data_15366 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Human eRF1 C-domain ; _BMRB_accession_number 15366 _BMRB_flat_file_name bmr15366.str _Entry_type original _Submission_date 2007-07-05 _Accession_date 2007-07-05 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details . loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Mantsyzov Alexey B. . 2 Polshakov Vladimir I. . 3 Birdsall Berry . . 4 Kisselev Lev L. . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 2 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 160 "13C chemical shifts" 315 "15N chemical shifts" 160 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2009-08-31 update BMRB 'correct entry citation' 2008-01-28 original author 'original release' stop_ loop_ _Related_BMRB_accession_number _Relationship 6116 'Human eRF1 N-domain' 6763 'Human eRF1 middle domain' stop_ _Original_release_date 2015-09-03 save_ ############################# # Citation for this entry # ############################# save_citation_1 _Saveframe_category entry_citation _Citation_full . _Citation_title ; NMR assignments of the C-terminal domain of human polypeptide release factor eRF1 ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 19636860 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Mantsyzov Alexey B. . 2 Ivanova Elena V. . 3 Birdsall Berry . . 4 Kolosov Petr M. . 5 Kisselev Lev L. . 6 Polshakov Vladimir I. . stop_ _Journal_abbreviation 'Biomol. NMR Assignments' _Journal_volume 1 _Journal_issue 2 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 183 _Page_last 185 _Year 2007 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'Human eRF1 C-domain' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'Human eRF1 C-domain' $C-domain_of_human_polypeptide_release_factor_eRF1 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_C-domain_of_human_polypeptide_release_factor_eRF1 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common C-domain_of_human_polypeptide_release_factor_eRF1 _Molecular_mass . _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 171 _Mol_residue_sequence ; MSNVKFIQEKKLIGRYFDEI SQDTGKYCFGVEDTLKALEM GAVEILIVYENLDIMRYVLH CQGTEEEKILYLTPEQEKDK SHFTDKETGQEHELIESMPL LEWFANNYKKFGATLEIVTD KSQEGSQFVKGFGGIGGILR YRVDFQGMEYQGGDDEFFDL DDYLEHHHHHH ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 275 MET 2 276 SER 3 277 ASN 4 278 VAL 5 279 LYS 6 280 PHE 7 281 ILE 8 282 GLN 9 283 GLU 10 284 LYS 11 285 LYS 12 286 LEU 13 287 ILE 14 288 GLY 15 289 ARG 16 290 TYR 17 291 PHE 18 292 ASP 19 293 GLU 20 294 ILE 21 295 SER 22 296 GLN 23 297 ASP 24 298 THR 25 299 GLY 26 300 LYS 27 301 TYR 28 302 CYS 29 303 PHE 30 304 GLY 31 305 VAL 32 306 GLU 33 307 ASP 34 308 THR 35 309 LEU 36 310 LYS 37 311 ALA 38 312 LEU 39 313 GLU 40 314 MET 41 315 GLY 42 316 ALA 43 317 VAL 44 318 GLU 45 319 ILE 46 320 LEU 47 321 ILE 48 322 VAL 49 323 TYR 50 324 GLU 51 325 ASN 52 326 LEU 53 327 ASP 54 328 ILE 55 329 MET 56 330 ARG 57 331 TYR 58 332 VAL 59 333 LEU 60 334 HIS 61 335 CYS 62 336 GLN 63 337 GLY 64 338 THR 65 339 GLU 66 340 GLU 67 341 GLU 68 342 LYS 69 343 ILE 70 344 LEU 71 345 TYR 72 346 LEU 73 347 THR 74 348 PRO 75 349 GLU 76 350 GLN 77 351 GLU 78 352 LYS 79 353 ASP 80 354 LYS 81 355 SER 82 356 HIS 83 357 PHE 84 358 THR 85 359 ASP 86 360 LYS 87 361 GLU 88 362 THR 89 363 GLY 90 364 GLN 91 365 GLU 92 366 HIS 93 367 GLU 94 368 LEU 95 369 ILE 96 370 GLU 97 371 SER 98 372 MET 99 373 PRO 100 374 LEU 101 375 LEU 102 376 GLU 103 377 TRP 104 378 PHE 105 379 ALA 106 380 ASN 107 381 ASN 108 382 TYR 109 383 LYS 110 384 LYS 111 385 PHE 112 386 GLY 113 387 ALA 114 388 THR 115 389 LEU 116 390 GLU 117 391 ILE 118 392 VAL 119 393 THR 120 394 ASP 121 395 LYS 122 396 SER 123 397 GLN 124 398 GLU 125 399 GLY 126 400 SER 127 401 GLN 128 402 PHE 129 403 VAL 130 404 LYS 131 405 GLY 132 406 PHE 133 407 GLY 134 408 GLY 135 409 ILE 136 410 GLY 137 411 GLY 138 412 ILE 139 413 LEU 140 414 ARG 141 415 TYR 142 416 ARG 143 417 VAL 144 418 ASP 145 419 PHE 146 420 GLN 147 421 GLY 148 422 MET 149 423 GLU 150 424 TYR 151 425 GLN 152 426 GLY 153 427 GLY 154 428 ASP 155 429 ASP 156 430 GLU 157 431 PHE 158 432 PHE 159 433 ASP 160 434 LEU 161 435 ASP 162 436 ASP 163 437 TYR 164 438 LEU 165 439 GLU 166 440 HIS 167 441 HIS 168 442 HIS 169 443 HIS 170 444 HIS 171 445 HIS stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-09-09 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 BMRB 19506 eRF1 100.00 445 99.42 100.00 5.52e-119 PDB 1DT9 "The Crystal Structure Of Human Eukaryotic Release Factor Erf1-Mechanism Of Stop Codon Recognition And Peptidyl-Trna Hydrolysis" 95.32 437 99.39 100.00 1.52e-111 PDB 2KTU 'Human Erf1 C-Domain, "closed" Conformer' 99.42 170 100.00 100.00 2.84e-119 PDB 2KTV 'Human Erf1 C-Domain, "open" Conformer' 99.42 170 100.00 100.00 2.84e-119 PDB 3E1Y "Crystal Structure Of Human Erf1ERF3 COMPLEX" 95.32 451 99.39 100.00 4.09e-111 PDB 3J5Y "Structure Of The Mammalian Ribosomal Pre-termination Complex Associated With Erf1-erf3-gdpnp" 85.38 414 99.32 100.00 6.85e-98 PDB 4D5N "Cryo-em Structures Of Ribosomal 80s Complexes With Termination Factors And Cricket Paralysis Virus Ires Reveal The Ires In The " 97.08 436 99.40 100.00 4.85e-114 PDB 4D61 "Cryo-em Structures Of Ribosomal 80s Complexes With Termination Factors And Cricket Paralysis Virus Ires Reveal The Ires In The " 97.08 436 99.40 100.00 4.85e-114 DBJ BAA13439 "eRF1 [Mus musculus]" 95.32 338 98.77 100.00 2.03e-111 DBJ BAA85489 "eukaryotic polypeptide chain release factor 1 [Oryctolagus cuniculus]" 95.32 437 99.39 100.00 1.52e-111 DBJ BAC33839 "unnamed protein product [Mus musculus]" 95.32 437 99.39 100.00 1.06e-111 DBJ BAE31210 "unnamed protein product [Mus musculus]" 95.32 387 99.39 100.00 1.08e-111 DBJ BAE31619 "unnamed protein product [Mus musculus]" 95.32 387 99.39 100.00 1.08e-111 EMBL CAA57281 "C11 protein [Homo sapiens]" 95.32 437 99.39 100.00 1.52e-111 EMBL CAA57282 "C11 protein [Mesocricetus auratus]" 95.32 437 99.39 100.00 1.52e-111 EMBL CAH93389 "hypothetical protein [Pongo abelii]" 95.32 437 98.77 99.39 1.99e-110 GB AAB49726 "eukaryotic release factor 1 [Homo sapiens]" 95.32 437 99.39 100.00 1.52e-111 GB AAD43966 "eRF1 [Homo sapiens]" 95.32 437 99.39 100.00 1.52e-111 GB AAH13717 "Eukaryotic translation termination factor 1 [Mus musculus]" 95.32 437 99.39 100.00 1.23e-111 GB AAH14269 "ETF1 protein [Homo sapiens]" 95.32 404 99.39 100.00 9.35e-112 GB AAH85902 "Eukaryotic translation termination factor 1 [Rattus norvegicus]" 95.32 437 99.39 100.00 1.52e-111 REF NP_001008345 "eukaryotic peptide chain release factor subunit 1 [Rattus norvegicus]" 95.32 437 99.39 100.00 1.52e-111 REF NP_001069722 "eukaryotic peptide chain release factor subunit 1 [Bos taurus]" 95.32 437 99.39 100.00 1.52e-111 REF NP_001076236 "eukaryotic peptide chain release factor subunit 1 [Oryctolagus cuniculus]" 95.32 437 99.39 100.00 1.52e-111 REF NP_001126989 "eukaryotic peptide chain release factor subunit 1 [Pongo abelii]" 95.32 437 98.77 99.39 1.99e-110 REF NP_001239075 "eukaryotic peptide chain release factor subunit 1 [Canis lupus familiaris]" 95.32 437 98.77 99.39 7.50e-111 SP P62495 "RecName: Full=Eukaryotic peptide chain release factor subunit 1; Short=Eukaryotic release factor 1; Short=eRF1; AltName: Full=P" 95.32 437 99.39 100.00 1.52e-111 SP P62496 "RecName: Full=Eukaryotic peptide chain release factor subunit 1; Short=Eukaryotic release factor 1; Short=Protein Cl1; Short=eR" 95.32 437 99.39 100.00 1.52e-111 SP P62497 "RecName: Full=Eukaryotic peptide chain release factor subunit 1; Short=Eukaryotic release factor 1; Short=eRF1" 95.32 437 99.39 100.00 1.52e-111 SP Q0VCX5 "RecName: Full=Eukaryotic peptide chain release factor subunit 1; Short=Eukaryotic release factor 1; Short=eRF1" 95.32 437 99.39 100.00 1.52e-111 SP Q5R4C7 "RecName: Full=Eukaryotic peptide chain release factor subunit 1; Short=Eukaryotic release factor 1; Short=eRF1" 95.32 437 98.77 99.39 1.99e-110 TPG DAA27419 "TPA: eukaryotic peptide chain release factor subunit 1 [Bos taurus]" 95.32 437 99.39 100.00 1.52e-111 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $C-domain_of_human_polypeptide_release_factor_eRF1 Human 9606 Eukaryota Metazoa Homo sapiens 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 $C-domain_of_human_polypeptide_release_factor_eRF1 'recombinant technology' . Escherichia coli BL21(DE3) pET23b(+) 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 $C-domain_of_human_polypeptide_release_factor_eRF1 1 mM 'natural abundance' 'potassium phosphate' 10 mM 'natural abundance' 'potassium chloride' 50 mM 'natural abundance' stop_ save_ save_sample_2 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $C-domain_of_human_polypeptide_release_factor_eRF1 1.1 mM '[U-99% 15N]' 'potassium phosphate' 10 mM 'natural abundance' 'potassium chloride' 20 mM 'natural abundance' stop_ save_ save_sample_3 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $C-domain_of_human_polypeptide_release_factor_eRF1 0.8 mM '[U-99% 13C; U-99% 15N]' 'potassium phosphate' 10 mM 'natural abundance' 'potassium chloride' 20 mM 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_VNMR _Saveframe_category software _Name VNMR _Version . loop_ _Vendor _Address _Electronic_address Varian . . stop_ loop_ _Task collection stop_ _Details . save_ save_xwinnmr _Saveframe_category software _Name xwinnmr _Version . loop_ _Vendor _Address _Electronic_address 'Bruker Biospin' . . stop_ loop_ _Task collection 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_ save_AutoAssign _Saveframe_category software _Name AutoAssign _Version . loop_ _Vendor _Address _Electronic_address 'Zimmerman, Moseley, Kulikowski and Montelione' . . stop_ loop_ _Task 'chemical shift assignment' stop_ _Details . save_ save_Pence _Saveframe_category software _Name Pence _Version . loop_ _Vendor _Address _Electronic_address 'Wishart and Sykes' . . 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 600 _Details . save_ save_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model INOVA _Field_strength 600 _Details . save_ save_spectrometer_3 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model INOVA _Field_strength 800 _Details . save_ ############################# # NMR applied experiments # ############################# save_2D_1H-15N_HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $sample_2 save_ save_2D_1H-13C_HSQC_2 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-13C HSQC' _Sample_label $sample_3 save_ save_3D_HNCA_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $sample_3 save_ save_3D_HNCACB_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_3 save_ save_3D_HN(CO)CA_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CO)CA' _Sample_label $sample_3 save_ save_3D_CBCA(CO)NH_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _Sample_label $sample_3 save_ save_3D_HBHA(CO)NH_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HBHA(CO)NH' _Sample_label $sample_3 save_ save_3D_HNCACB_8 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_3 save_ save_3D_HNCO_9 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $sample_3 save_ save_3D_HNHA_10 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNHA' _Sample_label $sample_2 save_ save_3D_1H-15N_NOESY_11 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N NOESY' _Sample_label $sample_2 save_ save_3D_1H-13C_NOESY_12 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-13C NOESY' _Sample_label $sample_3 save_ save_2D_DQF-COSY_13 _Saveframe_category NMR_applied_experiment _Experiment_name '2D DQF-COSY' _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' 0.08 . M pH 7.0 . 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 DSS C 13 'methyl protons' ppm 0.00 . indirect . . . 0.251449530 water H 1 'methyl protons' ppm 4.76 internal direct . . . 1.000000000 DSS N 15 'methyl protons' ppm 0.00 . 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 . loop_ _Experiment_label '2D 1H-15N HSQC' '2D 1H-13C HSQC' '3D HNCO' '3D 1H-15N NOESY' stop_ loop_ _Sample_label $sample_2 $sample_3 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name 'Human eRF1 C-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 1 277 3 ASN C C 175.643 0.05 1 2 277 3 ASN CA C 53.743 0.070 1 3 278 4 VAL H H 8.179 0.008 1 4 278 4 VAL C C 176.673 0.05 1 5 278 4 VAL CA C 64.769 0.045 1 6 278 4 VAL N N 120.268 0.102 1 7 279 5 LYS H H 8.196 0.005 1 8 279 5 LYS C C 177.629 0.05 1 9 279 5 LYS CA C 58.629 0.024 1 10 279 5 LYS N N 122.592 0.048 1 11 280 6 PHE H H 7.896 0.004 1 12 280 6 PHE C C 176.690 0.05 1 13 280 6 PHE CA C 59.896 0.113 1 14 280 6 PHE N N 119.116 0.067 1 15 281 7 ILE H H 7.792 0.005 1 16 281 7 ILE C C 177.751 0.05 1 17 281 7 ILE CA C 64.363 0.064 1 18 281 7 ILE N N 119.475 0.076 1 19 282 8 GLN H H 8.126 0.005 1 20 282 8 GLN C C 178.105 0.05 1 21 282 8 GLN CA C 59.113 0.048 1 22 282 8 GLN N N 119.854 0.073 1 23 283 9 GLU H H 8.238 0.005 1 24 283 