data_26700 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Backbone assignment of Sam68 STAR domain ; _BMRB_accession_number 26700 _BMRB_flat_file_name bmr26700.str _Entry_type original _Submission_date 2015-11-04 _Accession_date 2015-11-04 _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 Foot Jaelle N. . 2 Dominguez Cyril . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 144 "15N chemical shifts" 144 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2016-12-09 update BMRB 'update entry citation' 2016-01-06 original author 'original release' stop_ loop_ _Related_BMRB_accession_number _Relationship 16969 'Structural basis for homodimerization of the Src-associated during mitosis, 68 kD protein (Sam68) Qua1 domain' 26701 'T-STAR KH' stop_ _Original_release_date 2016-01-06 save_ ############################# # Citation for this entry # ############################# save_Sam68_STAR _Saveframe_category entry_citation _Citation_full . _Citation_title ; Structural basis of RNA recognition and dimerization by the STAR proteins T-STAR and Sam68 ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 26758068 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Feracci Mikael N. . 2 Foot Jaelle N. . 3 Grellscheid Sushma N. . 4 Danilenko Marina . . 5 Stehle Ralf . . 6 Gonchar Oksana . . 7 Kang Hyun-Seo . . 8 Dalgliesh Caroline . . 9 Meyer Helge N. . 10 Liu Yilei . . 11 Lahat Albert . . 12 Sattler Michael . . 13 Eperon Ian C. . 14 Elliott David J. . 15 Dominguez Cyril . . stop_ _Journal_abbreviation 'Nat. Commun.' _Journal_volume 7 _Journal_issue . _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 10355 _Page_last 10355 _Year 2016 _Details . loop_ _Keyword 'KH domain' 'STAR proteins' 'alternative splicing' 'protein-RNA complexe' stop_ save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'Sam68 STAR' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label Sam68 $Sam68 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_Sam68 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common Sam68 _Molecular_mass . _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 189 _Mol_residue_sequence ; GAMEPENKYLPELMAEKDSL DPSFTHAMQLLTAEIEKIQK GDSKKDDEENYLDLFSHKNM KLKERVLIPVKQYPKFNFVG KILGPQGNTIKRLQEETGAK ISVLGKGSMRDKAKEEELRK GGDPKYAHLNMDLHVFIEVF GPPCEAYALMAHAMEEVKKF LVPDMMDDICQEQFLELSYL NGVPEPSRG ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 95 GLY 2 96 ALA 3 97 MET 4 98 GLU 5 99 PRO 6 100 GLU 7 101 ASN 8 102 LYS 9 103 TYR 10 104 LEU 11 105 PRO 12 106 GLU 13 107 LEU 14 108 MET 15 109 ALA 16 110 GLU 17 111 LYS 18 112 ASP 19 113 SER 20 114 LEU 21 115 ASP 22 116 PRO 23 117 SER 24 118 PHE 25 