data_25892 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; 1H, 13C and 15N chemical shift assignments for PARP-1 F1F2F3 domains ; _BMRB_accession_number 25892 _BMRB_flat_file_name bmr25892.str _Entry_type original _Submission_date 2015-10-08 _Accession_date 2015-10-14 _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 Neuhaus David . . 2 Eustermann Sebastian . . 3 Yang Ji-Chun . . 4 Wu Wing-Fung . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 332 "13C chemical shifts" 350 "15N chemical shifts" 332 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2016-10-07 update author 'update entry title, etc.' 2016-07-22 update BMRB 'update entry citation' 2015-11-25 original author 'original release' stop_ loop_ _Related_BMRB_accession_number _Relationship 25888 'F1F2-DNA complex' 25889 'F1F2 free' 25890 'DNA free' 25891 'F1F2F3-DNA complex' 25893 'F3 free' 25894 'F1F2F3-WGR-DNA complex' 25895 'WGR free' stop_ _Original_release_date 2015-11-25 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; Structural basis of detection and signaling of DNA single-strand breaks by human PARP 1 ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 26626479 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Eustermann Sebastian . . 2 Wu Wing-Fung . . 3 Langelier Marie-France . . 4 Yang Ji-Chun . . 5 Easton Laura E. . 6 Riccio Amanda . . 7 Pascal John M. . 8 Neuhaus David . . stop_ _Journal_abbreviation 'Mol. Cell' _Journal_volume 60 _Journal_issue 5 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 742 _Page_last 754 _Year 2015 _Details . save_ ################################## # Molecular system description # ################################## save_assembly_f1f2f3_free _Saveframe_category molecular_system _Mol_system_name PARP-1_F1F2F3 _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label PARP-1_1-362 $PARP-1_1-362 ZN1 $entity_ZN ZN2 $entity_ZN ZN3 $entity_ZN 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_PARP-1_1-362 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common PARP-1_1-362 _Molecular_mass 24106.734 _Mol_thiol_state 'free and other bound' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 362 _Mol_residue_sequence ; MAESSDKLYRVEYAKSGRAS CKKCSESIPKDSLRMAIMVQ SPMFDGKVPHWYHFSCFWKV GHSIRHPDVEVDGFSELRWD DQQKVKKTAEAGGVTGKGQD GIGSKAEKTLGDFAAEYAKS NRSTCKGCMEKIEKGQVRLS KKMVDPEKPQLGMIDRWYHP GCFVKNREELGFRPEYSASQ LKGFSLLATEDKEALKKQLP GVKSEGKRKGDEVDGVDEVA KKKSKKEKDKDSKLEKALKA QNDLIWNIKDELKKVCSTND LKELLIFNKQQVPSGESAIL DRVADGMVFGALLPCEECSG QLVFKSDAYYCTGDVTAWTK CMVKTQTPNRKEWVTPKEFR EISYLKKLKVKKQDRIFPPE TS ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 1 MET 2 2 ALA 3 3 GLU 4 4 SER 5 5 SER 6 6 ASP 7 7 LYS 8 8 LEU 9 9 TYR 10 10 ARG 11 11 VAL 12 12 GLU 13 13 TYR 14 14 ALA 15 15 LYS 16 16 SER 17 17 GLY 18 18 ARG 19 19 ALA 20 20 SER 21 21 CYS 22 22 LYS 23 23 LYS 24 24 CYS 25 25 SER 26 26 