data_27325 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; SH2 domain of Yes1 kinase ; _BMRB_accession_number 27325 _BMRB_flat_file_name bmr27325.str _Entry_type original _Submission_date 2017-12-03 _Accession_date 2017-12-03 _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 Bachman Ashleigh . . 2 Keramisanou Dimitra . . 3 'Kumar M.V.' Vasantha . . 4 Gelis Ioannis . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 102 "13C chemical shifts" 207 "15N chemical shifts" 102 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2018-03-22 update BMRB 'update entry citation' 2018-01-16 original author 'original release' stop_ loop_ _Related_BMRB_accession_number _Relationship 27326 'Yes1-SH2 (Yes1 SH2 domain in complex with Cdc37-derived phosphopeptide)' 27327 'Yes1-SH3 (Yes1 kinase SH3 domain)' stop_ _Original_release_date 2017-12-04 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; Phosphorylation induced cochaperone unfolding promotes kinase recruitment and client class-specific Hsp90 phosphorylation ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 29343704 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Bachman Ashleigh B. . 2 Keramisanou Dimitra . . 3 Xu Wanping . . 4 Beebe Kristin . . 5 Moses Michael A. . 6 'Vasantha Kumar' M V. . 7 Gray Geoffrey . . 8 Noor 'Radwan Ebna' E. . 9 'van der Vaart' Arjan . . 10 Neckers Len . . 11 Gelis Ioannis . . stop_ _Journal_abbreviation 'Nat. Commun.' _Journal_name_full 'Nature communications' _Journal_volume 9 _Journal_issue 1 _Journal_ISSN 2041-1723 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 265 _Page_last 265 _Year 2018 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'Yes1-SH2 (SH2 domain of Yes1 kinase)' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label Yes1-SH2 $Yes1-SH2 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_Yes1-SH2 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common Yes1-SH2 _Molecular_mass . _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 110 _Mol_residue_sequence ; SIQAEEWYFGKMGRKDAERL LLNPGNQRGIFLVRESETTK GAYSLSIRDWDEIRGDNVKH YKIRKLDNGGYYITTRAQFD TLQKLVKHYTEHADGLCHKL TTVCPTVKPQ ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 152 SER 2 153 ILE 3 154 GLN 4 155 ALA 5 156 GLU 6 157 GLU 7 158 TRP 8 159 TYR 9 160 PHE 10 161 GLY 11 162 LYS 12 163 MET 13 164 GLY 14 165 ARG 15 166 LYS 16 167 ASP 17 168 ALA 18 169 GLU 19 170 ARG 20 171 LEU 21 172 LEU 22 173 LEU 23 174 ASN 24 175 PRO 25 176 GLY 26 177 ASN 27 178 GLN 28 179 ARG 29 180 GLY 30 181 ILE 31 182 PHE 32 183 LEU 33 184 VAL 34 185 ARG 35 186 GLU 36 187 SER 37 188 GLU 38 189 THR 39 190 THR 40 191 LYS 41 192 GLY 42 193 ALA 43 194 TYR 44 195 SER 45 196 LEU 46 197 SER 47 198 ILE 48 199 ARG 49 200 ASP 50 201 TRP 51 202 ASP 52 203 GLU 53 204 ILE 54 205 ARG 55 206 GLY 56 207 ASP 57 208 ASN 58 209 VAL 59 210 LYS 60 211 HIS 61 212 TYR 62 213 LYS 63 214 ILE 64 215 ARG 65 216 LYS 66 217 LEU 67 218 ASP 