data_50133 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Backbone 1H and 15N chemical shift assignments of chimeric SC Sup35NM, 5MT-B ; _BMRB_accession_number 50133 _BMRB_flat_file_name bmr50133.str _Entry_type original _Submission_date 2019-12-15 _Accession_date 2019-12-15 _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 Shida Toshinobu . . 2 Kamatari Yuji O. . 3 Yamaguchi Yoshiki . . 4 Kuwata Kazuo . . 5 Tanaka Motomasa . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 244 "15N chemical shifts" 244 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2020-06-23 update BMRB 'update entry citation' 2020-03-30 original author 'original release' stop_ loop_ _Related_BMRB_accession_number _Relationship 12016 'Solution SC Sup35NM' 50131 'KL Sup35NM' 50132 'Chimeric SC Sup35NM, 5MT-A' 50134 'Chimeric SC Sup35NM, 4MT-A' stop_ _Original_release_date 2019-12-16 save_ ############################# # Citation for this entry # ############################# save_citations_1 _Saveframe_category entry_citation _Citation_full . _Citation_title ; Short Disordered Protein Segment Regulates Cross-Species Transmission of a Yeast Prion ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 32284601 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Shida Toshinobu . . 2 Kamatari Yuji O. . 3 Yoda Takao . . 4 Yamaguchi Yoshiki . . 5 Feig Michael . . 6 Ohhashi Yumiko . . 7 Sugita Yuji . . 8 Kuwata Kazuo . . 9 Tanaka Motomasa . . stop_ _Journal_abbreviation 'Nat. Chem. Biol.' _Journal_volume 16 _Journal_issue 7 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 756 _Page_last 765 _Year 2020 _Details . save_ ################################## # Molecular system description # ################################## save_assembly_1 _Saveframe_category molecular_system _Mol_system_name 'Chimeric SC Sup35NM, 5MT-B' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 5MT-B $entity_1 stop_ _System_molecular_weight . _System_physical_state 'intrinsically disordered' _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_entity_1 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common entity_1 _Molecular_mass . _Mol_thiol_state 'not present' loop_ _Biological_function 'Translation termination factor' stop_ _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 260 _Mol_residue_sequence ; MSDSNQGNNQQNYQQYNQYG QYQQYNNRYQGYQAYNAQAQ PAGGYYQNYQGYSGYQQGGY QQYNPDAGYQQQYNPQGGYQ QYNPQGGYQQQFNPQGGRGN YKNFNYNNNLQGYQAGFQPQ SQGMSLNDFQKQQKQAAPKP KKTLKLVSSSGIKLANATKK VGTKPAESDKKEEEKSAETK EPTKEPTKVEEPVKKEEKPV QTEEKTEEKSELPKVEDLKI SESTHNTNNANVTSADALIK EQEEEVDDEVVNDHHHHHHH ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 1 MET 2 2 SER 3 3 ASP 4 4 SER 5 5 ASN 6 6 GLN 7 7 GLY 8 8 ASN 9 9 ASN 10 10 GLN 11 11 GLN 12 12 ASN 13 13 TYR 14 14 GLN 15 15 GLN 16 16 TYR 17 17 ASN 18 18 GLN 19 19 TYR 20 20 GLY 21 21 GLN 22 22 TYR 23 23 GLN 24 24 GLN 25 25 TYR 26 26 ASN 27 27 ASN 28 28 ARG 29 29 TYR 30 30 GLN 