GLU 27 27 SER 28 28 ILE 29 29 PRO 30 30 LYS 31 31 ASP 32 32 SER 33 33 LEU 34 34 ARG 35 35 MET 36 36 ALA 37 37 ILE 38 38 MET 39 39 VAL 40 40 GLN 41 41 SER 42 42 PRO 43 43 MET 44 44 PHE 45 45 ASP 46 46 GLY 47 47 LYS 48 48 VAL 49 49 PRO 50 50 HIS 51 51 TRP 52 52 TYR 53 53 HIS 54 54 PHE 55 55 SER 56 56 CYS 57 57 PHE 58 58 TRP 59 59 LYS 60 60 VAL 61 61 GLY 62 62 HIS 63 63 SER 64 64 ILE 65 65 ARG 66 66 HIS 67 67 PRO 68 68 ASP 69 69 VAL 70 70 GLU 71 71 VAL 72 72 ASP 73 73 GLY 74 74 PHE 75 75 SER 76 76 GLU 77 77 LEU 78 78 ARG 79 79 TRP 80 80 ASP 81 81 ASP 82 82 GLN 83 83 GLN 84 84 LYS 85 85 VAL 86 86 LYS 87 87 LYS 88 88 THR 89 89 ALA 90 90 GLU 91 91 ALA 92 92 GLY 93 93 GLY 94 94 VAL 95 95 THR 96 96 GLY 97 97 LYS 98 98 GLY 99 99 GLN 100 100 ASP 101 101 GLY 102 102 ILE 103 103 GLY 104 104 SER 105 105 LYS 106 106 ALA 107 107 GLU 108 108 LYS 109 109 THR 110 110 LEU 111 111 GLY 112 112 ASP 113 113 PHE 114 114 ALA 115 115 ALA 116 116 GLU 117 117 TYR 118 118 ALA 119 119 LYS 120 120 SER 121 121 ASN 122 122 ARG 123 123 SER 124 124 THR 125 125 CYS 126 126 LYS 127 127 GLY 128 128 CYS 129 129 MET 130 130 GLU 131 131 LYS 132 132 ILE 133 133 GLU 134 134 LYS 135 135 GLY 136 136 GLN 137 137 VAL 138 138 ARG 139 139 LEU 140 140 SER 141 141 LYS 142 142 LYS 143 143 MET 144 144 VAL 145 145 ASP 146 146 PRO 147 147 GLU 148 148 LYS 149 149 PRO 150 150 GLN 151 151 LEU 152 152 GLY 153 153 MET 154 154 ILE 155 155 ASP 156 156 ARG 157 157 TRP 158 158 TYR 159 159 HIS 160 160 PRO 161 161 GLY 162 162 CYS 163 163 PHE 164 164 VAL 165 165 LYS 166 166 ASN 167 167 ARG 168 168 GLU 169 169 GLU 170 170 LEU 171 171 GLY 172 172 PHE 173 173 ARG 174 174 PRO 175 175 GLU 176 176 TYR 177 177 SER 178 178 ALA 179 179 SER 180 180 GLN 181 181 LEU 182 182 LYS 183 183 GLY 184 184 PHE 185 185 SER 186 186 LEU 187 187 LEU 188 188 ALA 189 189 THR 190 190 GLU 191 191 ASP 192 192 LYS 193 193 GLU 194 194 ALA 195 195 LEU 196 196 LYS 197 197 LYS 198 198 GLN 199 199 LEU 200 200 PRO 201 201 GLY 202 202 VAL 203 203 LYS 204 204 SER 205 205 GLU 206 206 GLY 207 207 LYS 208 208 ARG 209 209 LYS 210 210 GLY 211 211 ASP 212 212 GLU 213 213 VAL 214 214 ASP 215 215 GLY 216 216 VAL 217 217 ASP 218 218 GLU 219 219 VAL 220 220 ALA 221 221 LYS 222 222 LYS 223 223 LYS 224 224 SER 225 225 LYS 226 226 LYS 227 227 GLU 228 228 LYS 229 229 ASP 230 230 LYS 231 231 ASP 232 232 SER 233 233 LYS 234 234 LEU 235 235 GLU 236 236 LYS 237 237 ALA 238 238 LEU 239 239 LYS 240 240 ALA 241 241 GLN 242 242 ASN 243 243 ASP 244 244 LEU 245 245 ILE 246 246 TRP 247 247 ASN 248 248 ILE 249 249 LYS 250 250 ASP 251 251 GLU 252 252 LEU 253 253 LYS 254 254 LYS 255 255 VAL 256 256 CYS 257 257 SER 258 258 THR 259 259 ASN 260 260 ASP 261 261 LEU 262 262 LYS 263 263 GLU 264 264 LEU 265 265 LEU 266 266 ILE 267 267 PHE 268 268 ASN 269 269 LYS 270 270 GLN 271 271 GLN 272 272 VAL 273 273 PRO 274 274 SER 275 275 GLY 276 276 GLU 