data_17589 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Backbone Resonance Assignments for Prp24-RRM3 ; _BMRB_accession_number 17589 _BMRB_flat_file_name bmr17589.str _Entry_type original _Submission_date 2011-04-12 _Accession_date 2011-04-12 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details 'Resonances assignments for RRM3: residues 208-291 of Prp24' loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Martin-Tumasz Stephen A. . 2 Butcher Samuel E. . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 84 "13C chemical shifts" 253 "15N chemical shifts" 84 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2012-03-08 update BMRB 'update entry citation' 2011-06-22 original author 'original release' stop_ loop_ _Related_BMRB_accession_number _Relationship 16230 'Prp24-2 + RNA' 16243 Prp24-23 16244 'Prp24-23 + RNA' 16246 Prp24-2 17490 Prp24-L4W 17491 Prp24-L4C 7070 Prp24-12 stop_ save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title 'A novel occluded RNA recognition motif in Prp24 unwinds the U6 RNA internal stem loop.' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 21653550 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Martin-Tumasz Stephen . . 2 Richie Ashley C. . 3 Clos Lawrence J. 2nd 4 Brow David A. . 5 Butcher Samuel E. . stop_ _Journal_abbreviation 'Nucleic Acids Res.' _Journal_name_full 'Nucleic acids research' _Journal_volume 39 _Journal_issue 17 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 7837 _Page_last 7847 _Year 2011 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name Prp24-RRM3 _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label RRM3 $RRM3 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_RRM3 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common RRM3 _Molecular_mass . _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 93 _Mol_residue_sequence ; MEGREIMIRNLSTELLDENL LRESFEGFGSIEKINIPAGQ KEHSFNNCCAFMVFENKDSA ERALQMNRSLLGNREISVSL ADKKPLWHHHHHH ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 207 MET 2 208 GLU 3 209 GLY 4 210 ARG 5 211 GLU 6 212 ILE 7 213 MET 8 214 ILE 9 215 ARG 10 216 ASN 11 217 LEU 12 218 SER 13 219 THR 14 220 GLU 15 221 LEU 16 222 LEU 17 223 ASP 18 224 GLU 19 225 ASN 20 226 LEU 21 227 LEU 22 228 ARG 23 229 GLU 24 230 SER 25 231 PHE 26 232 GLU 27 233 GLY 28 234 PHE 29 235 GLY 30 236 SER 31 237 ILE 32 238 GLU 33 239 LYS 34 240 ILE 35 241 ASN 36 242 ILE 37 243 PRO 38 244 ALA 39 245 GLY 40 246 GLN 41 247 LYS 42 248 GLU 43 249 HIS 44 250 SER 45 251 PHE 46 252 ASN 47 253 ASN 48 254 CYS 49 255 CYS 50 256 ALA 51 257 PHE 52 258 MET 53 259 VAL 54 260 PHE 55 261 GLU 56 262 ASN 57 263 LYS 58 264 ASP 59 265 SER 60 266 ALA 61 267 GLU 62 268 ARG 63 269 ALA 64 270 LEU 65 271 GLN 66 272 MET 67 273 ASN 68 274 ARG 69 275 SER 70 276 LEU 71 277 LEU 72 278 GLY 73 279 