9 GLU C C 177.072 0.05 1 25 283 9 GLU CA C 60.003 0.038 1 26 283 9 GLU N N 121.267 0.101 1 27 284 10 LYS H H 7.847 0.008 1 28 284 10 LYS C C 179.463 0.05 1 29 284 10 LYS CA C 60.535 0.095 1 30 284 10 LYS N N 118.413 0.084 1 31 285 11 LYS H H 7.945 0.006 1 32 285 11 LYS C C 178.738 0.05 1 33 285 11 LYS CA C 59.211 0.029 1 34 285 11 LYS N N 119.685 0.058 1 35 286 12 LEU H H 8.085 0.005 1 36 286 12 LEU C C 177.451 0.05 1 37 286 12 LEU CA C 58.082 0.091 1 38 286 12 LEU N N 122.192 0.057 1 39 287 13 ILE H H 8.223 0.006 1 40 287 13 ILE C C 177.250 0.05 1 41 287 13 ILE CA C 64.208 0.046 1 42 287 13 ILE N N 117.423 0.058 1 43 288 14 GLY H H 8.003 0.006 1 44 288 14 GLY C C 175.405 0.05 1 45 288 14 GLY CA C 47.791 0.05 1 46 288 14 GLY N N 107.036 0.089 1 47 289 15 ARG H H 7.622 0.005 1 48 289 15 ARG C C 178.033 0.05 1 49 289 15 ARG CA C 59.675 0.108 1 50 289 15 ARG N N 122.102 0.072 1 51 290 16 TYR H H 7.640 0.011 1 52 290 16 TYR C C 175.996 0.05 1 53 290 16 TYR CA C 62.547 0.095 1 54 290 16 TYR N N 122.075 0.067 1 55 291 17 PHE H H 8.627 0.007 1 56 291 17 PHE C C 178.803 0.05 1 57 291 17 PHE CA C 58.279 0.121 1 58 291 17 PHE N N 115.689 0.104 1 59 292 18 ASP H H 8.447 0.004 1 60 292 18 ASP CA C 57.734 0.081 1 61 292 18 ASP N N 122.535 0.074 1 62 293 19 GLU H H 7.741 0.005 1 63 293 19 GLU C C 178.355 0.05 1 64 293 19 GLU CA C 58.772 0.038 1 65 293 19 GLU N N 119.495 0.014 1 66 294 20 ILE H H 6.913 0.008 1 67 294 20 ILE C C 180.271 0.05 1 68 294 20 ILE CA C 65.383 0.058 1 69 294 20 ILE N N 117.096 0.076 1 70 295 21 SER H H 8.583 0.005 1 71 295 21 SER C C 175.921 0.05 1 72 295 21 SER CA C 61.683 0.058 1 73 295 21 SER N N 116.672 0.062 1 74 296 22 GLN H H 7.911 0.006 1 75 296 22 GLN CA C 56.561 0.277 1 76 296 22 GLN N N 117.620 0.104 1 77 297 23 ASP C C 175.997 0.05 1 78 297 23 ASP CA C 55.400 0.080 1 79 298 24 THR H H 8.154 0.005 1 80 298 24 THR C C 176.618 0.05 1 81 298 24 THR CA C 62.954 0.080 1 82 298 24 THR N N 107.009 0.093 1 83 299 25 GLY H H 8.434 0.005 1 84 299 25 GLY C C 174.021 0.05 1 85 299 25 GLY N N 107.892 0.119 1 86 300 26 LYS H H 8.154 0.006 1 87 300 26 LYS C C 174.206 0.05 1 88 300 26 LYS CA C 55.905 0.091 1 89 300 26 LYS N N 121.435 0.067 1 90 301 27 TYR H H 7.148 0.005 1 91 301 27 TYR C C 171.917 0.05 1 92 301 27 TYR CA C 55.676 0.069 1 93 301 27 TYR N N 115.569 0.076 1 94 302 28 CYS H H 8.797 0.006 1 95 302 28 CYS C C 173.866 0.05 1 96 302 28 CYS CA C 55.508 0.097 1 97 302 28 CYS N N 112.306 0.071 1 98 303 29 PHE H H 9.295 0.004 1 99 303 29 PHE C C 174.441 0.05 1 100 303 29 PHE CA C 57.411 0.061 1 101 303 29 PHE N N 121.483 0.063 1 102 304 30 GLY H H 8.353 0.007 1 103 304 30 GLY C C 174.305 0.05 1 104 304 30 GLY CA C 44.562 0.020 1 105 304 30 GLY N N 105.278 0.069 1 106 305 31 VAL H H 8.864 0.004 1 107 305 31 VAL C C 175.518 0.05 1 108 305 31 VAL CA C 68.247 0.076 1 109 305 31 VAL N N 122.000 0.043 1 110 306 32 GLU H H 8.429 0.003 1 111 306 32 GLU C C 179.593 0.05 1 112 306 32 GLU CA C 61.242 0.049 1 113 306 32 GLU N N 118.227 0.083 1 114 307 33 ASP H H 9.174 0.004 1 115 307 33 ASP C C 177.686 0.05 1 116 307 33 ASP CA C 57.328 0.088 1 117 307 33 ASP N N 119.840 0.042 1 118 308 34 THR H H 7.187 0.003 1 119 308 34 THR C C 175.915 0.05 1 120 308 34 THR CA C 67.246 0.181 1 121 308 34 THR N N 115.077 0.047 1 122 309 35 LEU H H 8.196 0.005 1 123 309 35 LEU C C 178.983 0.05 1 124 309 35 LEU CA C 57.708 0.064 1 125 309 35 LEU N N 122.220 0.030 1 126 310 36 LYS H H 7.592 0.005 1 127 310 36 LYS C C 178.652 0.05 1 128 310 36 LYS CA C 59.713 0.083 1 129 310 36 LYS N N 119.027 0.046 1 130 311 37 ALA H H 8.411 0.007 1 131 311 37 ALA C C 179.220 0.05 1 132 311 37 ALA CA C 55.395 0.036 1 133 311 37 ALA N N 120.898 0.052 1 134 312 38 LEU H H 8.653 0.004 1 135 312 38 LEU C C 179.896 0.05 1 136 312 38 LEU CA C 57.581 0.025 1 137 312 38 LEU N N 120.361 0.071 1 138 313 39 GLU H H 8.035 0.006 1 139 313 39 GLU C C 178.015 0.05 1 140 313 39 GLU CA C 59.622 0.066 1 141 313 39 GLU CB C 29.638 0.008 1 142 313 39 GLU N N 118.772 0.055 1 143 314 40 MET H H 7.664 0.005 1 144 314 40 MET C C 176.268 0.05 1 145 314 40 MET CA C 57.067 0.072 1 146 314 40 MET N N 114.924 0.081 1 147 315 41 GLY H H 8.196 0.005 1 148 315 41 GLY C C 175.290 0.05 1 149 315 41 GLY CA C 46.390 0.047 1 150 315 41 GLY N N 108.073 0.105 1 151 316 42 ALA H H 