277 277 SER 278 278 ALA 279 279 ILE 280 280 LEU 281 281 ASP 282 282 ARG 283 283 VAL 284 284 ALA 285 285 ASP 286 286 GLY 287 287 MET 288 288 VAL 289 289 PHE 290 290 GLY 291 291 ALA 292 292 LEU 293 293 LEU 294 294 PRO 295 295 CYS 296 296 GLU 297 297 GLU 298 298 CYS 299 299 SER 300 300 GLY 301 301 GLN 302 302 LEU 303 303 VAL 304 304 PHE 305 305 LYS 306 306 SER 307 307 ASP 308 308 ALA 309 309 TYR 310 310 TYR 311 311 CYS 312 312 THR 313 313 GLY 314 314 ASP 315 315 VAL 316 316 THR 317 317 ALA 318 318 TRP 319 319 THR 320 320 LYS 321 321 CYS 322 322 MET 323 323 VAL 324 324 LYS 325 325 THR 326 326 GLN 327 327 THR 328 328 PRO 329 329 ASN 330 330 ARG 331 331 LYS 332 332 GLU 333 333 TRP 334 334 VAL 335 335 THR 336 336 PRO 337 337 LYS 338 338 GLU 339 339 PHE 340 340 ARG 341 341 GLU 342 342 ILE 343 343 SER 344 344 TYR 345 345 LEU 346 346 LYS 347 347 LYS 348 348 LEU 349 349 LYS 350 350 VAL 351 351 LYS 352 352 LYS 353 353 GLN 354 354 ASP 355 355 ARG 356 356 ILE 357 357 PHE 358 358 PRO 359 359 PRO 360 360 GLU 361 361 THR 362 362 SER stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date . save_ ############# # Ligands # ############# save_ZN _Saveframe_category ligand _Mol_type "non-polymer (NON-POLYMER)" _Name_common 'ZINC ION' _BMRB_code ZN _PDB_code ZN _Molecular_mass 65.409 _Mol_charge 2 _Mol_paramagnetic . _Mol_aromatic no _Details . loop_ _Atom_name _PDB_atom_name _Atom_type _Atom_chirality _Atom_charge _Atom_oxidation_number _Atom_unpaired_electrons ZN ZN ZN . 2 . ? stop_ _Mol_thiol_state . _Sequence_homology_query_date . save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $PARP-1_1-362 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 _Variant _Vector_name $PARP-1_1-362 'recombinant technology' . Escherichia coli BL21 DE3 Pet13 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details ; PARP-1 F1F2F3 free protein. F1F2F3 was sortase ligated (N.B. additional residues LPETGG inserted between residues 214 and 215; this sample was not used for making any assignments of residues in this region, which is in the flexible linker between domains). Labelling for residues 1-214 (and LPET of insertion): uniform [2H,15N,13C] Labelling for residues 215-362 (and GG of insertion): natural abundance ; loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $PARP-1_1-362 0.2 mM '[U-13C; U-15N; U-2H]-1_214, [natural abundance]-215_362' TRIS 50 mM [U-2H] DTT 1 mM [U-2H] ZnSO4 0.1 mM 'natural abundance' H2O 95 % 'natural abundance' D2O 5 % [U-2H] 'sodium chloride' 200 mM 'natural abundance' stop_ save_ save_sample_2 _Saveframe_category sample _Sample_type solution _Details ; PARP-1 F1F2F3 free protein. F1F2F3 was sortase ligated (N.B. additional residues LPETGG inserted between residues 214 and 215; this sample was not used for making any assignments of residues in this region, which is in the flexible linker between