68 219 ASN 69 220 GLY 70 221 GLY 71 222 TYR 72 223 TYR 73 224 ILE 74 225 THR 75 226 THR 76 227 ARG 77 228 ALA 78 229 GLN 79 230 PHE 80 231 ASP 81 232 THR 82 233 LEU 83 234 GLN 84 235 LYS 85 236 LEU 86 237 VAL 87 238 LYS 88 239 HIS 89 240 TYR 90 241 THR 91 242 GLU 92 243 HIS 93 244 ALA 94 245 ASP 95 246 GLY 96 247 LEU 97 248 CYS 98 249 HIS 99 250 LYS 100 251 LEU 101 252 THR 102 253 THR 103 254 VAL 104 255 CYS 105 256 PRO 106 257 THR 107 258 VAL 108 259 LYS 109 260 PRO 110 261 GLN 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 $Yes1-SH2 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 $Yes1-SH2 'recombinant technology' . Escherichia coli . pGEX6P1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_2 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $Yes1-SH2 0.5 mM '[U-100% 13C; U-100% 15N]' stop_ save_ save_sample_1 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $Yes1-SH2 0.5 mM '[U-100% 15N]' stop_ save_ ############################ # Computer software used # ############################ save_SPARKY _Saveframe_category software _Name SPARKY _Version . loop_ _Vendor _Address _Electronic_address Goddard . . stop_ loop_ _Task 'chemical shift assignment' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Agilent _Model 'direct drive' _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_1 save_ save_3D_CBCA(CO)NH_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _Sample_label $sample_2 save_ save_3D_HNCA_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $sample_2 save_ save_3D_HNCACB_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_2 save_ save_3D_HN(CO)CA_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CO)CA' _Sample_label $sample_2 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' 0.1 . M pH 7.5 . 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 water H 1 protons ppm 4.7 internal direct . . . 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '2D 1H-15N HSQC' '3D CBCA(CO)NH' '3D HNCA' '3D HNCACB' '3D HN(CO)CA' stop_ loop_ _Sample_label $sample_1 $sample_2 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name Yes1-SH2 _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 1 152 1 SER CA C 58.486 . . 2 152 1 SER CB C 63.805 . . 3 153 2 ILE H H 8.177 . . 4 153 2 ILE CA C 62.552 . . 5 153 2 ILE CB C 38.336 . . 6 153 2 ILE N N 122.107 . . 7 154 3 GLN H H 7.724 . . 8 154 3 GLN CA C 57.423 . . 9 154 3 GLN CB C 28.261 . . 10 154 3 GLN N N 118.005 . . 11 155 4 ALA H H 7.652 . . 12 155 4 ALA CA C 51.734 . . 13 155 4 ALA CB C 19.392 . . 14 155 4 ALA N N 120.279 . . 15 156 5 GLU H H 7.440 . . 16 156 5 GLU CA C 55.465 . . 17 156 5 GLU CB C 27.875 . . 18 156 5 GLU N N 118.837 . . 19 157 6 GLU H H 9.050 . . 20 157 6 GLU CA C 58.714 . . 21 157 6 GLU CB C 29.739 . . 22 157 6 GLU N N 122.851 . . 23 158 7 TRP H H 6.207 . . 24 158 7 TRP CA C 53.370 . . 25 158 7 TRP CB C 30.468 . . 26 158 7 TRP N N 108.339 . . 27 159 8 TYR H H 7.501 . . 