ASN 74 280 ARG 75 281 GLU 76 282 ILE 77 283 SER 78 284 VAL 79 285 SER 80 286 LEU 81 287 ALA 82 288 ASP 83 289 LYS 84 290 LYS 85 291 PRO 86 292 LEU 87 293 TRP 88 294 HIS 89 295 HIS 90 296 HIS 91 297 HIS 92 298 HIS 93 299 HIS stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-01-30 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 16243 Prp24-RRM23 100.00 186 97.85 98.92 1.94e-58 BMRB 16244 Prp24-RRM23 100.00 186 97.85 98.92 1.94e-58 PDB 4N0T "Core Structure Of The U6 Small Nuclear Ribonucleoprotein At 1.7 Angstrom Resolution" 92.47 374 97.67 98.84 2.26e-50 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species _Gene_mnemonic $RRM3 'Baker's yeast' 4932 Eukaryota Metazoa Saccharomyces cerevisiae Prp24 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 $RRM3 'recombinant technology' . Escherichia coli 'BL21 DE3' pET-21b stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_13C15N_H2O _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $RRM3 600 uM '[U-99% 13C; U-99% 15N]' 'potassium phosphate pH 6' 18 mM 'natural abundance' 'potassium chloride' 45 mM 'natural abundance' DTT 0.9 mM 'natural abundance' H2O 90 % 'natural abundance' D2O 10 % 'natural abundance' stop_ save_ save_Reference _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $RRM3 600 uM '[U-99% 13C; U-99% 15N]' 'potassium phosphate pH 6' 18 mM 'natural abundance' 'potassium chloride' 45 mM 'natural abundance' DSS 1 uM 'natural abundance' H2O 90 % 'natural abundance' D2O 10 % 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_VNMRJ _Saveframe_category software _Name VNMRJ _Version . loop_ _Vendor _Address _Electronic_address Varian . . stop_ loop_ _Task collection stop_ _Details . save_ save_NMRDraw _Saveframe_category software _Name NMRDraw _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 'chemical shift assignment' 'data analysis' 'peak picking' stop_ _Details . save_ save_TALOS _Saveframe_category software _Name TALOS _Version . loop_ _Vendor _Address _Electronic_address 'Cornilescu, Delaglio and Bax' . . stop_ loop_ _Task 'data analysis' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model 'Uniform NMR System' _Field_strength 900 _Details . save_ ############################# # NMR applied experiments # ############################# save_2D_1H-15N_HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $13C15N_H2O save_ save_3D_CBCA(CO)NH_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _Sample_label $13C15N_H2O save_ save_3D_HNCACB_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $13C15N_H2O save_ save_3D_HNCO_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $13C15N_H2O save_ save_2D_1H-13C_HSQC_aliphatic_5 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-13C HSQC aliphatic' _Sample_label $Reference save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units pH 6 . pH pressure 1 . atm temperature 273 . 