31 31 GLY 32 32 TYR 33 33 GLN 34 34 ALA 35 35 TYR 36 36 ASN 37 37 ALA 38 38 GLN 39 39 ALA 40 40 GLN 41 41 PRO 42 42 ALA 43 43 GLY 44 44 GLY 45 45 TYR 46 46 TYR 47 47 GLN 48 48 ASN 49 49 TYR 50 50 GLN 51 51 GLY 52 52 TYR 53 53 SER 54 54 GLY 55 55 TYR 56 56 GLN 57 57 GLN 58 58 GLY 59 59 GLY 60 60 TYR 61 61 GLN 62 62 GLN 63 63 TYR 64 64 ASN 65 65 PRO 66 66 ASP 67 67 ALA 68 68 GLY 69 69 TYR 70 70 GLN 71 71 GLN 72 72 GLN 73 73 TYR 74 74 ASN 75 75 PRO 76 76 GLN 77 77 GLY 78 78 GLY 79 79 TYR 80 80 GLN 81 81 GLN 82 82 TYR 83 83 ASN 84 84 PRO 85 85 GLN 86 86 GLY 87 87 GLY 88 88 TYR 89 89 GLN 90 90 GLN 91 91 GLN 92 92 PHE 93 93 ASN 94 94 PRO 95 95 GLN 96 96 GLY 97 97 GLY 98 98 ARG 99 99 GLY 100 100 ASN 101 101 TYR 102 102 LYS 103 103 ASN 104 104 PHE 105 105 ASN 106 106 TYR 107 107 ASN 108 108 ASN 109 109 ASN 110 110 LEU 111 111 GLN 112 112 GLY 113 113 TYR 114 114 GLN 115 115 ALA 116 116 GLY 117 117 PHE 118 118 GLN 119 119 PRO 120 120 GLN 121 121 SER 122 122 GLN 123 123 GLY 124 124 MET 125 125 SER 126 126 LEU 127 127 ASN 128 128 ASP 129 129 PHE 130 130 GLN 131 131 LYS 132 132 GLN 133 133 GLN 134 134 LYS 135 135 GLN 136 136 ALA 137 137 ALA 138 138 PRO 139 139 LYS 140 140 PRO 141 141 LYS 142 142 LYS 143 143 THR 144 144 LEU 145 145 LYS 146 146 LEU 147 147 VAL 148 148 SER 149 149 SER 150 150 SER 151 151 GLY 152 152 ILE 153 153 LYS 154 154 LEU 155 155 ALA 156 156 ASN 157 157 ALA 158 158 THR 159 159 LYS 160 160 LYS 161 161 VAL 162 162 GLY 163 163 THR 164 164 LYS 165 165 PRO 166 166 ALA 167 167 GLU 168 168 SER 169 169 ASP 170 170 LYS 171 171 LYS 172 172 GLU 173 173 GLU 174 174 GLU 175 175 LYS 176 176 SER 177 177 ALA 178 178 GLU 179 179 THR 180 180 LYS 181 181 GLU 182 182 PRO 183 183 THR 184 184 LYS 185 185 GLU 186 186 PRO 187 187 THR 188 188 LYS 189 189 VAL 190 190 GLU 191 191 GLU 192 192 PRO 193 193 VAL 194 194 LYS 195 195 LYS 196 196 GLU 197 197 GLU 198 198 LYS 199 199 PRO 200 200 VAL 201 201 GLN 202 202 THR 203 203 GLU 204 204 GLU 205 205 LYS 206 206 THR 207 207 GLU 208 208 GLU 209 209 LYS 210 210 SER 211 211 GLU 212 212 LEU 213 213 PRO 214 214 LYS 215 215 VAL 216 216 GLU 217 217 ASP 218 218 LEU 219 219 LYS 220 220 ILE 221 221 SER 222 222 GLU 223 223 SER 224 224 THR 225 225 HIS 226 226 ASN 227 227 THR 228 228 ASN 229 229 ASN 230 230 ALA 231 231 ASN 232 232 VAL 233 233 THR 234 234 SER 235 235 ALA 236 236 ASP 237 237 ALA 238 238 LEU 239 239 ILE 240 240 LYS 241 241 GLU 242 242 GLN 243 243 GLU 244 244 GLU 245 245 GLU 246 246 VAL 247 247 ASP 248 248 ASP 249 249 GLU 250 250 VAL 251 251 VAL 252 252 ASN 253 253 ASP 254 254 HIS 255 255 HIS 256 256 HIS 257 257 HIS 258 258 HIS 259 259 HIS 260 260 HIS 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 GB AAA35133 'SC Sup35' . . . . . GB AAF99684 'SC Sup35' . . . . . GB AF206288 'KL Sup35' . . . . . GB AB039749 'KL Sup35' . . . . . stop_ save_ #################### # Natural source # #################### save_natural_source_1 _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $entity_1 "baker's yeast" 4932 Eukaryota Fungi Saccharomyces cerevisiae $entity_1 'budding yeasts' 28985 Eukaryota Fungi Kluyveromyces lactis stop_ save_ ######################### # Experimental source # ######################### save_experimental_source_1 _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_type _Vector_name $entity_1 'recombinant technology' . Escherichia coli 'Rosetta (DE3)' plasmid pET29b 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 $entity_1 60 uM '[U-99% 15N]' MES 50 mM 'natural abundance' H2O 90 % 'natural abundance' D2O 10 % '[U-99% 2H]' stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Saveframe_category software _Name SPARKY _Version 3.114 loop_ _Vendor _Address _Electronic_address Goddard 'University of California, San Francisco' https://www.cgl.ucsf.edu/home/sparky/ stop_ loop_ _Task 'data analysis' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 600 _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_ ####################### # 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 4.0 . pH pressure 1 . atm temperature 310.15 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_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 H 1 'methyl protons' ppm 0 internal direct . . . 1.000000000 DSS N 15 'methyl protons' ppm 0 na 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_chemical_shifts_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Software_label $software_1 stop_ loop_ _Experiment_label '2D 1H-15N HSQC' stop_ loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chem_shift_reference_1 _Mol_system_component_name 5MT-B _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 3 3 ASP H H 8.792 0.01 1 2 3 3 ASP N N 121.463 0.1 1 3 4 4 SER H H 8.413 0.01 1 4 4 4 SER N N 116.374 0.1 1 5 5 5 ASN H H 8.482 0.01 1 6 5 5 ASN N N 120.630 0.1 1 7 6 6 GLN H H 8.292 0.01 1 8 6 6 GLN N N 120.262 0.1 1 9 7 7 GLY H H 8.378 0.01 1 10 7 7 GLY N N 109.385 0.1 1 11 8 8 ASN H H 8.269 0.01 1 12 8 8 ASN N N 118.590 0.1 1 13 9 9 ASN H H 8.418 0.01 1 14 9 9 ASN N N 119.159 0.1 1 15 10 10 GLN H H 8.312 0.01 1 16 10 10 GLN N N 120.095 0.1 1 17 11 11 GLN H H 8.312 0.01 1 18 11 11 GLN N N 120.442 0.1 1 19 12 12 ASN H H 8.287 0.01 1 20 12 12 ASN N N 119.189 0.1 1 21 13 13 TYR H H 8.050 0.01 1 22 13 13 TYR N N 120.555 0.1 1 23 14 14 GLN H H 8.169 0.01 1 24 14 14 GLN N N 121.232 0.1 1 25 15 15 GLN H H 8.139 0.01 1 26 15 15 GLN N N 120.371 0.1 1 27 16 16 TYR H H 8.044 0.01 1 28 16 16 TYR N N 120.252 0.1 1 29 17 17 ASN H H 8.208 0.01 1 30 17 17 ASN N N 119.985 0.1 1 31 18 18 GLN H H 8.242 0.01 1 32 18 18 GLN N N 120.214 0.1 1 33 19 19 TYR H H 8.067 0.01 1 34 19 19 TYR N N 119.775 0.1 1 35 20 20 GLY H H 8.126 0.01 1 36 20 20 GLY N N 109.483 0.1 1 37 21 21 GLN H H 8.099 0.01 1 38 21 21 GLN N N 119.584 0.1 1 39 22 22 TYR H H 8.149 0.01 1 40 22 22 TYR N N 120.597 0.1 1 41 23 23 GLN H H 8.128 0.01 1 42 23 23 GLN N