119 THR 26 120 HIS 27 121 ALA 28 122 MET 29 123 GLN 30 124 LEU 31 125 LEU 32 126 THR 33 127 ALA 34 128 GLU 35 129 ILE 36 130 GLU 37 131 LYS 38 132 ILE 39 133 GLN 40 134 LYS 41 135 GLY 42 136 ASP 43 137 SER 44 138 LYS 45 139 LYS 46 140 ASP 47 141 ASP 48 142 GLU 49 143 GLU 50 144 ASN 51 145 TYR 52 146 LEU 53 147 ASP 54 148 LEU 55 149 PHE 56 150 SER 57 151 HIS 58 152 LYS 59 153 ASN 60 154 MET 61 155 LYS 62 156 LEU 63 157 LYS 64 158 GLU 65 159 ARG 66 160 VAL 67 161 LEU 68 162 ILE 69 163 PRO 70 164 VAL 71 165 LYS 72 166 GLN 73 167 TYR 74 168 PRO 75 169 LYS 76 170 PHE 77 171 ASN 78 172 PHE 79 173 VAL 80 174 GLY 81 175 LYS 82 176 ILE 83 177 LEU 84 178 GLY 85 179 PRO 86 180 GLN 87 181 GLY 88 182 ASN 89 183 THR 90 184 ILE 91 185 LYS 92 186 ARG 93 187 LEU 94 188 GLN 95 189 GLU 96 190 GLU 97 191 THR 98 192 GLY 99 193 ALA 100 194 LYS 101 195 ILE 102 196 SER 103 197 VAL 104 198 LEU 105 199 GLY 106 200 LYS 107 201 GLY 108 202 SER 109 203 MET 110 204 ARG 111 205 ASP 112 206 LYS 113 207 ALA 114 208 LYS 115 209 GLU 116 210 GLU 117 211 GLU 118 212 LEU 119 213 ARG 120 214 LYS 121 215 GLY 122 216 GLY 123 217 ASP 124 218 PRO 125 219 LYS 126 220 TYR 127 221 ALA 128 222 HIS 129 223 LEU 130 224 ASN 131 225 MET 132 226 ASP 133 227 LEU 134 228 HIS 135 229 VAL 136 230 PHE 137 231 ILE 138 232 GLU 139 233 VAL 140 234 PHE 141 235 GLY 142 236 PRO 143 237 PRO 144 238 CYS 145 239 GLU 146 240 ALA 147 241 TYR 148 242 ALA 149 243 LEU 150 244 MET 151 245 ALA 152 246 HIS 153 247 ALA 154 248 MET 155 249 GLU 156 250 GLU 157 251 VAL 158 252 LYS 159 253 LYS 160 254 PHE 161 255 LEU 162 256 VAL 163 257 PRO 164 258 ASP 165 259 MET 166 260 MET 167 261 ASP 168 262 ASP 169 263 ILE 170 264 CYS 171 265 GLN 172 266 GLU 173 267 GLN 174 268 PHE 175 269 LEU 176 270 GLU 177 271 LEU 178 272 SER 179 273 TYR 180 274 LEU 181 275 ASN 182 276 GLY 183 277 VAL 184 278 PRO 185 279 GLU 186 280 PRO 187 281 SER 188 282 ARG 189 283 GLY stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date . loop_ _Database_name _Database_accession_code _Database_entry_mol_name _Sequence_query_to_submitted_percentage _Sequence_subject_length _Sequence_identity _Sequence_positive _Sequence_homology_expectation_value UNP Q07666 KHDR1_human . . . . . 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 $Sam68 human 9606 Eukaryota Metazoa Homo sapiens KHDRBS1 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 $Sam68 'recombinant technology' . Escherichia coli Rosetta pLEICS-01 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 $Sam68 0.5 mM [U-15N] $Sam68 1 mM '[U-13C; U-15N]' H2O 93 % 'natural abundance' D2O 7 % 'natural abundance' Tris 10 mM 'natural abundance' NaCl 100 mM 