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 DSS H 1 'methyl protons' ppm 0.00 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' '3D CBCA(CO)NH' '3D HNCACB' '3D HNCO' '2D 1H-13C HSQC aliphatic' stop_ loop_ _Sample_label $13C15N_H2O $Reference stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name RRM3 _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 1 207 1 MET C C 176.592 0.4 1 2 207 1 MET CA C 61.41 0.4 1 3 207 1 MET CB C 38.706 0.4 1 4 208 2 GLU H H 8.395 0.03 1 5 208 2 GLU C C 176.435 0.4 1 6 208 2 GLU CA C 56.728 0.4 1 7 208 2 GLU CB C 30.42 0.4 1 8 208 2 GLU N N 124.302 0.4 1 9 209 3 GLY H H 8.62 0.03 1 10 209 3 GLY C C 173.234 0.4 1 11 209 3 GLY CA C 46.239 0.4 1 12 209 3 GLY N N 109.309 0.4 1 13 210 4 ARG H H 8.07 0.03 1 14 210 4 ARG C C 173.454 0.4 1 15 210 4 ARG CA C 55.362 0.4 1 16 210 4 ARG CB C 30.796 0.4 1 17 210 4 ARG N N 114.114 0.4 1 18 211 5 GLU H H 7.852 0.03 1 19 211 5 GLU C C 176.401 0.4 1 20 211 5 GLU CA C 53.939 0.4 1 21 211 5 GLU CB C 33.308 0.4 1 22 211 5 GLU N N 121.394 0.4 1 23 212 6 ILE H H 9.381 0.03 1 24 212 6 ILE C C 173.569 0.4 1 25 212 6 ILE CA C 59.187 0.4 1 26 212 6 ILE CB C 40.643 0.4 1 27 212 6 ILE N N 120.162 0.4 1 28 213 7 MET H H 9.32 0.03 1 29 213 7 MET C C 173.927 0.4 1 30 213 7 MET CA C 54.312 0.4 1 31 213 7 MET CB C 35.704 0.4 1 32 213 7 MET N N 121.945 0.4 1 33 214 8 ILE H H 8.993 0.03 1 34 214 8 ILE C C 174.779 0.4 1 35 214 8 ILE CA C 59.822 0.4 1 36 214 8 ILE CB C 40.317 0.4 1 37 214 8 ILE N N 129.057 0.4 1 38 215 9 ARG H H 9.229 0.03 1 39 215 9 ARG C C 175.602 0.4 1 40 215 9 ARG CA C 54.603 0.4 1 41 215 9 ARG CB C 34.328 0.4 1 42 215 9 ARG N N 123.255 0.4 1 43 216 10 ASN H H 8.274 0.03 1 44 216 10 ASN C C 175.972 0.4 1 45 216 10 ASN CA C 54.455 0.4 1 46 216 10 ASN CB C 38.338 0.4 1 47 216 10 ASN N N 114.285 0.4 1 48 217 11 LEU H H 7.986 0.03 1 49 217 11 LEU C C 176.918 0.4 1 50 217 11 LEU CA C 54.676 0.4 1 51 217 11 LEU CB C 42.178 0.4 1 52 217 11 LEU N N 115.318 0.4 1 53 218 12 SER H H 6.515 0.03 1 54 218 12 SER C C 176.167 0.4 1 55 218 12 SER CA C 55.772 0.4 1 56 218 12 SER CB C 65.52 0.4 1 57 218 12 SER N N 114.376 0.4 1 58 219 13 THR H H 8.933 0.03 1 59 219 13 THR C C 177.527 0.4 1 60 219 13 THR CA C 66.036 0.4 1 61 219 13 THR CB C 68.255 0.4 1 62 219 13 THR N N 112.77 0.4 1 63 220 14 GLU H H 8.357 0.03 1 64 220 14 GLU C C 177.132 0.4 1 65 220 14 GLU CA C 58.683 0.4 1 66 220 14 GLU CB C 28.944 0.4 1 67 220 14 GLU N N 119.65 0.4 1 68 221 15 LEU H H 7.251 0.03 1 69 221 15 LEU C C 175.546 0.4 1 70 221 15 LEU CA C 54.077 0.4 1 71 221 15 LEU CB C 43.31 0.4 1 72 221 15 LEU N N 118.192 0.4 1 73 222 16 LEU H H 6.95 0.03 1 74 222 16 LEU C C 174.815 0.4 1 75 222 16 LEU CA C 52.673 0.4 1 76 222 16 LEU CB C 39.323 0.4 1 77 222 16 LEU N N 