N 121.399 0.1 1 43 24 24 GLN H H 8.188 0.01 1 44 24 24 GLN N N 120.497 0.1 1 45 25 25 TYR H H 8.091 0.01 1 46 25 25 TYR N N 120.423 0.1 1 47 26 26 ASN H H 8.218 0.01 1 48 26 26 ASN N N 119.740 0.1 1 49 27 27 ASN H H 8.227 0.01 1 50 27 27 ASN N N 118.886 0.1 1 51 28 28 ARG H H 8.083 0.01 1 52 28 28 ARG N N 120.287 0.1 1 53 29 29 TYR H H 8.037 0.01 1 54 29 29 TYR N N 120.182 0.1 1 55 30 30 GLN H H 8.147 0.01 1 56 30 30 GLN N N 121.915 0.1 1 57 31 31 GLY H H 7.869 0.01 1 58 31 31 GLY N N 109.039 0.1 1 59 32 32 TYR H H 7.963 0.01 1 60 32 32 TYR N N 120.047 0.1 1 61 33 33 GLN H H 8.134 0.01 1 62 33 33 GLN N N 122.301 0.1 1 63 34 34 ALA H H 8.045 0.01 1 64 34 34 ALA N N 124.539 0.1 1 65 35 35 TYR H H 7.988 0.01 1 66 35 35 TYR N N 119.003 0.1 1 67 36 36 ASN H H 8.115 0.01 1 68 36 36 ASN N N 120.782 0.1 1 69 37 37 ALA H H 8.105 0.01 1 70 37 37 ALA N N 124.403 0.1 1 71 38 38 GLN H H 8.108 0.01 1 72 38 38 GLN N N 117.819 0.1 1 73 39 39 ALA H H 8.020 0.01 1 74 39 39 ALA N N 124.207 0.1 1 75 40 40 GLN H H 8.133 0.01 1 76 40 40 GLN N N 120.011 0.1 1 77 42 42 ALA H H 8.360 0.01 1 78 42 42 ALA N N 124.352 0.1 1 79 43 43 GLY H H 8.289 0.01 1 80 43 43 GLY N N 107.954 0.1 1 81 44 44 GLY H H 8.072 0.01 1 82 44 44 GLY N N 108.081 0.1 1 83 45 45 TYR H H 7.942 0.01 1 84 45 45 TYR N N 119.751 0.1 1 85 46 46 TYR H H 8.017 0.01 1 86 46 46 TYR N N 120.952 0.1 1 87 47 47 GLN H H 8.051 0.01 1 88 47 47 GLN N N 121.110 0.1 1 89 48 48 ASN H H 8.198 0.01 1 90 48 48 ASN N N 118.962 0.1 1 91 49 49 TYR H H 8.055 0.01 1 92 49 49 TYR N N 120.606 0.1 1 93 50 50 GLN H H 8.208 0.01 1 94 50 50 GLN N N 121.887 0.1 1 95 51 51 GLY H H 7.798 0.01 1 96 51 51 GLY N N 108.768 0.1 1 97 52 52 TYR H H 7.949 0.01 1 98 52 52 TYR N N 120.073 0.1 1 99 53 53 SER H H 8.255 0.01 1 100 53 53 SER N N 117.997 0.1 1 101 54 54 GLY H H 7.753 0.01 1 102 54 54 GLY N N 109.833 0.1 1 103 55 55 TYR H H 7.929 0.01 1 104 55 55 TYR N N 119.935 0.1 1 105 56 56 GLN H H 8.182 0.01 1 106 56 56 GLN N N 122.108 0.1 1 107 57 57 GLN H H 8.255 0.01 1 108 57 57 GLN N N 121.272 0.1 1 109 58 58 GLY H H 8.331 0.01 1 110 58 58 GLY N N 109.862 0.1 1 111 59 59 GLY H H 8.136 0.01 1 112 59 59 GLY N N 108.367 0.1 1 113 60 60 TYR H H 8.005 0.01 1 114 60 60 TYR N N 119.884 0.1 1 115 61 61 GLN H H 8.218 0.01 1 116 61 61 GLN N N 121.911 0.1 1 117 62 62 GLN H H 8.176 0.01 1 118 62 62 GLN N N 120.979 0.1 1 119 63 63 TYR H H 8.151 0.01 1 120 63 63 TYR N N 121.554 0.1 1 121 64 64 ASN H H 8.169 0.01 1 122 64 64 ASN N N 122.672 0.1 1 123 66 66 ASP H H 8.125 0.01 1 124 66 66 ASP N N 118.033 0.1 1 125 67 67 ALA H H 7.827 0.01 1 126 67 67 ALA N N 123.487 0.1 1 127 68 68 GLY H H 8.199 0.01 1 128 68 68 GLY N N 107.031 0.1 1 129 69 69 TYR H H 7.902 0.01 1 130 69 69 TYR N N 119.941 0.1 1 131 70 70 GLN H H 8.194 0.01 1 132 70 70 GLN N N 121.471 0.1 1 133 71 71 GLN H H 8.203 0.01 1 134 71 71 GLN N N 120.772 0.1 1 135 72 72 GLN H H 8.243 0.01 1 136 72 72 GLN N N 120.588 0.1 1 137 73 