domains). Labelling for residues 1-214 (and LPET of insertion): natural abundance Labelling for residues 215-362 (and GG of insertion): uniform [2H,15N,13C] ; loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $PARP-1_1-362 0.2 mM '[natural abundance]-1_214, [U-13C; U-15N; U-2H]-215_362' TRIS 50 mM [U-2H] DTT 1 mM [U-2H] ZnSO4 0.1 mM 'natural abundance' H2O 95 % 'natural abundance' D2O 5 % [U-2H] 'sodium chloride' 200 mM 'natural abundance' stop_ save_ save_sample_3 _Saveframe_category sample _Sample_type solution _Details ; PARP-1 F1F2F3 free protein. Uniformly 15N,13C,2H labelled ; loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $PARP-1_1-362 0.2 mM '[U-13C; U-15N; U-2H]' TRIS 50 mM [U-2H] DTT 1 mM [U-2H] ZnSO4 0.1 mM 'natural abundance' H2O 95 % 'natural abundance' D2O 5 % [U-2H] 'sodium chloride' 200 mM 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_SPARKY _Saveframe_category software _Name SPARKY _Version 3.115 loop_ _Vendor _Address _Electronic_address Goddard . . stop_ loop_ _Task 'chemical shift assignment' stop_ _Details . save_ save_TOPSPIN _Saveframe_category software _Name TOPSPIN _Version 2.1 loop_ _Vendor _Address _Electronic_address 'Bruker Biospin' . . stop_ loop_ _Task processing stop_ _Details . save_ save_Analysis _Saveframe_category software _Name Analysis _Version 2.4.1 loop_ _Vendor _Address _Electronic_address CCPN . . stop_ loop_ _Task 'chemical shift assignment' 'data analysis' stop_ _Details . save_ save_NMRPipe _Saveframe_category software _Name NMRPipe _Version . loop_ _Vendor _Address _Electronic_address 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . stop_ loop_ _Task 'data analysis' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_av800 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model 'Avance I' _Field_strength 800 _Details . save_ save_av700 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model 'Avance II+' _Field_strength 700 _Details . save_ save_dmx600 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model DMX _Field_strength 600 _Details . save_ save_drx500 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model DRX _Field_strength 500 _Details . save_ ############################# # NMR applied experiments # ############################# save_2D_1H-15N_TROSY_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N TROSY' _Sample_label $sample_1 save_ save_3D_TROSY-HNCA_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D TROSY-HNCA' _Sample_label $sample_1 save_ save_2D_1H-15N_TROSY_3 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N TROSY' _Sample_label $sample_2 save_ save_3D_TROSY-HNCA_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D TROSY-HNCA' _Sample_label $sample_2 save_ save_2D_1H-15N_TROSY_5 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N TROSY' _Sample_label $sample_3 save_ save_3D_TROSY-HNCA_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D TROSY-HNCA' _Sample_label $sample_3 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' 0.25 . M pH 7.2 . 