118.43 0.4 1 78 223 17 ASP H H 7.818 0.03 1 79 223 17 ASP C C 175.603 0.4 1 80 223 17 ASP CA C 53.014 0.4 1 81 223 17 ASP CB C 43.969 0.4 1 82 223 17 ASP N N 124.757 0.4 1 83 224 18 GLU H H 9.443 0.03 1 84 224 18 GLU C C 177.261 0.4 1 85 224 18 GLU CA C 61.06 0.4 1 86 224 18 GLU CB C 29.681 0.4 1 87 224 18 GLU N N 126.626 0.4 1 88 225 19 ASN H H 8.247 0.03 1 89 225 19 ASN C C 177.271 0.4 1 90 225 19 ASN CA C 56.521 0.4 1 91 225 19 ASN CB C 38.09 0.4 1 92 225 19 ASN N N 116.856 0.4 1 93 226 20 LEU H H 7.923 0.03 1 94 226 20 LEU C C 180.836 0.4 1 95 226 20 LEU CA C 58.028 0.4 1 96 226 20 LEU CB C 42.077 0.4 1 97 226 20 LEU N N 122.791 0.4 1 98 227 21 LEU H H 8.316 0.03 1 99 227 21 LEU C C 178.723 0.4 1 100 227 21 LEU CA C 58.262 0.4 1 101 227 21 LEU CB C 41.423 0.4 1 102 227 21 LEU N N 119.93 0.4 1 103 228 22 ARG H H 8.507 0.03 1 104 228 22 ARG C C 178.092 0.4 1 105 228 22 ARG CA C 61.013 0.4 1 106 228 22 ARG CB C 29.879 0.4 1 107 228 22 ARG N N 119.992 0.4 1 108 229 23 GLU H H 8.243 0.03 1 109 229 23 GLU C C 179.313 0.4 1 110 229 23 GLU CA C 59.353 0.4 1 111 229 23 GLU CB C 29.502 0.4 1 112 229 23 GLU N N 117.068 0.4 1 113 230 24 SER H H 7.82 0.03 1 114 230 24 SER C C 174.465 0.4 1 115 230 24 SER CA C 61.698 0.4 1 116 230 24 SER CB C 63.82 0.4 1 117 230 24 SER N N 111.917 0.4 1 118 231 25 PHE H H 7.832 0.03 1 119 231 25 PHE C C 176.924 0.4 1 120 231 25 PHE CA C 59.585 0.4 1 121 231 25 PHE CB C 42.415 0.4 1 122 231 25 PHE N N 116.592 0.4 1 123 232 26 GLU H H 8.758 0.03 1 124 232 26 GLU C C 177.731 0.4 1 125 232 26 GLU CA C 58.685 0.4 1 126 232 26 GLU CB C 28.216 0.4 1 127 232 26 GLU N N 120.607 0.4 1 128 233 27 GLY H H 8.579 0.03 1 129 233 27 GLY C C 175.752 0.4 1 130 233 27 GLY CA C 45.774 0.4 1 131 233 27 GLY N N 108.837 0.4 1 132 234 28 PHE H H 7.749 0.03 1 133 234 28 PHE C C 175.328 0.4 1 134 234 28 PHE CA C 59.746 0.4 1 135 234 28 PHE CB C 38.479 0.4 1 136 234 28 PHE N N 117.169 0.4 1 137 235 29 GLY H H 7.566 0.03 1 138 235 29 GLY C C 171.09 0.4 1 139 235 29 GLY CA C 44.071 0.4 1 140 235 29 GLY N N 106.702 0.4 1 141 236 30 SER H H 8.195 0.03 1 142 236 30 SER C C 175.69 0.4 1 143 236 30 SER CA C 59.59 0.4 1 144 236 30 SER CB C 63.32 0.4 1 145 236 30 SER N N 110.822 0.4 1 146 237 31 ILE H H 9.064 0.03 1 147 237 31 ILE C C 175.86 0.4 1 148 237 31 ILE CA C 61.992 0.4 1 149 237 31 ILE CB C 40.383 0.4 1 150 237 31 ILE N N 129.56 0.4 1 151 238 32 GLU H H 9.199 0.03 1 152 238 32 GLU C C 176.379 0.4 1 153 238 32 GLU CA C 57.848 0.4 1 154 238 32 GLU CB C 31.798 0.4 1 155 238 32 GLU N N 129.737 0.4 1 156 239 33 LYS H H 7.547 0.03 1 157 239 33 LYS C C 173.335 0.4 1 158 239 33 LYS CA C 55.623 0.4 1 159 239 33 LYS CB C 36.52 0.4 1 160 239 33 LYS N N 116.025 0.4 1 161 240 34 ILE H H 8.616 0.03 1 162 240 34 ILE C C 173.86 0.4 1 163 240 34 ILE CA C 61.079 0.4 1 164 240 34 