73 TYR H H 8.151 0.01 1 138 73 73 TYR N N 121.283 0.1 1 139 74 74 ASN H H 8.211 0.01 1 140 74 74 ASN N N 122.256 0.1 1 141 76 76 GLN H H 8.226 0.01 1 142 76 76 GLN N N 118.760 0.1 1 143 77 77 GLY H H 8.118 0.01 1 144 77 77 GLY N N 108.997 0.1 1 145 78 78 GLY H H 8.096 0.01 1 146 78 78 GLY N N 108.346 0.1 1 147 79 79 TYR H H 8.031 0.01 1 148 79 79 TYR N N 119.891 0.1 1 149 80 80 GLN H H 8.237 0.01 1 150 80 80 GLN N N 121.927 0.1 1 151 81 81 GLN H H 8.190 0.01 1 152 81 81 GLN N N 120.958 0.1 1 153 82 82 TYR H H 8.153 0.01 1 154 82 82 TYR N N 121.462 0.1 1 155 83 83 ASN H H 8.211 0.01 1 156 83 83 ASN N N 122.411 0.1 1 157 85 85 GLN H H 8.238 0.01 1 158 85 85 GLN N N 118.749 0.1 1 159 86 86 GLY H H 8.129 0.01 1 160 86 86 GLY N N 109.006 0.1 1 161 87 87 GLY H H 8.107 0.01 1 162 87 87 GLY N N 108.343 0.1 1 163 88 88 TYR H H 8.047 0.01 1 164 88 88 TYR N N 120.072 0.1 1 165 89 89 GLN H H 8.262 0.01 1 166 89 89 GLN N N 121.737 0.1 1 167 90 90 GLN H H 8.222 0.01 1 168 90 90 GLN N N 120.974 0.1 1 169 91 91 GLN H H 8.248 0.01 1 170 91 91 GLN N N 120.657 0.1 1 171 92 92 PHE H H 8.170 0.01 1 172 92 92 PHE N N 121.013 0.1 1 173 93 93 ASN H H 8.252 0.01 1 174 93 93 ASN N N 121.728 0.1 1 175 95 95 GLN H H 8.287 0.01 1 176 95 95 GLN N N 118.914 0.1 1 177 96 96 GLY H H 8.176 0.01 1 178 96 96 GLY N N 109.133 0.1 1 179 97 97 GLY H H 8.172 0.01 1 180 97 97 GLY N N 108.497 0.1 1 181 98 98 ARG H H 8.210 0.01 1 182 98 98 ARG N N 120.126 0.1 1 183 99 99 GLY H H 8.345 0.01 1 184 99 99 GLY N N 109.204 0.1 1 185 100 100 ASN H H 8.181 0.01 1 186 100 100 ASN N N 118.644 0.1 1 187 101 101 TYR H H 8.043 0.01 1 188 101 101 TYR N N 120.654 0.1 1 189 102 102 LYS H H 8.075 0.01 1 190 102 102 LYS N N 122.151 0.1 1 191 103 103 ASN H H 8.125 0.01 1 192 103 103 ASN N N 118.692 0.1 1 193 104 104 PHE H H 8.045 0.01 1 194 104 104 PHE N N 120.595 0.1 1 195 105 105 ASN H H 8.179 0.01 1 196 105 105 ASN N N 120.085 0.1 1 197 106 106 TYR H H 7.984 0.01 1 198 106 106 TYR N N 120.827 0.1 1 199 107 107 ASN H H 8.225 0.01 1 200 107 107 ASN N N 119.687 0.1 1 201 108 108 ASN H H 8.206 0.01 1 202 108 108 ASN N N 118.941 0.1 1 203 109 109 ASN H H 8.309 0.01 1 204 109 109 ASN N N 118.424 0.1 1 205 110 110 LEU H H 8.076 0.01 1 206 110 110 LEU N N 121.694 0.1 1 207 111 111 GLN H H 8.215 0.01 1 208 111 111 GLN N N 119.915 0.1 1 209 112 112 GLY H H 8.233 0.01 1 210 112 112 GLY N N 109.237 0.1 1 211 113 113 TYR H H 7.975 0.01 1 212 113 113 TYR N N 120.148 0.1 1 213 114 114 GLN H H 8.184 0.01 1 214 114 114 GLN N N 122.427 0.1 1 215 115 115 ALA H H 8.139 0.01 1 216 115 115 ALA N N 124.911 0.1 1 217 116 116 GLY H H 8.222 0.01 1 218 116 116 GLY N N 107.642 0.1 1 219 117 117 PHE H H 7.976 0.01 1 220 117 117 PHE N N 120.024 0.1 1 221 118 118 GLN H H 8.126 0.01 1 222 118 118 GLN N N 123.653 0.1 1 223 120 120 GLN H H 8.494 0.01 1 224 120 120 GLN N N 120.021 0.1 1 225 121 121 SER H H 8.246 0.01 1 226 121 121 SER N N 116.565 0.1 1 227 122 122 