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 TSP C 13 'methyl protons' ppm 0.0 external indirect . 'separate tube (no insert) similar to the experimental sample tube' . 0.251449530 TSP H 1 'methyl protons' ppm 0.0 external direct . 'separate tube (no insert) similar to the experimental sample tube' . 1.0 TSP N 15 'methyl protons' ppm 0.0 external indirect . 'separate tube (no insert) similar to the experimental sample tube' . 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_free_F1F2F3 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '2D 1H-15N TROSY' '3D TROSY-HNCA' stop_ loop_ _Sample_label $sample_1 $sample_2 $sample_3 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name PARP-1_1-362 _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 6 6 ASP H H 8.353 0.02 1 2 6 6 ASP CA C 53.883 0.1 1 3 6 6 ASP N N 122.469 0.1 1 4 7 7 LYS H H 8.187 0.02 1 5 7 7 LYS CA C 56.041 0.1 1 6 7 7 LYS N N 120.664 0.1 1 7 8 8 LEU H H 8.900 0.02 1 8 8 8 LEU CA C 55.464 0.1 1 9 8 8 LEU N N 122.901 0.1 1 10 9 9 TYR H H 6.828 0.02 1 11 9 9 TYR CA C 53.856 0.1 1 12 9 9 TYR N N 110.548 0.1 1 13 10 10 ARG H H 8.436 0.02 1 14 10 10 ARG CA C 54.288 0.1 1 15 10 10 ARG N N 120.362 0.1 1 16 11 11 VAL H H 8.878 0.02 1 17 11 11 VAL CA C 58.155 0.1 1 18 11 11 VAL N N 122.266 0.1 1 19 12 12 GLU H H 8.457 0.02 1 20 12 12 GLU CA C 54.340 0.1 1 21 12 12 GLU N N 119.192 0.1 1 22 13 13 TYR H H 7.951 0.02 1 23 13 13 TYR CA C 56.924 0.1 1 24 13 13 TYR N N 119.095 0.1 1 25 14 14 ALA H H 9.373 0.02 1 26 14 14 ALA CA C 53.280 0.1 1 27 14 14 ALA N N 126.675 0.1 1 28 15 15 LYS H H 8.209 0.02 1 29 15 15 LYS CA C 57.677 0.1 1 30 15 15 LYS N N 125.393 0.1 1 31 16 16 SER H H 7.496 0.02 1 32 16 16 SER CA C 55.675 0.1 1 33 16 16 SER N N 109.836 0.1 1 34 17 17 GLY CA C 45.090 0.1 1 35 18 18 ARG H H 7.478 0.02 1 36 18 18 ARG CA C 56.681 0.1 1 37 18 18 ARG N N 115.655 0.1 1 38 19 19 ALA H H 8.462 0.02 1 39 19 19 ALA CA C 51.617 0.1 1 40 19 19 ALA N N 123.480 0.1 1 41 20 20 SER H H 8.271 0.02 1 42 20 20 SER CA C 56.354 0.1 1 43 20 20 SER N N 115.228 0.1 1 44 21 21 CYS H H 8.216 0.02 1 45 21 21 CYS CA C 58.017 0.1 1 46 21 21 CYS N N 125.343 0.1 1 47 22 22 LYS H H 8.496 0.02 1 48 22 22 LYS CA C 56.521 0.1 1 49 22 22 LYS N N 129.183 0.1 1 50 23 23 LYS H H 8.820 0.02 1 51 23 23 LYS CA C 57.434 0.1 1 52 23 23 LYS N N 120.633 0.1 1 53 24 24 CYS H H 8.107 0.02 1 54 24 24 CYS CA C 58.880 0.1 1 55 24 24 CYS N N 116.545 0.1 1 56 25 25 SER H H 8.066 0.02 1 57 25 25 SER CA C 61.005 0.1 1 58 25 25 SER N N 115.491 0.1 1 59 26 26 GLU H H 8.342 0.02 1 60 26 26 GLU CA C 55.142 0.1 1 61 26 26 GLU N N 120.893 0.1 1 62 27 27 SER H H 8.861 0.02 1 63 27 27 SER CA C 59.182 0.1 1 64 27 27 SER N N 116.502 0.1 1 