ILE CB C 39.821 0.4 1 165 240 34 ILE N N 124.123 0.4 1 166 241 35 ASN H H 9.135 0.03 1 167 241 35 ASN C C 173.54 0.4 1 168 241 35 ASN CA C 51.823 0.4 1 169 241 35 ASN CB C 41.473 0.4 1 170 241 35 ASN N N 126.155 0.4 1 171 242 36 ILE H H 8.96 0.03 1 172 242 36 ILE CA C 58.6 0.4 1 173 242 36 ILE CB C 38.95 0.4 1 174 242 36 ILE N N 126.819 0.4 1 175 243 37 PRO C C 176.537 0.4 1 176 243 37 PRO CA C 63.721 0.4 1 177 243 37 PRO CB C 32.236 0.4 1 178 244 38 ALA H H 8.642 0.03 1 179 244 38 ALA C C 178.563 0.4 1 180 244 38 ALA CA C 52.639 0.4 1 181 244 38 ALA CB C 19.79 0.4 1 182 244 38 ALA N N 126.838 0.4 1 183 245 39 GLY H H 8.651 0.03 1 184 245 39 GLY C C 175.437 0.4 1 185 245 39 GLY CA C 46.334 0.4 1 186 245 39 GLY N N 108.026 0.4 1 187 246 40 GLN H H 8.137 0.03 1 188 246 40 GLN C C 177.366 0.4 1 189 246 40 GLN CA C 58.192 0.4 1 190 246 40 GLN CB C 31.441 0.4 1 191 246 40 GLN N N 118.533 0.4 1 192 247 41 LYS H H 8.259 0.03 1 193 247 41 LYS C C 178.687 0.4 1 194 247 41 LYS CA C 58.804 0.4 1 195 247 41 LYS CB C 32.181 0.4 1 196 247 41 LYS N N 118.019 0.4 1 197 248 42 GLU H H 8.853 0.03 1 198 248 42 GLU C C 177.142 0.4 1 199 248 42 GLU CA C 58.883 0.4 1 200 248 42 GLU CB C 29.039 0.4 1 201 248 42 GLU N N 119.129 0.4 1 202 249 43 HIS H H 7.333 0.03 1 203 249 43 HIS C C 174.222 0.4 1 204 249 43 HIS CA C 55.659 0.4 1 205 249 43 HIS CB C 29.841 0.4 1 206 249 43 HIS N N 114.51 0.4 1 207 250 44 SER H H 8.015 0.03 1 208 250 44 SER C C 174.465 0.4 1 209 250 44 SER CA C 58.569 0.4 1 210 250 44 SER CB C 62.438 0.4 1 211 250 44 SER N N 114.659 0.4 1 212 251 45 PHE H H 7.829 0.03 1 213 251 45 PHE C C 176.014 0.4 1 214 251 45 PHE CA C 57.504 0.4 1 215 251 45 PHE CB C 38.542 0.4 1 216 251 45 PHE N N 119.61 0.4 1 217 252 46 ASN H H 8.45 0.03 1 218 252 46 ASN C C 174.388 0.4 1 219 252 46 ASN CA C 54.368 0.4 1 220 252 46 ASN CB C 39.104 0.4 1 221 252 46 ASN N N 118.149 0.4 1 222 253 47 ASN H H 8.007 0.03 1 223 253 47 ASN C C 174.45 0.4 1 224 253 47 ASN CA C 52.895 0.4 1 225 253 47 ASN CB C 38.858 0.4 1 226 253 47 ASN N N 118.442 0.4 1 227 254 48 CYS H H 8.932 0.03 1 228 254 48 CYS C C 173.388 0.4 1 229 254 48 CYS CA C 58.217 0.4 1 230 254 48 CYS CB C 30.515 0.4 1 231 254 48 CYS N N 121.21 0.4 1 232 255 49 CYS H H 9.636 0.03 1 233 255 49 CYS C C 172.076 0.4 1 234 255 49 CYS CA C 55.001 0.4 1 235 255 49 CYS CB C 32.617 0.4 1 236 255 49 CYS N N 118.189 0.4 1 237 256 50 ALA H H 8.535 0.03 1 238 256 50 ALA C C 173.563 0.4 1 239 256 50 ALA CA C 50.909 0.4 1 240 256 50 ALA CB C 23.892 0.4 1 241 256 50 ALA N N 119.717 0.4 1 242 257 51 PHE H H 8.816 0.03 1 243 257 51 PHE C C 174.991 0.4 1 244 257 51 PHE CA C 56.346 0.4 1 245 257 51 PHE CB C 42.183 0.4 1 246 257 51 PHE N N 117.913 0.4 1 247 258 52 MET H H 8.769 0.03 1 248 258 52 MET C C 172.751 0.4 1 249 258 52 MET CA C 54.614 0.4 1 250 258 52 MET