7.992 0.006 1 152 316 42 ALA C C 176.413 0.05 1 153 316 42 ALA CA C 52.979 0.095 1 154 316 42 ALA N N 119.240 0.069 1 155 317 43 VAL H H 8.313 0.005 1 156 317 43 VAL C C 174.159 0.05 1 157 317 43 VAL CA C 64.232 0.109 1 158 317 43 VAL N N 119.589 0.043 1 159 318 44 GLU H H 9.120 0.007 1 160 318 44 GLU C C 176.442 0.05 1 161 318 44 GLU CA C 58.410 0.113 1 162 318 44 GLU N N 128.844 0.098 1 163 319 45 ILE H H 7.538 0.006 1 164 319 45 ILE C C 172.876 0.05 1 165 319 45 ILE CA C 60.315 0.112 1 166 319 45 ILE N N 116.643 0.095 1 167 320 46 LEU H H 8.998 0.004 1 168 320 46 LEU C C 172.052 0.05 1 169 320 46 LEU CA C 53.944 0.076 1 170 320 46 LEU N N 131.132 0.134 1 171 321 47 ILE H H 8.828 0.003 1 172 321 47 ILE C C 174.303 0.05 1 173 321 47 ILE CA C 60.977 0.046 1 174 321 47 ILE N N 127.620 0.088 1 175 322 48 VAL H H 8.394 0.007 1 176 322 48 VAL C C 174.500 0.05 1 177 322 48 VAL CA C 60.001 0.174 1 178 322 48 VAL N N 122.219 0.046 1 179 323 49 TYR H H 9.095 0.005 1 180 323 49 TYR C C 175.980 0.05 1 181 323 49 TYR CA C 55.311 0.094 1 182 323 49 TYR N N 127.013 0.078 1 183 324 50 GLU H H 9.022 0.006 1 184 324 50 GLU CA C 58.611 0.05 1 185 324 50 GLU N N 126.546 0.072 1 186 327 53 ASP C C 175.006 0.05 1 187 327 53 ASP CA C 53.709 0.103 1 188 328 54 ILE H H 6.613 0.004 1 189 328 54 ILE C C 175.197 0.05 1 190 328 54 ILE CA C 60.644 0.151 1 191 328 54 ILE N N 116.986 0.050 1 192 329 55 MET H H 9.401 0.010 1 193 329 55 MET C C 173.249 0.05 1 194 329 55 MET CA C 53.448 0.067 1 195 329 55 MET N N 129.245 0.097 1 196 330 56 ARG H H 8.952 0.005 1 197 330 56 ARG C C 174.275 0.05 1 198 330 56 ARG CA C 54.773 0.151 1 199 330 56 ARG N N 124.843 0.081 1 200 331 57 TYR H H 9.180 0.007 1 201 331 57 TYR C C 173.756 0.05 1 202 331 57 TYR CA C 57.654 0.045 1 203 331 57 TYR N N 127.490 0.049 1 204 332 58 VAL H H 8.707 0.005 1 205 332 58 VAL C C 174.526 0.05 1 206 332 58 VAL CA C 62.044 0.117 1 207 332 58 VAL N N 120.016 0.074 1 208 333 59 LEU H H 9.332 0.007 9 209 333 59 LEU C C 176.160 0.05 9 210 333 59 LEU CA C 53.277 0.067 9 211 333 59 LEU N N 126.621 0.067 9 212 334 60 HIS H H 9.233 0.005 1 213 334 60 HIS C C 174.385 0.05 1 214 334 60 HIS CA C 53.791 0.174 1 215 334 60 HIS N N 118.941 0.066 1 216 335 61 CYS H H 8.652 0.004 1 217 335 61 CYS CA C 55.387 0.038 1 218 335 61 CYS N N 124.961 0.050 1 219 336 62 GLN C C 177.325 0.05 1 220 336 62 GLN CA C 57.940 0.086 1 221 337 63 GLY H H 9.058 0.008 9 222 337 63 GLY C C 174.318 0.05 9 223 337 63 GLY CA C 46.452 0.053 9 224 337 63 GLY N N 112.997 0.092 9 225 338 64 THR H H 7.810 0.005 9 226 338 64 THR C C 174.222 0.05 9 227 338 64 THR CA C 61.191 0.037 9 228 338 64 THR N N 111.333 0.070 9 229 339 65 GLU H H 8.364 0.006 9 230 339 65 GLU C C 175.132 0.05 9 231 339 65 GLU CA C 56.840 0.061 9 232 339 65 GLU N N 117.565 0.052 9 233 340 66 GLU H H 7.903 0.004 9 234 340 66 GLU CA C 56.830 0.063 9 235 340 66 GLU N N 120.127 0.067 9 236 341 67 GLU H H 8.373 0.003 9 237 341 67 GLU C C 175.253 0.05 9 238 341 67 GLU CA C 55.584 0.085 9 239 341 67 GLU N N 122.832 0.077 9 240 342 68 LYS H H 8.817 0.005 9 241 342 68 LYS C C 173.245 0.05 9 242 342 68 LYS CA C 55.035 0.083 9 243 342 68 LYS N N 126.133 0.018 9 244 343 69 ILE H H 8.323 0.016 1 245 343 69 ILE C C 175.228 0.05 1 246 343 69 ILE CA C 59.761 0.075 1 247 343 69 ILE N N 125.104 0.064 1 248 344 70 LEU H H 8.950 0.004 9 249 344 70 LEU C C 173.996 0.05 9 250 344 70 LEU CA C 53.050 0.079 9 251 344 70 LEU N N 126.626 0.070 9 252 345 71 TYR H H 8.405 0.004 1 253 345 71 TYR C C 174.921 0.05 1 254 345 71 TYR CA C 56.475 0.093 1 255 345 71 TYR N N 120.500 0.050 1 256 346 72 LEU H H 8.835 0.006 1 257 346 72 LEU C C 176.976 0.05 1 258 346 72 LEU CA C 53.393 0.068 1 259 346 72 LEU N N 121.535 0.055 1 260 347 73 THR H H 8.907 0.007 1 261 347 73 THR CA C 60.671 0.185 1 262 347 73 THR N N 114.842 0.067 1 263 348 74 PRO C C 179.261 0.05 1 264 348 74 PRO CA C 65.914 0.128 1 265 349 75 GLU H H 8.092 0.004 1 266 349 75 GLU CA C 59.560 0.034 1 267 349 75 GLU N N 115.220 0.076 1 268 350 76 GLN H H 7.740 0.006 1 269 350 76 GLN C C 178.096 0.05 1 270 350 76 GLN CA C 58.625 0.135 1 271 350 76 GLN N N 119.478 0.082 1 272 351 77 GLU H H 8.213 0.010 1 273 351 77 GLU C C 175.707 0.05 1 274 351 77 GLU CA C 59.269 0.038 1 275 351 77 GLU N N 116.674 0.066 1 276 352 78 LYS H H 6.997 