'natural abundance' beta-mercapto-ethanol 0.1 % 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_SPARKY _Saveframe_category software _Name SPARKY _Version 3.110 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 Bruker _Model DRX _Field_strength 600 _Details . save_ save_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model DRX _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_HNCA_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $sample_1 save_ save_3D_HNCACB_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_1 save_ save_3D_CBCA(CO)NH_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _Sample_label $sample_1 save_ save_3D_1H-15N_NOESY_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N NOESY' _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' 50 . mM pH 7.0 . pH pressure 1 . atm temperature 303 . 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 water N 15 protons ppm 4.7 internal 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_ _Software_label $SPARKY stop_ loop_ _Experiment_label '2D 1H-15N HSQC' '3D HNCA' '3D HNCACB' '3D CBCA(CO)NH' '3D 1H-15N NOESY' 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 Sam68 _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 97 3 MET H H 8.439 0.05 1 2 97 3 MET N N 119.282 0.2 1 3 98 4 GLU H H 8.324 0.05 1 4 98 4 GLU N N 123.342 0.2 1 5 100 6 GLU H H 8.640 0.05 1 6 100 6 GLU N N 120.875 0.2 1 7 101 7 ASN H H 8.341 0.05 1 8 101 7 ASN N N 119.283 0.2 1 9 102 8 LYS H H 8.330 0.05 1 10 102 8 LYS N N 121.730 0.2 1 11 103 9 TYR H H 7.966 0.05 1 12 103 9 TYR N N 120.011 0.2 1 13 104 10 LEU H H 8.387 0.05 1 14 104 10 LEU N N 118.002 0.2 1 15 106 12 GLU H H 7.672 0.05 1 16 106 12 GLU N N 117.688 0.2 1 17 107 13 LEU H H 8.207 0.05 1 18 107 13 LEU N N 120.724 0.2 1 19 108 14 MET H H 8.277 0.05 1 20 108 14 MET N N 116.578 0.2 1 21 109 15 ALA H H 7.909 0.05 1 22 109 15 ALA N N 121.060 0.2 1 23 110 16 GLU H H 7.900 0.05 1 24 110 16 GLU N N 119.872 0.2 1 25 111 17 LYS H H 8.309 0.05 1 26 111 17 LYS N N 119.540 0.2 1 27 112 18 ASP H H 7.989 0.05 1 28 112 18 ASP N N 115.409 0.2 1 29 113 19 SER H H 7.625 0.05 1 30 113 19 SER N N 112.258 0.2 1 31 114 20 LEU H H 7.781 0.05 1 32 114 20 LEU N N 126.609 0.2 1 33 115 21 ASP H H 8.105 0.05 1 34 115 21 ASP N N 127.441 0.2 1 35 117 23 SER H H 8.749 0.05 1 36 117 23 SER N N 114.806 0.2 1 37 118 24 PHE H H 7.996 0.05 1 38 118 24 PHE N N 124.991 0.2 1 39 119 25 THR H H 7.369 0.05 1 40 119 25 THR N N 115.863 0.2 1 41 120 26 HIS H H 11.904 0.05 1 42 120 26 HIS N N 127.125 0.2 1 43 121 27 ALA H H 11.049 0.05 1 44 121 27 ALA N N 127.312 0.2 1 45 122 28 MET H H 8.492 0.05 1 46 122 28 MET N N 114.874 0.2 