GLN H H 8.385 0.01 1 228 122 122 GLN N N 121.902 0.1 1 229 123 123 GLY H H 8.384 0.01 1 230 123 123 GLY N N 109.576 0.1 1 231 124 124 MET H H 8.133 0.01 1 232 124 124 MET N N 119.785 0.1 1 233 125 125 SER H H 8.433 0.01 1 234 125 125 SER N N 117.322 0.1 1 235 126 126 LEU H H 8.325 0.01 1 236 126 126 LEU N N 124.036 0.1 1 237 127 127 ASN H H 8.319 0.01 1 238 127 127 ASN N N 118.181 0.1 1 239 128 128 ASP H H 8.120 0.01 1 240 128 128 ASP N N 119.802 0.1 1 241 129 129 PHE H H 8.128 0.01 1 242 129 129 PHE N N 120.563 0.1 1 243 130 130 GLN H H 8.222 0.01 1 244 130 130 GLN N N 119.868 0.1 1 245 131 131 LYS H H 8.031 0.01 1 246 131 131 LYS N N 120.687 0.1 1 247 132 132 GLN H H 8.107 0.01 1 248 132 132 GLN N N 119.790 0.1 1 249 133 133 GLN H H 8.207 0.01 1 250 133 133 GLN N N 120.931 0.1 1 251 134 134 LYS H H 8.218 0.01 1 252 134 134 LYS N N 122.013 0.1 1 253 135 135 GLN H H 8.263 0.01 1 254 135 135 GLN N N 121.262 0.1 1 255 136 136 ALA H H 8.262 0.01 1 256 136 136 ALA N N 125.715 0.1 1 257 137 137 ALA H H 8.202 0.01 1 258 137 137 ALA N N 124.950 0.1 1 259 139 139 LYS H H 8.349 0.01 1 260 139 139 LYS N N 122.805 0.1 1 261 141 141 LYS H H 8.391 0.01 1 262 141 141 LYS N N 122.188 0.1 1 263 142 142 LYS H H 8.322 0.01 1 264 142 142 LYS N N 122.965 0.1 1 265 143 143 THR H H 8.205 0.01 1 266 143 143 THR N N 116.923 0.1 1 267 144 144 LEU H H 8.287 0.01 1 268 144 144 LEU N N 125.704 0.1 1 269 145 145 LYS H H 8.274 0.01 1 270 145 145 LYS N N 123.159 0.1 1 271 146 146 LEU H H 8.252 0.01 1 272 146 146 LEU N N 124.754 0.1 1 273 147 147 VAL H H 8.175 0.01 1 274 147 147 VAL N N 121.696 0.1 1 275 148 148 SER H H 8.389 0.01 1 276 148 148 SER N N 119.640 0.1 1 277 149 149 SER H H 8.417 0.01 1 278 149 149 SER N N 118.231 0.1 1 279 150 150 SER H H 8.352 0.01 1 280 150 150 SER N N 117.640 0.1 1 281 151 151 GLY H H 8.365 0.01 1 282 151 151 GLY N N 110.685 0.1 1 283 152 152 ILE H H 7.903 0.01 1 284 152 152 ILE N N 120.310 0.1 1 285 153 153 LYS H H 8.342 0.01 1 286 153 153 LYS N N 125.775 0.1 1 287 154 154 LEU H H 8.218 0.01 1 288 154 154 LEU N N 124.299 0.1 1 289 155 155 ALA H H 8.282 0.01 1 290 155 155 ALA N N 124.883 0.1 1 291 156 156 ASN H H 8.310 0.01 1 292 156 156 ASN N N 117.704 0.1 1 293 157 157 ALA H H 8.203 0.01 1 294 157 157 ALA N N 124.372 0.1 1 295 158 158 THR H H 8.083 0.01 1 296 158 158 THR N N 113.495 0.1 1 297 159 159 LYS H H 8.213 0.01 1 298 159 159 LYS N N 124.005 0.1 1 299 160 160 LYS H H 8.333 0.01 1 300 160 160 LYS N N 123.591 0.1 1 301 161 161 VAL H H 8.199 0.01 1 302 161 161 VAL N N 122.067 0.1 1 303 162 162 GLY H H 8.484 0.01 1 304 162 162 GLY N N 112.632 0.1 1 305 163 163 THR H H 8.030 0.01 1 306 163 163 THR N N 113.972 0.1 1 307 164 164 LYS H H 8.364 0.01 1 308 164 164 LYS N N 125.133 0.1 1 309 166 166 ALA H H 8.407 0.01 1 310 166 166 ALA N N 124.456 0.1 1 311 167 167 GLU H H 8.373 0.01 1 312 167 167 GLU N N 119.904 0.1 1 313 168 168 SER H H 8.312 0.01 1 314 168 168 SER N N 