0.006 1 277 352 78 LYS C C 175.852 0.05 1 278 352 78 LYS CA C 57.240 0.065 1 279 352 78 LYS N N 114.106 0.063 1 280 353 79 ASP H H 7.789 0.005 1 281 353 79 ASP C C 175.371 0.05 1 282 353 79 ASP CA C 53.214 0.082 1 283 353 79 ASP N N 119.936 0.068 1 284 354 80 LYS H H 8.449 0.005 1 285 354 80 LYS C C 178.745 0.05 1 286 354 80 LYS CA C 57.709 0.040 1 287 354 80 LYS N N 122.309 0.092 1 288 355 81 SER H H 8.691 0.008 1 289 355 81 SER C C 176.082 0.05 1 290 355 81 SER CA C 61.882 0.036 1 291 355 81 SER N N 118.397 0.059 1 292 356 82 HIS H H 6.932 0.007 1 293 356 82 HIS C C 175.005 0.05 1 294 356 82 HIS CA C 58.759 0.090 1 295 356 82 HIS N N 117.489 0.118 1 296 357 83 PHE H H 7.386 0.014 1 297 357 83 PHE C C 173.938 0.05 1 298 357 83 PHE CA C 57.688 0.126 1 299 357 83 PHE N N 112.492 0.194 1 300 358 84 THR H H 7.205 0.004 9 301 358 84 THR C C 172.179 0.05 9 302 358 84 THR CA C 61.036 0.040 9 303 358 84 THR N N 113.136 0.041 9 304 359 85 ASP H H 8.368 0.010 1 305 359 85 ASP C C 176.741 0.05 1 306 359 85 ASP CA C 54.372 0.086 1 307 359 85 ASP N N 124.534 0.049 1 308 360 86 LYS H H 8.924 0.007 1 309 360 86 LYS C C 177.392 0.05 1 310 360 86 LYS CA C 59.209 0.018 1 311 360 86 LYS N N 128.502 0.093 1 312 361 87 GLU H H 8.444 0.020 1 313 361 87 GLU C C 178.095 0.05 1 314 361 87 GLU CA C 58.935 0.074 1 315 361 87 GLU N N 117.241 0.077 1 316 362 88 THR H H 8.033 0.016 9 317 362 88 THR C C 176.512 0.05 9 318 362 88 THR CA C 62.332 0.125 9 319 362 88 THR N N 106.387 0.060 9 320 363 89 GLY H H 8.275 0.006 1 321 363 89 GLY C C 174.019 0.05 1 322 363 89 GLY CA C 46.013 0.070 1 323 363 89 GLY N N 111.262 0.082 1 324 364 90 GLN H H 8.165 0.134 1 325 364 90 GLN C C 175.882 0.05 1 326 364 90 GLN CA C 56.140 0.074 1 327 364 90 GLN N N 119.624 0.249 1 328 365 91 GLU H H 8.494 0.005 1 329 365 91 GLU CA C 56.864 0.075 1 330 365 91 GLU N N 121.578 0.068 1 331 370 96 GLU C C 173.153 0.05 1 332 370 96 GLU CA C 55.770 0.016 1 333 371 97 SER H H 8.344 0.005 1 334 371 97 SER C C 172.407 0.05 1 335 371 97 SER CA C 56.931 0.084 1 336 371 97 SER N N 115.247 0.090 1 337 372 98 MET H H 8.413 0.006 1 338 372 98 MET CA C 54.707 0.111 1 339 372 98 MET N N 119.486 0.105 1 340 373 99 PRO C C 177.743 0.05 1 341 373 99 PRO CA C 64.243 0.109 1 342 374 100 LEU H H 9.248 0.005 1 343 374 100 LEU C C 177.152 0.05 1 344 374 100 LEU CA C 57.962 0.063 1 345 374 100 LEU N N 128.094 0.060 1 346 375 101 LEU H H 9.229 0.009 1 347 375 101 LEU C C 177.860 0.05 1 348 375 101 LEU CA C 59.669 0.099 1 349 375 101 LEU N N 117.927 0.055 1 350 376 102 GLU H H 6.753 0.004 1 351 376 102 GLU CA C 59.239 0.100 1 352 376 102 GLU N N 117.869 0.079 1 353 377 103 TRP H H 8.182 0.008 1 354 377 103 TRP C C 180.847 0.05 1 355 377 103 TRP CA C 64.080 0.057 1 356 377 103 TRP N N 121.300 0.082 1 357 378 104 PHE H H 9.487 0.004 1 358 378 104 PHE C C 178.065 0.05 1 359 378 104 PHE CA C 59.869 0.073 1 360 378 104 PHE N N 118.960 0.051 1 361 379 105 ALA H H 8.487 0.005 1 362 379 105 ALA C C 178.586 0.05 1 363 379 105 ALA CA C 56.145 0.082 1 364 379 105 ALA N N 121.732 0.103 1 365 380 106 ASN H H 7.705 0.004 1 366 380 106 ASN C C 176.172 0.05 1 367 380 106 ASN CA C 54.350 0.072 1 368 380 106 ASN N N 112.529 0.066 1 369 381 107 ASN H H 7.504 0.004 1 370 381 107 ASN C C 175.241 0.05 1 371 381 107 ASN CA C 55.073 0.124 1 372 381 107 ASN N N 115.133 0.077 1 373 382 108 TYR H H 8.463 0.005 1 374 382 108 TYR C C 175.842 0.05 1 375 382 108 TYR CA C 62.715 0.077 1 376 382 108 TYR N N 118.059 0.125 1 377 383 109 LYS H H 7.213 0.008 1 378 383 109 LYS C C 179.922 0.05 1 379 383 109 LYS CA C 59.155 0.054 1 380 383 109 LYS N N 120.250 0.089 1 381 384 110 LYS H H 7.516 0.005 1 382 384 110 LYS C C 176.813 0.05 1 383 384 110 LYS CA C 58.573 0.086 1 384 384 110 LYS N N 119.601 0.036 1 385 385 111 PHE H H 7.097 0.005 1 386 385 111 PHE C C 176.393 0.05 1 387 385 111 PHE CA C 57.135 0.078 1 388 385 111 PHE N N 115.345 0.071 1 389 386 112 GLY H H 7.812 0.004 1 390 386 112 GLY C C 172.623 0.05 1 391 386 112 GLY CA C 46.702 0.026 1 392 386 112 GLY N N 107.189 0.050 1 393 387 113 ALA H H 6.901 0.004 1 394 387 113 ALA C C 176.438 0.05 1 395 387 113 ALA CA C 50.946 0.066 1 396 387 113 ALA N N 119.620 0.062 1 397 388 114 THR H H 7.579 0.004 1 398 388 114 THR C C 171.809 0.05 1 399 388 114 THR CA C 62.596 0.116 1 400 388 