1 47 123 29 GLN H H 7.953 0.05 1 48 123 29 GLN N N 122.560 0.2 1 49 124 30 LEU H H 8.880 0.05 1 50 124 30 LEU N N 121.329 0.2 1 51 125 31 LEU H H 8.674 0.05 1 52 125 31 LEU N N 120.972 0.2 1 53 126 32 THR H H 8.165 0.05 1 54 126 32 THR N N 114.732 0.2 1 55 127 33 ALA H H 8.237 0.05 1 56 127 33 ALA N N 123.318 0.2 1 57 128 34 GLU H H 7.884 0.05 1 58 128 34 GLU N N 121.532 0.2 1 59 129 35 ILE H H 8.210 0.05 1 60 129 35 ILE N N 119.728 0.2 1 61 130 36 GLU H H 8.037 0.05 1 62 130 36 GLU N N 118.067 0.2 1 63 131 37 LYS H H 7.935 0.05 1 64 131 37 LYS N N 119.709 0.2 1 65 132 38 ILE H H 7.969 0.05 1 66 132 38 ILE N N 119.447 0.2 1 67 133 39 GLN H H 8.463 0.05 1 68 133 39 GLN N N 118.939 0.2 1 69 134 40 LYS H H 8.053 0.05 1 70 134 40 LYS N N 117.519 0.2 1 71 135 41 GLY H H 7.738 0.05 1 72 135 41 GLY N N 107.446 0.2 1 73 136 42 ASP H H 8.201 0.05 1 74 136 42 ASP N N 120.393 0.2 1 75 137 43 SER H H 8.216 0.05 1 76 137 43 SER N N 116.232 0.2 1 77 138 44 LYS H H 8.280 0.05 1 78 138 44 LYS N N 123.318 0.2 1 79 139 45 LYS H H 8.329 0.05 1 80 139 45 LYS N N 123.279 0.2 1 81 140 46 ASP H H 8.368 0.05 1 82 140 46 ASP N N 121.764 0.2 1 83 141 47 ASP H H 8.223 0.05 1 84 141 47 ASP N N 120.309 0.2 1 85 143 49 GLU H H 8.251 0.05 1 86 143 49 GLU N N 120.456 0.2 1 87 144 50 ASN H H 8.127 0.05 1 88 144 50 ASN N N 119.399 0.2 1 89 145 51 TYR H H 7.957 0.05 1 90 145 51 TYR N N 118.858 0.2 1 91 146 52 LEU H H 9.303 0.05 1 92 146 52 LEU N N 122.332 0.2 1 93 147 53 ASP H H 8.750 0.05 1 94 147 53 ASP N N 122.913 0.2 1 95 148 54 LEU H H 9.241 0.05 1 96 148 54 LEU N N 123.472 0.2 1 97 149 55 PHE H H 8.537 0.05 1 98 149 55 PHE N N 117.359 0.2 1 99 150 56 SER H H 7.351 0.05 1 100 150 56 SER N N 114.677 0.2 1 101 152 58 LYS H H 7.960 0.05 1 102 152 58 LYS N N 121.589 0.2 1 103 153 59 ASN H H 8.457 0.05 1 104 153 59 ASN N N 122.180 0.2 1 105 154 60 MET H H 8.853 0.05 1 106 154 60 MET N N 121.288 0.2 1 107 155 61 LYS H H 8.235 0.05 1 108 155 61 LYS N N 120.007 0.2 1 109 156 62 LEU H H 8.363 0.05 1 110 156 62 LEU N N 123.642 0.2 1 111 157 63 LYS H H 8.398 0.05 1 112 157 63 LYS N N 119.458 0.2 1 113 158 64 GLU H H 8.561 0.05 1 114 158 64 GLU N N 119.800 0.2 1 115 159 65 ARG H H 9.105 0.05 1 116 159 65 ARG N N 120.189 0.2 1 117 160 66 VAL H H 9.730 0.05 1 118 160 66 VAL N N 123.667 0.2 1 119 161 67 LEU H H 8.952 0.05 1 120 161 67 LEU N N 128.260 0.2 1 121 162 68 ILE H H 7.303 0.05 1 122 162 68 ILE N N 122.382 0.2 1 123 164 70 VAL H H 8.754 0.05 1 124 164 70 VAL N N 122.154 0.2 1 125 165 71 LYS H H 8.299 0.05 1 126 165 71 LYS N N 118.027 0.2 1 127 166 72 GLN H H 7.403 0.05 1 128 166 72 GLN N N 117.137 0.2 1 129 167 73 TYR H H 7.374 0.05 1 