116.456 0.1 1 315 169 169 ASP H H 8.365 0.01 1 316 169 169 ASP N N 122.125 0.1 1 317 170 170 LYS H H 8.183 0.01 1 318 170 170 LYS N N 121.685 0.1 1 319 171 171 LYS H H 8.285 0.01 1 320 171 171 LYS N N 122.230 0.1 1 321 172 172 GLU H H 8.347 0.01 1 322 172 172 GLU N N 121.309 0.1 1 323 173 173 GLU H H 8.348 0.01 1 324 173 173 GLU N N 121.406 0.1 1 325 174 174 GLU H H 8.341 0.01 1 326 174 174 GLU N N 121.754 0.1 1 327 175 175 LYS H H 8.300 0.01 1 328 175 175 LYS N N 122.397 0.1 1 329 176 176 SER H H 8.280 0.01 1 330 176 176 SER N N 116.748 0.1 1 331 177 177 ALA H H 8.300 0.01 1 332 177 177 ALA N N 125.714 0.1 1 333 178 178 GLU H H 8.251 0.01 1 334 178 178 GLU N N 119.293 0.1 1 335 179 179 THR H H 8.110 0.01 1 336 179 179 THR N N 115.571 0.1 1 337 180 180 LYS H H 8.277 0.01 1 338 180 180 LYS N N 123.963 0.1 1 339 181 181 GLU H H 8.349 0.01 1 340 181 181 GLU N N 123.065 0.1 1 341 183 183 THR H H 8.206 0.01 1 342 183 183 THR N N 114.979 0.1 1 343 184 184 LYS H H 8.310 0.01 1 344 184 184 LYS N N 124.082 0.1 1 345 185 185 GLU H H 8.375 0.01 1 346 185 185 GLU N N 123.388 0.1 1 347 187 187 THR H H 8.196 0.01 1 348 187 187 THR N N 115.037 0.1 1 349 188 188 LYS H H 8.302 0.01 1 350 188 188 LYS N N 124.393 0.1 1 351 189 189 VAL H H 8.169 0.01 1 352 189 189 VAL N N 122.412 0.1 1 353 190 190 GLU H H 8.428 0.01 1 354 190 190 GLU N N 125.016 0.1 1 355 191 191 GLU H H 8.363 0.01 1 356 191 191 GLU N N 123.410 0.1 1 357 193 193 VAL H H 8.144 0.01 1 358 193 193 VAL N N 120.541 0.1 1 359 194 194 LYS H H 8.333 0.01 1 360 194 194 LYS N N 125.648 0.1 1 361 195 195 LYS H H 8.344 0.01 1 362 195 195 LYS N N 123.763 0.1 1 363 196 196 GLU H H 8.434 0.01 1 364 196 196 GLU N N 122.383 0.1 1 365 197 197 GLU H H 8.419 0.01 1 366 197 197 GLU N N 122.841 0.1 1 367 198 198 LYS H H 8.330 0.01 1 368 198 198 LYS N N 123.776 0.1 1 369 200 200 VAL H H 8.211 0.01 1 370 200 200 VAL N N 120.615 0.1 1 371 201 201 GLN H H 8.461 0.01 1 372 201 201 GLN N N 124.202 0.1 1 373 202 202 THR H H 8.192 0.01 1 374 202 202 THR N N 115.990 0.1 1 375 203 203 GLU H H 8.407 0.01 1 376 203 203 GLU N N 122.802 0.1 1 377 204 204 GLU H H 8.404 0.01 1 378 204 204 GLU N N 122.163 0.1 1 379 205 205 LYS H H 8.382 0.01 1 380 205 205 LYS N N 122.649 0.1 1 381 206 206 THR H H 8.143 0.01 1 382 206 206 THR N N 115.495 0.1 1 383 207 207 GLU H H 8.392 0.01 1 384 207 207 GLU N N 122.767 0.1 1 385 208 208 GLU H H 8.353 0.01 1 386 208 208 GLU N N 122.047 0.1 1 387 209 209 LYS H H 8.341 0.01 1 388 209 209 LYS N N 122.468 0.1 1 389 210 210 SER H H 8.263 0.01 1 390 210 210 SER N N 116.627 0.1 1 391 211 211 GLU H H 8.330 0.01 1 392 211 211 GLU N N 122.353 0.1 1 393 212 212 LEU H H 8.168 0.01 1 394 212 212 LEU N N 124.492 0.1 1 395 214 214 LYS H H 8.326 0.01 1 396 214 214 LYS N N 121.728 0.1 1 397 215 215 VAL H H 8.134 0.01 1 398 215 215 VAL N N 121.541 0.1 1 399 216 216 GLU H H 8.465 0.01 1 400 216 216 GLU N N 123.758 0.1 1 401 217 217 ASP H H 8.317 0.01 1 