28 159 8 TYR CA C 58.621 . . 29 159 8 TYR CB C 38.279 . . 30 159 8 TYR N N 121.723 . . 31 160 9 PHE H H 9.291 . . 32 160 9 PHE CA C 57.299 . . 33 160 9 PHE CB C 38.862 . . 34 160 9 PHE N N 130.066 . . 35 161 10 GLY H H 5.429 . . 36 161 10 GLY CA C 46.412 . . 37 161 10 GLY N N 103.576 . . 38 162 11 LYS H H 8.571 . . 39 162 11 LYS CA C 56.409 . . 40 162 11 LYS CB C 31.518 . . 41 162 11 LYS N N 124.078 . . 42 163 12 MET H H 7.949 . . 43 163 12 MET CA C 56.102 . . 44 163 12 MET CB C 35.837 . . 45 163 12 MET N N 125.452 . . 46 164 13 GLY H H 9.125 . . 47 164 13 GLY CA C 44.743 . . 48 164 13 GLY N N 114.304 . . 49 165 14 ARG H H 8.450 . . 50 165 14 ARG CA C 60.444 . . 51 165 14 ARG CB C 30.910 . . 52 165 14 ARG N N 120.578 . . 53 166 15 LYS H H 8.545 . . 54 166 15 LYS CA C 59.567 . . 55 166 15 LYS CB C 31.459 . . 56 166 15 LYS N N 117.648 . . 57 167 16 ASP H H 7.940 . . 58 167 16 ASP CA C 57.376 . . 59 167 16 ASP CB C 40.519 . . 60 167 16 ASP N N 120.021 . . 61 168 17 ALA H H 7.881 . . 62 168 17 ALA CA C 55.177 . . 63 168 17 ALA CB C 18.623 . . 64 168 17 ALA N N 121.433 . . 65 169 18 GLU H H 8.288 . . 66 169 18 GLU CA C 60.558 . . 67 169 18 GLU CB C 28.470 . . 68 169 18 GLU N N 115.644 . . 69 170 19 ARG H H 7.848 . . 70 170 19 ARG CA C 59.307 . . 71 170 19 ARG CB C 30.040 . . 72 170 19 ARG N N 117.467 . . 73 171 20 LEU H H 7.403 . . 74 171 20 LEU CA C 57.526 . . 75 171 20 LEU CB C 42.661 . . 76 171 20 LEU N N 117.404 . . 77 172 21 LEU H H 8.056 . . 78 172 21 LEU CA C 57.648 . . 79 172 21 LEU CB C 43.219 . . 80 172 21 LEU N N 118.553 . . 81 173 22 LEU H H 8.116 . . 82 173 22 LEU CA C 55.434 . . 83 173 22 LEU CB C 40.212 . . 84 173 22 LEU N N 117.561 . . 85 174 23 ASN H H 6.931 . . 86 174 23 ASN CA C 52.865 . . 87 174 23 ASN CB C 38.768 . . 88 174 23 ASN N N 121.943 . . 89 175 24 PRO CA C 63.951 . . 90 175 24 PRO CB C 29.346 . . 91 176 25 GLY H H 8.711 . . 92 176 25 GLY CA C 45.068 . . 93 176 25 GLY N N 109.613 . . 94 177 26 ASN H H 7.146 . . 95 177 26 ASN CA C 52.341 . . 96 177 26 ASN CB C 39.945 . . 97 177 26 ASN N N 117.803 . . 98 178 27 GLN H H 7.888 . . 99 178 27 GLN CA C 54.445 . . 100 178 27 GLN CB C 31.218 . . 101 178 27 GLN N N 118.807 . . 102 179 28 ARG H H 8.143 . . 103 179 28 ARG CA C 57.877 . . 104 179 28 ARG CB C 30.752 . . 105 179 28 ARG N N 119.082 . . 106 180 29 GLY H H 8.928 . . 107 180 29 GLY CA C 46.029 . . 108 180 29 GLY N N 113.213 . . 109 181 30 ILE H H 7.203 . . 110 181 30 ILE CA C 61.758 . . 111 181 30 ILE CB C 38.143 . . 112 181 30 ILE N N 117.441 . . 113 182 31 PHE H H 7.581 . . 114 182 31 PHE CA C 55.782 . . 115 182 31 PHE CB C 44.785 . . 116 182 31 PHE N N 117.428 . . 117 183 32 LEU H H 8.696 . . 118 183 32 LEU CA C 54.869 . . 119 183 32 LEU CB C 45.044 . . 120 183 32 LEU N N 113.445 . . 121 184 33 VAL H H 9.043 . . 122 184 33 VAL CA C 61.252 . . 123 184 33 VAL CB C 33.928 . . 124 184 33 VAL N N 120.568 . . 125 185 34 ARG H H 9.195 . . 