130 167 73 TYR N N 115.610 0.2 1 131 169 75 LYS H H 8.649 0.05 1 132 169 75 LYS N N 116.317 0.2 1 133 170 76 PHE H H 7.438 0.05 1 134 170 76 PHE N N 120.965 0.2 1 135 172 78 PHE H H 8.092 0.05 1 136 172 78 PHE N N 123.670 0.2 1 137 173 79 VAL H H 8.283 0.05 1 138 173 79 VAL N N 117.904 0.2 1 139 174 80 GLY H H 7.696 0.05 1 140 174 80 GLY N N 103.892 0.2 1 141 175 81 LYS H H 7.201 0.05 1 142 175 81 LYS N N 121.351 0.2 1 143 176 82 ILE H H 7.997 0.05 1 144 176 82 ILE N N 117.477 0.2 1 145 177 83 LEU H H 7.994 0.05 1 146 177 83 LEU N N 114.544 0.2 1 147 178 84 GLY H H 7.498 0.05 1 148 178 84 GLY N N 104.896 0.2 1 149 181 87 GLY H H 8.025 0.05 1 150 181 87 GLY N N 106.309 0.2 1 151 182 88 ASN H H 8.292 0.05 1 152 182 88 ASN N N 117.623 0.2 1 153 183 89 THR H H 7.432 0.05 1 154 183 89 THR N N 123.212 0.2 1 155 184 90 ILE H H 7.592 0.05 1 156 184 90 ILE N N 124.453 0.2 1 157 185 91 LYS H H 7.674 0.05 1 158 185 91 LYS N N 120.498 0.2 1 159 189 95 GLU H H 8.040 0.05 1 160 189 95 GLU N N 120.663 0.2 1 161 190 96 GLU H H 8.707 0.05 1 162 190 96 GLU N N 116.774 0.2 1 163 191 97 THR H H 7.720 0.05 1 164 191 97 THR N N 105.069 0.2 1 165 192 98 GLY H H 8.065 0.05 1 166 192 98 GLY N N 109.796 0.2 1 167 193 99 ALA H H 7.795 0.05 1 168 193 99 ALA N N 121.702 0.2 1 169 194 100 LYS H H 8.527 0.05 1 170 194 100 LYS N N 121.193 0.2 1 171 195 101 ILE H H 8.093 0.05 1 172 195 101 ILE N N 125.457 0.2 1 173 196 102 SER H H 8.625 0.05 1 174 196 102 SER N N 118.974 0.2 1 175 197 103 VAL H H 8.664 0.05 1 176 197 103 VAL N N 124.380 0.2 1 177 198 104 LEU H H 8.279 0.05 1 178 198 104 LEU N N 127.555 0.2 1 179 199 105 GLY H H 9.845 0.05 1 180 199 105 GLY N N 106.469 0.2 1 181 200 106 LYS H H 8.620 0.05 1 182 200 106 LYS N N 121.409 0.2 1 183 201 107 GLY H H 11.141 0.05 1 184 201 107 GLY N N 117.415 0.2 1 185 202 108 SER H H 8.469 0.05 1 186 202 108 SER N N 115.721 0.2 1 187 205 111 ASP H H 7.767 0.05 1 188 205 111 ASP N N 117.006 0.2 1 189 206 112 LYS H H 8.560 0.05 1 190 206 112 LYS N N 126.456 0.2 1 191 207 113 ALA H H 8.168 0.05 1 192 207 113 ALA N N 121.989 0.2 1 193 208 114 LYS H H 7.752 0.05 1 194 208 114 LYS N N 121.073 0.2 1 195 209 115 GLU H H 8.200 0.05 1 196 209 115 GLU N N 118.218 0.2 1 197 210 116 GLU H H 7.793 0.05 1 198 210 116 GLU N N 117.244 0.2 1 199 211 117 GLU H H 7.555 0.05 1 200 211 117 GLU N N 118.930 0.2 1 201 212 118 LEU H H 8.184 0.05 1 202 212 118 LEU N N 119.765 0.2 1 203 213 119 ARG H H 8.562 0.05 1 204 213 119 ARG N N 121.200 0.2 1 205 214 120 LYS H H 7.927 0.05 1 206 214 120 LYS N N 117.665 0.2 1 207 215 121 GLY H H 7.644 0.05 1 208 215 121 GLY N N 105.434 0.2 1 209 216 122 GLY H H 7.310 0.05 1 210 216 