402 217 217 ASP N N 121.188 0.1 1 403 218 218 LEU H H 8.143 0.01 1 404 218 218 LEU N N 123.041 0.1 1 405 219 219 LYS H H 8.257 0.01 1 406 219 219 LYS N N 121.592 0.1 1 407 220 220 ILE H H 7.995 0.01 1 408 220 220 ILE N N 121.210 0.1 1 409 221 221 SER H H 8.307 0.01 1 410 221 221 SER N N 119.146 0.1 1 411 222 222 GLU H H 8.352 0.01 1 412 222 222 GLU N N 122.493 0.1 1 413 223 223 SER H H 8.289 0.01 1 414 223 223 SER N N 116.281 0.1 1 415 224 224 THR H H 8.052 0.01 1 416 224 224 THR N N 115.068 0.1 1 417 225 225 HIS H H 8.438 0.01 1 418 225 225 HIS N N 120.166 0.1 1 419 226 226 ASN H H 8.481 0.01 1 420 226 226 ASN N N 120.380 0.1 1 421 227 227 THR H H 8.211 0.01 1 422 227 227 THR N N 114.345 0.1 1 423 228 228 ASN H H 8.459 0.01 1 424 228 228 ASN N N 120.834 0.1 1 425 229 229 ASN H H 8.362 0.01 1 426 229 229 ASN N N 119.504 0.1 1 427 230 230 ALA H H 8.221 0.01 1 428 230 230 ALA N N 123.931 0.1 1 429 231 231 ASN H H 8.353 0.01 1 430 231 231 ASN N N 117.549 0.1 1 431 232 232 VAL H H 7.993 0.01 1 432 232 232 VAL N N 119.918 0.1 1 433 233 233 THR H H 8.244 0.01 1 434 233 233 THR N N 117.341 0.1 1 435 234 234 SER H H 8.287 0.01 1 436 234 234 SER N N 118.158 0.1 1 437 235 235 ALA H H 8.388 0.01 1 438 235 235 ALA N N 125.855 0.1 1 439 236 236 ASP H H 8.206 0.01 1 440 236 236 ASP N N 117.859 0.1 1 441 237 237 ALA H H 8.012 0.01 1 442 237 237 ALA N N 123.451 0.1 1 443 238 238 LEU H H 7.959 0.01 1 444 238 238 LEU N N 119.725 0.1 1 445 239 239 ILE H H 7.813 0.01 1 446 239 239 ILE N N 120.495 0.1 1 447 240 240 LYS H H 8.078 0.01 1 448 240 240 LYS N N 123.187 0.1 1 449 241 241 GLU H H 8.173 0.01 1 450 241 241 GLU N N 120.271 0.1 1 451 242 242 GLN H H 8.242 0.01 1 452 242 242 GLN N N 120.131 0.1 1 453 243 243 GLU H H 8.248 0.01 1 454 243 243 GLU N N 120.293 0.1 1 455 244 244 GLU H H 8.192 0.01 1 456 244 244 GLU N N 120.083 0.1 1 457 245 245 GLU H H 8.188 0.01 1 458 245 245 GLU N N 120.745 0.1 1 459 246 246 VAL H H 8.022 0.01 1 460 246 246 VAL N N 120.125 0.1 1 461 247 247 ASP H H 8.354 0.01 1 462 247 247 ASP N N 122.288 0.1 1 463 248 248 ASP H H 8.286 0.01 1 464 248 248 ASP N N 120.106 0.1 1 465 249 249 GLU H H 8.226 0.01 1 466 249 249 GLU N N 119.910 0.1 1 467 250 250 VAL H H 7.980 0.01 1 468 250 250 VAL N N 119.941 0.1 1 469 251 251 VAL H H 7.954 0.01 1 470 251 251 VAL N N 121.723 0.1 1 471 252 252 ASN H H 8.294 0.01 1 472 252 252 ASN N N 120.807 0.1 1 473 253 253 ASP H H 8.093 0.01 1 474 253 253 ASP N N 119.793 0.1 1 475 254 254 HIS H H 8.513 0.01 1 476 254 254 HIS N N 117.781 0.1 1 477 255 255 HIS H H 8.432 0.01 1 478 255 255 HIS N N 116.756 0.1 1 479 256 256 HIS H H 8.403 0.01 1 480 256 256 HIS N N 118.167 0.1 1 481 257 257 HIS H H 8.648 0.01 1 482 257 257 HIS N N 119.540 0.1 1 483 258 258 HIS H H 8.712 0.01 1 484 258 258 HIS N N 120.306 0.1 1 485 259 259 HIS H H 8.566 0.01 1 486 259 259 HIS N N 120.539 0.1 1 487 260 260 HIS H H 8.383 0.01 1 488 260 260 HIS N N 125.561 0.1 1 stop_ save_