126 185 34 ARG CA C 52.702 . . 127 185 34 ARG CB C 33.928 . . 128 185 34 ARG N N 122.976 . . 129 186 35 GLU H H 8.786 . . 130 186 35 GLU CA C 56.251 . . 131 186 35 GLU CB C 31.752 . . 132 186 35 GLU N N 122.626 . . 133 187 36 SER H H 7.939 . . 134 187 36 SER CA C 58.233 . . 135 187 36 SER CB C 63.749 . . 136 187 36 SER N N 116.471 . . 137 188 37 GLU H H 9.327 . . 138 188 37 GLU CA C 58.217 . . 139 188 37 GLU CB C 30.267 . . 140 188 37 GLU N N 126.037 . . 141 189 38 THR H H 7.994 . . 142 189 38 THR CA C 62.292 . . 143 189 38 THR CB C 70.141 . . 144 189 38 THR N N 108.710 . . 145 190 39 THR CA C 61.705 . . 146 191 40 LYS H H 8.499 . . 147 191 40 LYS CA C 57.652 . . 148 191 40 LYS CB C 32.331 . . 149 191 40 LYS N N 127.927 . . 150 192 41 GLY H H 9.305 . . 151 192 41 GLY CA C 45.425 . . 152 192 41 GLY N N 114.204 . . 153 193 42 ALA H H 7.345 . . 154 193 42 ALA CA C 50.346 . . 155 193 42 ALA CB C 19.630 . . 156 193 42 ALA N N 121.071 . . 157 194 43 TYR H H 8.873 . . 158 194 43 TYR CA C 57.016 . . 159 194 43 TYR CB C 42.394 . . 160 194 43 TYR N N 120.447 . . 161 195 44 SER H H 9.552 . . 162 195 44 SER CA C 58.042 . . 163 195 44 SER CB C 58.853 . . 164 195 44 SER N N 116.191 . . 165 196 45 LEU H H 9.469 . . 166 196 45 LEU CA C 53.653 . . 167 196 45 LEU CB C 45.394 . . 168 196 45 LEU N N 128.530 . . 169 197 46 SER H H 9.048 . . 170 197 46 SER CA C 58.760 . . 171 197 46 SER CB C 65.438 . . 172 197 46 SER N N 125.195 . . 173 198 47 ILE H H 8.895 . . 174 198 47 ILE CA C 59.652 . . 175 198 47 ILE CB C 44.057 . . 176 198 47 ILE N N 122.145 . . 177 199 48 ARG H H 8.865 . . 178 199 48 ARG CA C 57.037 . . 179 199 48 ARG CB C 31.764 . . 180 199 48 ARG N N 127.014 . . 181 200 49 ASP H H 9.473 . . 182 200 49 ASP CA C 52.229 . . 183 200 49 ASP CB C 46.111 . . 184 200 49 ASP N N 130.084 . . 185 201 50 TRP H H 8.146 . . 186 201 50 TRP CA C 58.538 . . 187 201 50 TRP CB C 32.585 . . 188 201 50 TRP N N 121.308 . . 189 202 51 ASP H H 6.509 . . 190 202 51 ASP CA C 53.853 . . 191 202 51 ASP CB C 44.156 . . 192 202 51 ASP N N 121.266 . . 193 203 52 GLU H H 8.422 . . 194 203 52 GLU CA C 58.471 . . 195 203 52 GLU CB C 29.560 . . 196 203 52 GLU N N 116.231 . . 197 204 53 ILE H H 8.291 . . 198 204 53 ILE CA C 62.445 . . 199 204 53 ILE CB C 38.056 . . 200 204 53 ILE N N 120.297 . . 201 205 54 ARG H H 9.071 . . 202 205 54 ARG CA C 56.457 . . 203 205 54 ARG CB C 31.343 . . 204 205 54 ARG N N 119.467 . . 205 206 55 GLY H H 7.510 . . 206 206 55 GLY CA C 44.813 . . 207 206 55 GLY N N 108.588 . . 208 207 56 ASP H H 8.634 . . 209 207 56 ASP CA C 55.725 . . 210 207 56 ASP CB C 41.582 . . 211 207 56 ASP N N 125.071 . . 212 208 57 ASN H H 8.539 . . 213 208 57 ASN CA C 53.046 . . 214 208 57 ASN CB C 41.620 . . 215 208 57 ASN N N 118.410 . . 216 209 58 VAL H H 8.774 . . 217 209 58 VAL CA C 60.690 . . 218 209 58 VAL CB C 34.645 . . 219 209 58 VAL N N 121.245 . . 220 210 59 LYS H H 8.505 . . 221 210 59 LYS CA C 54.412 . . 