CB C 36.534 0.4 1 251 258 52 MET N N 121.458 0.4 1 252 259 53 VAL H H 8.914 0.03 1 253 259 53 VAL C C 176.225 0.4 1 254 259 53 VAL CA C 61.218 0.4 1 255 259 53 VAL CB C 33.456 0.4 1 256 259 53 VAL N N 126.134 0.4 1 257 260 54 PHE H H 9.123 0.03 1 258 260 54 PHE C C 175.331 0.4 1 259 260 54 PHE CA C 58.518 0.4 1 260 260 54 PHE CB C 41.491 0.4 1 261 260 54 PHE N N 126.835 0.4 1 262 261 55 GLU H H 8.353 0.03 1 263 261 55 GLU C C 175.878 0.4 1 264 261 55 GLU CA C 59.548 0.4 1 265 261 55 GLU CB C 30.206 0.4 1 266 261 55 GLU N N 118.987 0.4 1 267 262 56 ASN H H 8.355 0.03 1 268 262 56 ASN C C 175.103 0.4 1 269 262 56 ASN CA C 51.665 0.4 1 270 262 56 ASN CB C 42.073 0.4 1 271 262 56 ASN N N 112.616 0.4 1 272 263 57 LYS H H 8.953 0.03 1 273 263 57 LYS C C 177.32 0.4 1 274 263 57 LYS CA C 59.153 0.4 1 275 263 57 LYS CB C 32.359 0.4 1 276 263 57 LYS N N 122.469 0.4 1 277 264 58 ASP H H 8.628 0.03 1 278 264 58 ASP C C 178.865 0.4 1 279 264 58 ASP CA C 57.243 0.4 1 280 264 58 ASP CB C 40.104 0.4 1 281 264 58 ASP N N 120.085 0.4 1 282 265 59 SER H H 7.689 0.03 1 283 265 59 SER C C 173.91 0.4 1 284 265 59 SER CA C 61.728 0.4 1 285 265 59 SER CB C 62.916 0.4 1 286 265 59 SER N N 116.162 0.4 1 287 266 60 ALA H H 6.525 0.03 1 288 266 60 ALA C C 177.305 0.4 1 289 266 60 ALA CA C 54.808 0.4 1 290 266 60 ALA CB C 17.806 0.4 1 291 266 60 ALA N N 121.922 0.4 1 292 267 61 GLU H H 7.617 0.03 1 293 267 61 GLU C C 180.644 0.4 1 294 267 61 GLU CA C 59.107 0.4 1 295 267 61 GLU CB C 29.223 0.4 1 296 267 61 GLU N N 113.147 0.4 1 297 268 62 ARG H H 7.811 0.03 1 298 268 62 ARG C C 178.045 0.4 1 299 268 62 ARG CA C 59.793 0.4 1 300 268 62 ARG CB C 30.802 0.4 1 301 268 62 ARG N N 119.934 0.4 1 302 269 63 ALA H H 7.527 0.03 1 303 269 63 ALA C C 178.047 0.4 1 304 269 63 ALA CA C 53.363 0.4 1 305 269 63 ALA CB C 18.842 0.4 1 306 269 63 ALA N N 120.867 0.4 1 307 270 64 LEU H H 7.146 0.03 1 308 270 64 LEU C C 179.879 0.4 1 309 270 64 LEU CA C 57.167 0.4 1 310 270 64 LEU CB C 40.348 0.4 1 311 270 64 LEU N N 115.44 0.4 1 312 271 65 GLN H H 7.856 0.03 1 313 271 65 GLN C C 176.75 0.4 1 314 271 65 GLN CA C 57.771 0.4 1 315 271 65 GLN CB C 29.057 0.4 1 316 271 65 GLN N N 119.38 0.4 1 317 272 66 MET H H 7.722 0.03 1 318 272 66 MET C C 177.49 0.4 1 319 272 66 MET CA C 54.505 0.4 1 320 272 66 MET CB C 32.372 0.4 1 321 272 66 MET N N 114.801 0.4 1 322 273 67 ASN H H 7.936 0.03 1 323 273 67 ASN C C 175.071 0.4 1 324 273 67 ASN CA C 56.575 0.4 1 325 273 67 ASN CB C 38.944 0.4 1 326 273 67 ASN N N 119.146 0.4 1 327 274 68 ARG H H 8.888 0.03 1 328 274 68 ARG C C 174.593 0.4 1 329 274 68 ARG CA C 58.749 0.4 1 330 274 68 ARG CB C 27.126 0.4 1 331 274 68 ARG N N 121.254 0.4 1 332 275 69 SER H H 7.83 0.03 1 333 275 69 SER C C 172.01 0.4 1 334 275 69 SER CA C 58.468 0.4 1 335 275 69 SER CB C 64.903 0.4 1 336 275 69 