122 GLY N N 105.361 0.2 1 211 217 123 ASP H H 8.936 0.05 1 212 217 123 ASP N N 124.562 0.2 1 213 219 125 LYS H H 8.832 0.05 1 214 219 125 LYS N N 120.083 0.2 1 215 220 126 TYR H H 7.721 0.05 1 216 220 126 TYR N N 115.103 0.2 1 217 221 127 ALA H H 7.426 0.05 1 218 221 127 ALA N N 123.994 0.2 1 219 222 128 HIS H H 8.133 0.05 1 220 222 128 HIS N N 115.772 0.2 1 221 223 129 LEU H H 7.391 0.05 1 222 223 129 LEU N N 119.721 0.2 1 223 224 130 ASN H H 7.606 0.05 1 224 224 130 ASN N N 114.431 0.2 1 225 225 131 MET H H 8.187 0.05 1 226 225 131 MET N N 120.060 0.2 1 227 226 132 ASP H H 8.243 0.05 1 228 226 132 ASP N N 120.159 0.2 1 229 227 133 LEU H H 8.750 0.05 1 230 227 133 LEU N N 122.947 0.2 1 231 228 134 HIS H H 9.279 0.05 1 232 228 134 HIS N N 123.547 0.2 1 233 229 135 VAL H H 9.406 0.05 1 234 229 135 VAL N N 118.256 0.2 1 235 230 136 PHE H H 9.704 0.05 1 236 230 136 PHE N N 131.128 0.2 1 237 231 137 ILE H H 8.906 0.05 1 238 231 137 ILE N N 129.123 0.2 1 239 232 138 GLU H H 8.885 0.05 1 240 232 138 GLU N N 124.849 0.2 1 241 233 139 VAL H H 8.766 0.05 1 242 233 139 VAL N N 120.652 0.2 1 243 234 140 PHE H H 8.258 0.05 1 244 234 140 PHE N N 123.469 0.2 1 245 235 141 GLY H H 8.411 0.05 1 246 235 141 GLY N N 109.853 0.2 1 247 238 144 CYS H H 8.710 0.05 1 248 238 144 CYS N N 112.911 0.2 1 249 239 145 GLU H H 8.127 0.05 1 250 239 145 GLU N N 120.491 0.2 1 251 240 146 ALA H H 8.993 0.05 1 252 240 146 ALA N N 122.044 0.2 1 253 241 147 TYR H H 7.883 0.05 1 254 241 147 TYR N N 115.092 0.2 1 255 242 148 ALA H H 7.400 0.05 1 256 242 148 ALA N N 121.045 0.2 1 257 243 149 LEU H H 8.815 0.05 1 258 243 149 LEU N N 120.703 0.2 1 259 253 159 LYS H H 7.157 0.05 1 260 253 159 LYS N N 114.342 0.2 1 261 254 160 PHE H H 7.925 0.05 1 262 254 160 PHE N N 116.106 0.2 1 263 255 161 LEU H H 7.602 0.05 1 264 255 161 LEU N N 117.197 0.2 1 265 256 162 VAL H H 6.958 0.05 1 266 256 162 VAL N N 115.401 0.2 1 267 258 164 ASP H H 6.896 0.05 1 268 258 164 ASP N N 119.516 0.2 1 269 259 165 MET H H 8.026 0.05 1 270 259 165 MET N N 119.384 0.2 1 271 268 174 PHE H H 8.175 0.05 1 272 268 174 PHE N N 120.541 0.2 1 273 269 175 LEU H H 8.011 0.05 1 274 269 175 LEU N N 123.051 0.2 1 275 270 176 GLU H H 8.246 0.05 1 276 270 176 GLU N N 121.263 0.2 1 277 271 177 LEU H H 8.085 0.05 1 278 271 177 LEU N N 122.224 0.2 1 279 272 178 SER H H 8.133 0.05 1 280 272 178 SER N N 115.772 0.2 1 281 273 179 TYR H H 7.959 0.05 1 282 273 179 TYR N N 121.397 0.2 1 283 274 180 LEU H H 7.953 0.05 1 284 274 180 LEU N N 122.560 0.2 1 285 275 181 ASN H H 8.252 0.05 1 286 275 181 ASN N N 118.371 0.2 1 287 276 182 GLY H H 8.126 0.05 1 288 276 182 GLY N N 108.418 0.2 1 stop_ save_