222 210 59 LYS CB C 36.096 . . 223 210 59 LYS N N 126.940 . . 224 211 60 HIS H H 8.152 . . 225 211 60 HIS CA C 54.220 . . 226 211 60 HIS CB C 30.769 . . 227 211 60 HIS N N 118.852 . . 228 212 61 TYR H H 9.684 . . 229 212 61 TYR CA C 56.985 . . 230 212 61 TYR CB C 41.296 . . 231 212 61 TYR N N 122.641 . . 232 213 62 LYS H H 8.911 . . 233 213 62 LYS CA C 57.104 . . 234 213 62 LYS CB C 33.088 . . 235 213 62 LYS N N 125.281 . . 236 214 63 ILE H H 8.866 . . 237 214 63 ILE CA C 60.855 . . 238 214 63 ILE CB C 38.687 . . 239 214 63 ILE N N 126.997 . . 240 215 64 ARG H H 8.482 . . 241 215 64 ARG CA C 54.579 . . 242 215 64 ARG CB C 32.846 . . 243 215 64 ARG N N 128.189 . . 244 216 65 LYS H H 8.390 . . 245 216 65 LYS CA C 54.348 . . 246 216 65 LYS CB C 35.313 . . 247 216 65 LYS N N 119.503 . . 248 217 66 LEU H H 8.719 . . 249 217 66 LEU CA C 54.426 . . 250 217 66 LEU CB C 43.222 . . 251 217 66 LEU N N 129.571 . . 252 219 68 ASN CA C 52.884 . . 253 219 68 ASN CB C 38.013 . . 254 220 69 GLY H H 7.514 . . 255 220 69 GLY CA C 45.498 . . 256 220 69 GLY N N 107.742 . . 257 221 70 GLY H H 8.144 . . 258 221 70 GLY CA C 44.616 . . 259 221 70 GLY N N 109.229 . . 260 222 71 TYR H H 9.306 . . 261 222 71 TYR CA C 57.762 . . 262 222 71 TYR CB C 42.198 . . 263 222 71 TYR N N 117.728 . . 264 223 72 TYR H H 9.226 . . 265 223 72 TYR CA C 57.847 . . 266 223 72 TYR CB C 41.004 . . 267 223 72 TYR N N 116.163 . . 268 224 73 ILE H H 10.153 . . 269 224 73 ILE CA C 63.341 . . 270 224 73 ILE CB C 42.529 . . 271 224 73 ILE N N 120.049 . . 272 225 74 THR H H 9.023 . . 273 225 74 THR CA C 59.033 . . 274 225 74 THR CB C 70.988 . . 275 225 74 THR N N 113.672 . . 276 226 75 THR CA C 64.010 . . 277 227 76 ARG H H 7.717 . . 278 227 76 ARG CA C 57.103 . . 279 227 76 ARG CB C 30.636 . . 280 227 76 ARG N N 117.370 . . 281 228 77 ALA H H 7.417 . . 282 228 77 ALA CA C 51.660 . . 283 228 77 ALA CB C 20.297 . . 284 228 77 ALA N N 123.016 . . 285 229 78 GLN H H 7.705 . . 286 229 78 GLN CA C 53.576 . . 287 229 78 GLN CB C 31.467 . . 288 229 78 GLN N N 119.086 . . 289 230 79 PHE H H 9.210 . . 290 230 79 PHE CA C 57.041 . . 291 230 79 PHE CB C 44.605 . . 292 230 79 PHE N N 117.771 . . 293 231 80 ASP H H 9.305 . . 294 231 80 ASP CA C 56.728 . . 295 231 80 ASP CB C 41.036 . . 296 231 80 ASP N N 120.365 . . 297 232 81 THR H H 7.312 . . 298 232 81 THR CA C 58.423 . . 299 232 81 THR CB C 72.775 . . 300 232 81 THR N N 103.831 . . 301 233 82 LEU H H 8.967 . . 302 233 82 LEU CA C 57.017 . . 303 233 82 LEU CB C 41.852 . . 304 233 82 LEU N N 122.821 . . 305 234 83 GLN H H 9.151 . . 306 234 83 GLN CA C 61.025 . . 307 234 83 GLN CB C 27.348 . . 308 234 83 GLN N N 118.009 . . 309 235 84 LYS H H 7.859 . . 310 235 84 LYS CA C 59.657 . . 311 235 84 LYS CB C 33.135 . . 312 235 84 LYS N N 119.070 . . 313 236 85 LEU H H 7.023 . . 314 236 85 LEU CA C 59.104 . . 315 236 85 LEU CB C 41.574 . . 316 236 85 LEU N N 123.779 . . 317 237 86 VAL H H 7.903 . . 