114 THR N N 113.578 0.072 1 401 389 115 LEU H H 7.363 0.012 1 402 389 115 LEU C C 174.129 0.05 1 403 389 115 LEU CA C 54.229 0.044 1 404 389 115 LEU N N 127.407 0.070 1 405 390 116 GLU H H 9.079 0.006 1 406 390 116 GLU C C 173.063 0.05 1 407 390 116 GLU CA C 54.724 0.141 1 408 390 116 GLU N N 128.926 0.077 1 409 391 117 ILE H H 8.231 0.005 1 410 391 117 ILE C C 177.394 0.05 1 411 391 117 ILE CA C 59.416 0.034 1 412 391 117 ILE N N 124.243 0.102 1 413 392 118 VAL H H 8.600 0.004 1 414 392 118 VAL C C 174.227 0.05 1 415 392 118 VAL CA C 59.190 0.124 1 416 392 118 VAL N N 119.663 0.058 1 417 393 119 THR H H 8.944 0.003 1 418 393 119 THR C C 172.743 0.05 1 419 393 119 THR CA C 60.847 0.065 1 420 393 119 THR N N 114.502 0.067 1 421 394 120 ASP H H 8.621 0.004 1 422 394 120 ASP C C 176.805 0.05 1 423 394 120 ASP CA C 52.568 0.023 1 424 394 120 ASP N N 114.977 0.097 1 425 395 121 LYS H H 8.457 0.007 1 426 395 121 LYS C C 177.874 0.05 1 427 395 121 LYS CA C 58.132 0.118 1 428 395 121 LYS N N 117.005 0.051 1 429 396 122 SER H H 7.532 0.009 1 430 396 122 SER CA C 57.368 0.049 1 431 396 122 SER N N 111.565 0.070 1 432 397 123 GLN C C 178.421 0.05 1 433 397 123 GLN CA C 59.918 0.154 1 434 398 124 GLU H H 10.120 0.009 1 435 398 124 GLU C C 177.911 0.05 1 436 398 124 GLU CA C 61.809 0.136 1 437 398 124 GLU N N 120.774 0.048 1 438 399 125 GLY H H 8.726 0.006 1 439 399 125 GLY C C 175.528 0.05 1 440 399 125 GLY CA C 47.570 0.112 1 441 399 125 GLY N N 109.884 0.057 1 442 400 126 SER H H 8.485 0.008 1 443 400 126 SER C C 176.855 0.05 1 444 400 126 SER CA C 62.637 0.246 1 445 400 126 SER N N 116.093 0.078 1 446 401 127 GLN H H 8.230 0.006 1 447 401 127 GLN C C 179.008 0.05 1 448 401 127 GLN CA C 59.140 0.059 1 449 401 127 GLN N N 120.075 0.065 1 450 402 128 PHE H H 8.944 0.005 1 451 402 128 PHE C C 177.223 0.05 1 452 402 128 PHE CA C 61.695 0.127 1 453 402 128 PHE N N 122.533 0.048 1 454 403 129 VAL H H 8.305 0.006 1 455 403 129 VAL C C 177.342 0.05 1 456 403 129 VAL CA C 67.705 0.095 1 457 403 129 VAL N N 120.024 0.088 1 458 404 130 LYS H H 8.305 0.004 1 459 404 130 LYS C C 178.589 0.05 1 460 404 130 LYS CA C 59.320 0.043 1 461 404 130 LYS N N 117.471 0.068 1 462 405 131 GLY H H 8.584 0.004 1 463 405 131 GLY C C 174.236 0.05 1 464 405 131 GLY CA C 45.925 0.081 1 465 405 131 GLY N N 104.885 0.078 1 466 406 132 PHE H H 6.967 0.006 1 467 406 132 PHE C C 174.771 0.05 1 468 406 132 PHE CA C 58.389 0.136 1 469 406 132 PHE N N 116.027 0.098 1 470 407 133 GLY H H 7.219 0.003 1 471 407 133 GLY C C 175.189 0.05 1 472 407 133 GLY CA C 46.234 0.011 1 473 407 133 GLY N N 105.107 0.063 1 474 408 134 GLY H H 7.123 0.004 1 475 408 134 GLY C C 170.332 0.05 1 476 408 134 GLY CA C 46.601 0.078 1 477 408 134 GLY N N 103.265 0.101 1 478 409 135 ILE H H 6.859 0.004 1 479 409 135 ILE C C 172.300 0.05 1 480 409 135 ILE CA C 59.463 0.090 1 481 409 135 ILE N N 115.376 0.079 1 482 410 136 GLY H H 8.948 0.006 1 483 410 136 GLY C C 169.980 0.05 1 484 410 136 GLY CA C 46.595 0.053 1 485 410 136 GLY N N 113.425 0.073 1 486 411 137 GLY H H 8.294 0.006 1 487 411 137 GLY C C 171.805 0.05 1 488 411 137 GLY CA C 45.499 0.092 1 489 411 137 GLY N N 106.307 0.105 1 490 412 138 ILE H H 8.821 0.008 1 491 412 138 ILE C C 176.057 0.05 1 492 412 138 ILE CA C 61.622 0.052 1 493 412 138 ILE N N 120.713 0.076 1 494 413 139 LEU H H 8.306 0.005 1 495 413 139 LEU C C 176.175 0.05 1 496 413 139 LEU CA C 53.555 0.071 1 497 413 139 LEU N N 126.364 0.076 1 498 414 140 ARG H H 8.811 0.005 1 499 414 140 ARG C C 175.155 0.05 1 500 414 140 ARG CA C 57.471 0.106 1 501 414 140 ARG N N 116.650 0.090 1 502 415 141 TYR H H 7.022 0.004 1 503 415 141 TYR C C 171.993 0.05 1 504 415 141 TYR CA C 54.814 0.114 1 505 415 141 TYR N N 111.894 0.101 1 506 416 142 ARG H H 8.458 0.004 1 507 416 142 ARG C C 175.598 0.05 1 508 416 142 ARG CA C 57.446 0.030 1 509 416 142 ARG N N 117.614 0.099 1 510 417 143 VAL H H 7.692 0.005 1 511 417 143 VAL C C 173.449 0.05 1 512 417 143 VAL CA C 61.836 0.078 1 513 417 143 VAL N N 124.334 0.065 1 514 418 144 ASP H H 8.237 0.004 1 515 418 144 ASP CA C 53.179 0.079 1 516 418 144 ASP N N 124.148 0.052 1 517 419 145 PHE H H 8.363 0.004 1 518 419 145 PHE C C 176.215 0.05 1 519 419 145 PHE CA C 59.787 0.091 1 520 419 145 PHE N N 122.943 0.033 1 521 420 146 GLN H H 8.484 