65 28 28 ILE H H 8.351 0.02 1 66 28 28 ILE CA C 58.163 0.1 1 67 28 28 ILE N N 127.129 0.1 1 68 29 29 PRO CA C 62.361 0.1 1 69 30 30 LYS H H 8.672 0.02 1 70 30 30 LYS CA C 58.119 0.1 1 71 30 30 LYS N N 123.924 0.1 1 72 31 31 ASP H H 9.398 0.02 1 73 31 31 ASP CA C 57.416 0.1 1 74 31 31 ASP N N 120.053 0.1 1 75 32 32 SER H H 7.872 0.02 1 76 32 32 SER CA C 58.322 0.1 1 77 32 32 SER N N 115.709 0.1 1 78 33 33 LEU H H 8.842 0.02 1 79 33 33 LEU CA C 55.563 0.1 1 80 33 33 LEU N N 123.145 0.1 1 81 34 34 ARG H H 9.343 0.02 1 82 34 34 ARG CA C 53.472 0.1 1 83 34 34 ARG N N 124.246 0.1 1 84 35 35 MET H H 8.643 0.02 1 85 35 35 MET CA C 53.087 0.1 1 86 35 35 MET N N 119.133 0.1 1 87 36 36 ALA H H 9.383 0.02 1 88 36 36 ALA CA C 49.222 0.1 1 89 36 36 ALA N N 124.078 0.1 1 90 37 37 ILE H H 7.973 0.02 1 91 37 37 ILE CA C 59.600 0.1 1 92 37 37 ILE N N 116.711 0.1 1 93 38 38 MET H H 8.197 0.02 1 94 38 38 MET CA C 52.188 0.1 1 95 38 38 MET N N 124.798 0.1 1 96 39 39 VAL H H 8.691 0.02 1 97 39 39 VAL CA C 60.101 0.1 1 98 39 39 VAL N N 122.770 0.1 1 99 40 40 GLN H H 8.509 0.02 1 100 40 40 GLN CA C 55.509 0.1 1 101 40 40 GLN N N 123.721 0.1 1 102 41 41 SER H H 8.789 0.02 1 103 41 41 SER CA C 54.945 0.1 1 104 41 41 SER N N 121.442 0.1 1 105 42 42 PRO CA C 63.637 0.1 1 106 43 43 MET H H 8.072 0.02 1 107 43 43 MET CA C 55.313 0.1 1 108 43 43 MET N N 114.999 0.1 1 109 44 44 PHE H H 7.561 0.02 1 110 44 44 PHE CA C 56.234 0.1 1 111 44 44 PHE N N 116.406 0.1 1 112 45 45 ASP H H 8.399 0.02 1 113 45 45 ASP CA C 53.695 0.1 1 114 45 45 ASP N N 119.423 0.1 1 115 46 46 GLY H H 7.853 0.02 1 116 46 46 GLY CA C 44.294 0.1 1 117 46 46 GLY N N 109.725 0.1 1 118 47 47 LYS H H 8.293 0.02 1 119 47 47 LYS CA C 55.639 0.1 1 120 47 47 LYS N N 118.491 0.1 1 121 48 48 VAL H H 9.003 0.02 1 122 48 48 VAL N N 118.081 0.1 1 123 49 49 PRO CA C 62.063 0.1 1 124 50 50 HIS H H 8.789 0.02 1 125 50 50 HIS CA C 54.141 0.1 1 126 50 50 HIS N N 124.731 0.1 1 127 51 51 TRP H H 8.135 0.02 1 128 51 51 TRP CA C 57.118 0.1 1 129 51 51 TRP N N 120.722 0.1 1 130 52 52 TYR H H 9.540 0.02 1 131 52 52 TYR CA C 56.230 0.1 1 132 52 52 TYR N N 115.799 0.1 1 133 53 53 HIS H H 8.848 0.02 1 134 53 53 HIS CA C 59.565 0.1 1 135 53 53 HIS N N 118.685 0.1 1 136 54 54 PHE H H 8.570 0.02 1 137 54 54 PHE CA C 63.346 0.1 1 138 54 54 PHE N N 123.071 0.1 1 139 55 55 SER H H 9.222 0.02 1 140 55 55 SER CA C 61.234 0.1 1 141 55 55 SER N N 109.469 0.1 1 142 56 56 CYS H H 7.037 0.02 1 143 56 56 CYS CA C 62.730 0.1 1 144 56 56 CYS N N 119.639 0.1 1 145 57 57 PHE H H 8.069 0.02 1 146 57 57 PHE CA C 60.956 0.1 1 147 57 57 PHE N N 117.851 0.1 1 148 58 58 TRP H H 6.592 0.02 1 149 58 58 TRP CA C 56.705 0.1 1 150 58 58 TRP N N 115.014 0.1 1 151 59 59 LYS H H 7.584 0.02 1 152 59 59 LYS CA C 56.608 0.1 1 153 59 59 LYS N N 117.471 0.1 1 154 60 60 VAL H H 7.100 0.02 1 155 60 60 VAL CA C 62.441 0.1 1 156 60 60 VAL