SER N N 114.979 0.4 1 337 276 70 LEU H H 8.162 0.03 1 338 276 70 LEU C C 177.349 0.4 1 339 276 70 LEU CA C 54.161 0.4 1 340 276 70 LEU CB C 42.917 0.4 1 341 276 70 LEU N N 120.191 0.4 1 342 277 71 LEU H H 9.068 0.03 1 343 277 71 LEU C C 176.05 0.4 1 344 277 71 LEU CA C 54.46 0.4 1 345 277 71 LEU CB C 44.57 0.4 1 346 277 71 LEU N N 129.11 0.4 1 347 278 72 GLY H H 8.92 0.03 1 348 278 72 GLY C C 174.651 0.4 1 349 278 72 GLY CA C 47.685 0.4 1 350 278 72 GLY N N 114.619 0.4 1 351 279 73 ASN H H 8.369 0.03 1 352 279 73 ASN C C 174.827 0.4 1 353 279 73 ASN CA C 52.89 0.4 1 354 279 73 ASN CB C 38.288 0.4 1 355 279 73 ASN N N 119.902 0.4 1 356 280 74 ARG H H 8.052 0.03 1 357 280 74 ARG C C 174.083 0.4 1 358 280 74 ARG CA C 53.225 0.4 1 359 280 74 ARG CB C 32.977 0.4 1 360 280 74 ARG N N 119.607 0.4 1 361 281 75 GLU H H 8.397 0.03 1 362 281 75 GLU C C 176.922 0.4 1 363 281 75 GLU CA C 55.314 0.4 1 364 281 75 GLU CB C 29.719 0.4 1 365 281 75 GLU N N 122.761 0.4 1 366 282 76 ILE H H 8.643 0.03 1 367 282 76 ILE C C 175.334 0.4 1 368 282 76 ILE CA C 61.654 0.4 1 369 282 76 ILE CB C 40.216 0.4 1 370 282 76 ILE N N 123.035 0.4 1 371 283 77 SER H H 8.019 0.03 1 372 283 77 SER C C 174.237 0.4 1 373 283 77 SER CA C 55.632 0.4 1 374 283 77 SER CB C 64.504 0.4 1 375 283 77 SER N N 115.843 0.4 1 376 284 78 VAL H H 8.985 0.03 1 377 284 78 VAL C C 173.639 0.4 1 378 284 78 VAL CA C 61.396 0.4 1 379 284 78 VAL CB C 35.416 0.4 1 380 284 78 VAL N N 126.497 0.4 1 381 285 79 SER H H 8.518 0.03 1 382 285 79 SER C C 173.187 0.4 1 383 285 79 SER CA C 56.55 0.4 1 384 285 79 SER CB C 66.055 0.4 1 385 285 79 SER N N 119.079 0.4 1 386 286 80 LEU H H 8.883 0.03 1 387 286 80 LEU C C 177.813 0.4 1 388 286 80 LEU CA C 55.751 0.4 1 389 286 80 LEU CB C 41.815 0.4 1 390 286 80 LEU N N 122.287 0.4 1 391 287 81 ALA H H 8.471 0.03 1 392 287 81 ALA C C 176.37 0.4 1 393 287 81 ALA CA C 52.525 0.4 1 394 287 81 ALA CB C 19.146 0.4 1 395 287 81 ALA N N 126.546 0.4 1 396 288 82 ASP H H 8.295 0.03 1 397 288 82 ASP C C 175.891 0.4 1 398 288 82 ASP CA C 53.991 0.4 1 399 288 82 ASP CB C 41.449 0.4 1 400 288 82 ASP N N 120.2 0.4 1 401 289 83 LYS H H 8.161 0.03 1 402 289 83 LYS C C 176.273 0.4 1 403 289 83 LYS CA C 55.988 0.4 1 404 289 83 LYS CB C 32.605 0.4 1 405 289 83 LYS N N 120.802 0.4 1 406 290 84 LYS H H 8.232 0.03 1 407 290 84 LYS CA C 54.507 0.4 1 408 290 84 LYS CB C 32.219 0.4 1 409 290 84 LYS N N 123.37 0.4 1 410 291 85 PRO C C 176.753 0.4 1 411 291 85 PRO CA C 62.989 0.4 1 412 291 85 PRO CB C 31.829 0.4 1 413 292 86 LEU H H 8.204 0.03 1 414 292 86 LEU C C 177.103 0.4 1 415 292 86 LEU CA C 55.338 0.4 1 416 292 86 LEU CB C 42.128 0.4 1 417 292 86 LEU N N 121.595 0.4 1 418 293 87 TRP H H 7.839 0.03 1 419 293 87 TRP CA C 56.992 0.4 1 420 293 87 TRP CB C 29.689 0.4 1 421 293 87 TRP N N 120.196 0.4 1 stop_ save_