0.005 1 522 420 146 GLN C C 176.384 0.05 1 523 420 146 GLN CA C 57.016 0.070 1 524 420 146 GLN N N 119.500 0.057 1 525 421 147 GLY H H 8.303 0.006 1 526 421 147 GLY C C 173.319 0.05 1 527 421 147 GLY CA C 46.036 0.041 1 528 421 147 GLY N N 109.408 0.067 1 529 422 148 MET H H 7.675 0.009 1 530 422 148 MET C C 174.954 0.05 1 531 422 148 MET CA C 55.461 0.072 1 532 422 148 MET N N 118.659 0.075 1 533 423 149 GLU H H 8.720 0.004 1 534 423 149 GLU C C 175.690 0.05 1 535 423 149 GLU CA C 57.001 0.096 1 536 423 149 GLU N N 122.351 0.080 1 537 424 150 TYR H H 8.247 0.004 1 538 424 150 TYR C C 175.314 0.05 1 539 424 150 TYR CA C 58.481 0.105 1 540 424 150 TYR N N 121.720 0.106 1 541 425 151 GLN H H 8.270 0.004 1 542 425 151 GLN C C 175.447 0.05 1 543 425 151 GLN CA C 55.748 0.028 1 544 425 151 GLN N N 123.575 0.058 1 545 426 152 GLY H H 7.638 0.008 1 546 426 152 GLY C C 173.887 0.05 1 547 426 152 GLY CA C 45.646 0.064 1 548 426 152 GLY N N 109.054 0.083 1 549 427 153 GLY H H 8.271 0.005 1 550 427 153 GLY C C 173.688 0.05 1 551 427 153 GLY CA C 45.593 0.075 1 552 427 153 GLY N N 108.583 0.068 1 553 428 154 ASP H H 8.352 0.004 1 554 428 154 ASP C C 175.691 0.05 1 555 428 154 ASP CA C 54.874 0.085 1 556 428 154 ASP N N 120.334 0.054 1 557 429 155 ASP H H 8.303 0.005 1 558 429 155 ASP C C 175.771 0.05 1 559 429 155 ASP CA C 54.859 0.076 1 560 429 155 ASP N N 119.937 0.094 1 561 430 156 GLU H H 8.201 0.005 1 562 430 156 GLU C C 175.488 0.05 1 563 430 156 GLU CA C 57.073 0.061 1 564 430 156 GLU N N 120.612 0.056 1 565 431 157 PHE H H 8.126 0.004 1 566 431 157 PHE C C 174.688 0.05 1 567 431 157 PHE CA C 57.712 0.034 1 568 431 157 PHE N N 120.344 0.086 1 569 432 158 PHE H H 8.028 0.006 1 570 432 158 PHE C C 174.199 0.05 1 571 432 158 PHE CA C 58.017 0.091 1 572 432 158 PHE N N 122.279 0.095 1 573 433 159 ASP H H 8.196 0.007 1 574 433 159 ASP C C 175.452 0.05 1 575 433 159 ASP CA C 53.889 0.044 1 576 433 159 ASP N N 122.715 0.062 1 577 434 160 LEU H H 8.156 0.006 1 578 434 160 LEU C C 177.136 0.05 1 579 434 160 LEU CA C 56.571 0.102 1 580 434 160 LEU N N 123.808 0.093 1 581 435 161 ASP H H 8.248 0.005 1 582 435 161 ASP C C 176.689 0.05 1 583 435 161 ASP CA C 56.200 0.045 1 584 435 161 ASP N N 119.686 0.040 1 585 436 162 ASP H H 8.089 0.003 1 586 436 162 ASP C C 176.568 0.05 1 587 436 162 ASP CA C 55.741 0.045 1 588 436 162 ASP N N 120.028 0.059 1 589 437 163 TYR H H 8.042 0.003 1 590 437 163 TYR CA C 60.080 0.134 1 591 437 163 TYR N N 120.180 0.063 1 592 438 164 LEU H H 8.205 0.009 1 593 438 164 LEU C C 177.579 0.05 1 594 438 164 LEU CA C 56.528 0.181 1 595 438 164 LEU N N 121.117 0.082 1 596 439 165 GLU H H 8.026 0.005 1 597 439 165 GLU C C 176.496 0.05 1 598 439 165 GLU CA C 57.663 0.055 1 599 439 165 GLU N N 119.127 0.056 1 600 440 166 HIS H H 7.927 0.007 1 601 440 166 HIS CA C 56.776 0.018 1 602 440 166 HIS N N 116.969 0.089 1 stop_ save_ save_assigned_chem_shift_list_2 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '2D 1H-15N HSQC' '3D HNCA' '3D HNCO' '3D 1H-15N NOESY' stop_ loop_ _Sample_label $sample_2 $sample_3 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name 'Human eRF1 C-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 1 333 59 LEU H H 9.262 0.001 9 2 333 59 LEU CA C 53.322 0.007 9 3 333 59 LEU N N 126.597 0.025 9 4 337 63 GLY H H 9.000 0.002 9 5 337 63 GLY CA C 46.366 0.024 9 6 337 63 GLY N N 111.711 0.018 9 7 338 64 THR H H 7.707 0.003 9 8 338 64 THR CA C 61.372 0.012 9 9 338 64 THR N N 111.530 0.012 9 10 339 65 GLU H H 8.283 0.016 9 11 339 65 GLU C C 175.327 0.05 9 12 339 65 GLU CA C 57.271 0.014 9 13 339 65 GLU N N 119.147 0.099 9 14 340 66 GLU H H 7.781 0.004 9 15 340 66 GLU C C 175.370 0.05 9 16 340 66 GLU CA C 56.781 0.007 9 17 340 66 GLU N N 119.336 0.080 9 18 341 67 GLU H H 8.582 0.006 9 19 341 67 GLU C C 175.251 0.05 9 20 341 67 GLU CA C 56.398 0.014 9 21 341 67 GLU N N 124.000 0.05 9 22 342 68 LYS H H 8.772 0.003 9 23 342 68 LYS CA C 54.880 0.033 9 24 342 68 LYS N N 125.517 0.062 9 25 344 70 LEU H H 8.866 0.02 9 26 344 70 LEU CA C 53.054 0.086 9 27 344 70 LEU N N 126.485 0.036 9 28 358 84 THR H H 7.303 0.002 9 29 358 84 THR CA C 61.100 0.022 9 30 358 84 THR N N 113.329 0.037 9 31 362 88 THR H H 8.057 0.002 9 32 362 88 THR CA C 62.404 0.087 9 33 362 88 THR N N 106.361 0.034 9 stop_ save_