318 237 86 VAL CA C 66.769 . . 319 237 86 VAL CB C 31.496 . . 320 237 86 VAL N N 119.212 . . 321 238 87 LYS H H 7.711 . . 322 238 87 LYS CA C 59.453 . . 323 238 87 LYS CB C 32.274 . . 324 238 87 LYS N N 118.741 . . 325 239 88 HIS H H 7.677 . . 326 239 88 HIS CA C 60.783 . . 327 239 88 HIS CB C 31.504 . . 328 239 88 HIS N N 119.532 . . 329 240 89 TYR H H 7.324 . . 330 240 89 TYR CA C 60.221 . . 331 240 89 TYR CB C 37.717 . . 332 240 89 TYR N N 114.947 . . 333 241 90 THR H H 7.451 . . 334 241 90 THR CA C 64.033 . . 335 241 90 THR CB C 69.556 . . 336 241 90 THR N N 113.751 . . 337 242 91 GLU H H 7.135 . . 338 242 91 GLU CA C 57.619 . . 339 242 91 GLU CB C 30.719 . . 340 242 91 GLU N N 120.367 . . 341 243 92 HIS H H 7.729 . . 342 243 92 HIS CA C 54.715 . . 343 243 92 HIS CB C 32.990 . . 344 243 92 HIS N N 116.507 . . 345 244 93 ALA H H 8.447 . . 346 244 93 ALA CA C 55.249 . . 347 244 93 ALA CB C 18.055 . . 348 244 93 ALA N N 123.462 . . 349 245 94 ASP H H 8.439 . . 350 245 94 ASP CA C 54.479 . . 351 245 94 ASP CB C 41.302 . . 352 245 94 ASP N N 112.373 . . 353 246 95 GLY H H 8.412 . . 354 246 95 GLY CA C 45.017 . . 355 246 95 GLY N N 105.924 . . 356 247 96 LEU H H 8.169 . . 357 247 96 LEU CA C 54.305 . . 358 247 96 LEU CB C 41.806 . . 359 247 96 LEU N N 119.927 . . 360 248 97 CYS H H 7.407 . . 361 248 97 CYS CA C 58.417 . . 362 248 97 CYS CB C 28.732 . . 363 248 97 CYS N N 115.374 . . 364 249 98 HIS H H 7.344 . . 365 249 98 HIS CA C 56.649 . . 366 249 98 HIS CB C 31.737 . . 367 249 98 HIS N N 119.752 . . 368 250 99 LYS H H 7.619 . . 369 250 99 LYS CA C 56.608 . . 370 250 99 LYS CB C 32.549 . . 371 250 99 LYS N N 120.079 . . 372 251 100 LEU H H 8.149 . . 373 251 100 LEU CA C 54.444 . . 374 251 100 LEU CB C 38.912 . . 375 251 100 LEU N N 122.030 . . 376 252 101 THR H H 8.309 . . 377 252 101 THR CA C 60.501 . . 378 252 101 THR CB C 68.639 . . 379 252 101 THR N N 113.523 . . 380 253 102 THR H H 8.334 . . 381 253 102 THR CA C 59.833 . . 382 253 102 THR CB C 71.381 . . 383 253 102 THR N N 114.331 . . 384 254 103 VAL H H 8.125 . . 385 254 103 VAL CA C 62.214 . . 386 254 103 VAL CB C 32.214 . . 387 254 103 VAL N N 120.138 . . 388 255 104 CYS H H 8.283 . . 389 255 104 CYS CA C 57.830 . . 390 255 104 CYS CB C 28.218 . . 391 255 104 CYS N N 128.014 . . 392 256 105 PRO CA C 63.426 . . 393 256 105 PRO CB C 32.530 . . 394 257 106 THR H H 8.099 . . 395 257 106 THR CA C 61.394 . . 396 257 106 THR CB C 70.282 . . 397 257 106 THR N N 114.159 . . 398 258 107 VAL H H 7.956 . . 399 258 107 VAL CA C 61.994 . . 400 258 107 VAL CB C 33.058 . . 401 258 107 VAL N N 121.258 . . 402 259 108 LYS H H 8.406 . . 403 259 108 LYS CA C 54.240 . . 404 259 108 LYS CB C 32.638 . . 405 259 108 LYS N N 126.861 . . 406 260 109 PRO CA C 63.045 . . 407 260 109 PRO CB C 32.156 . . 408 261 110 GLN H H 8.494 . . 409 261 110 GLN CA C 56.171 . . 410 261 110 GLN CB C 29.590 . . 411 261 110 GLN N N 120.524 . . stop_ save_