N N 114.601 0.1 1 157 61 61 GLY H H 7.465 0.02 1 158 61 61 GLY CA C 45.269 0.1 1 159 61 61 GLY N N 106.468 0.1 1 160 62 62 HIS H H 7.447 0.02 1 161 62 62 HIS CA C 55.757 0.1 1 162 62 62 HIS N N 119.690 0.1 1 163 63 63 SER H H 8.482 0.02 1 164 63 63 SER CA C 56.828 0.1 1 165 63 63 SER N N 116.721 0.1 1 166 64 64 ILE H H 8.830 0.02 1 167 64 64 ILE CA C 60.324 0.1 1 168 64 64 ILE N N 125.951 0.1 1 169 65 65 ARG H H 8.996 0.02 1 170 65 65 ARG CA C 56.933 0.1 1 171 65 65 ARG N N 126.786 0.1 1 172 66 66 HIS H H 8.790 0.02 1 173 66 66 HIS CA C 51.962 0.1 1 174 66 66 HIS N N 116.202 0.1 1 175 67 67 PRO CA C 65.225 0.1 1 176 68 68 ASP H H 8.542 0.02 1 177 68 68 ASP CA C 55.071 0.1 1 178 68 68 ASP N N 111.015 0.1 1 179 69 69 VAL H H 7.183 0.02 1 180 69 69 VAL CA C 62.308 0.1 1 181 69 69 VAL N N 114.743 0.1 1 182 70 70 GLU H H 7.920 0.02 1 183 70 70 GLU CA C 57.557 0.1 1 184 70 70 GLU N N 115.855 0.1 1 185 71 71 VAL H H 7.876 0.02 1 186 71 71 VAL CA C 60.236 0.1 1 187 71 71 VAL N N 116.834 0.1 1 188 72 72 ASP H H 9.093 0.02 1 189 72 72 ASP CA C 55.695 0.1 1 190 72 72 ASP N N 131.541 0.1 1 191 73 73 GLY H H 8.712 0.02 1 192 73 73 GLY CA C 44.918 0.1 1 193 73 73 GLY N N 113.427 0.1 1 194 74 74 PHE H H 7.673 0.02 1 195 74 74 PHE CA C 62.195 0.1 1 196 74 74 PHE N N 122.650 0.1 1 197 75 75 SER H H 8.721 0.02 1 198 75 75 SER CA C 60.087 0.1 1 199 75 75 SER N N 109.259 0.1 1 200 76 76 GLU H H 7.433 0.02 1 201 76 76 GLU CA C 55.967 0.1 1 202 76 76 GLU N N 118.192 0.1 1 203 77 77 LEU H H 7.101 0.02 1 204 77 77 LEU CA C 53.877 0.1 1 205 77 77 LEU N N 118.567 0.1 1 206 78 78 ARG H H 8.749 0.02 1 207 78 78 ARG CA C 56.951 0.1 1 208 78 78 ARG N N 120.328 0.1 1 209 79 79 TRP H H 9.159 0.02 1 210 79 79 TRP CA C 61.650 0.1 1 211 79 79 TRP N N 124.706 0.1 1 212 80 80 ASP H H 9.034 0.02 1 213 80 80 ASP CA C 56.811 0.1 1 214 80 80 ASP N N 115.327 0.1 1 215 81 81 ASP H H 7.224 0.02 1 216 81 81 ASP CA C 56.582 0.1 1 217 81 81 ASP N N 119.682 0.1 1 218 82 82 GLN H H 8.161 0.02 1 219 82 82 GLN CA C 59.384 0.1 1 220 82 82 GLN N N 121.326 0.1 1 221 83 83 GLN H H 7.661 0.02 1 222 83 83 GLN CA C 57.522 0.1 1 223 83 83 GLN N N 115.082 0.1 1 224 84 84 LYS H H 7.595 0.02 1 225 84 84 LYS CA C 59.323 0.1 1 226 84 84 LYS N N 120.119 0.1 1 227 85 85 VAL H H 8.454 0.02 1 228 85 85 VAL CA C 67.113 0.1 1 229 85 85 VAL N N 121.008 0.1 1 230 86 86 LYS H H 8.276 0.02 1 231 86 86 LYS CA C 60.263 0.1 1 232 86 86 LYS N N 118.249 0.1 1 233 87 87 LYS H H 8.652 0.02 1 234 87 87 LYS CA C 58.418 0.1 1 235 87 87 LYS N N 117.550 0.1 1 236 88 88 THR H H 7.850 0.02 1 237 88 88 THR CA C 65.980 0.1 1 238 88 88 THR N N 116.007 0.1 1 239 89 89 ALA H H 7.844 0.02 1 240 89 89 ALA CA C 54.052 0.1 1 241 89 89 ALA N N 123.136 0.1 1 242 90 90 GLU H H 7.711 0.02 1 243 90 90 GLU CA C 57.680 0.1 1 244 90 90 GLU N N 116.648 0.1 1 245 91 91 ALA H H 7.528 0.02 1 246 91 91 ALA CA C 52.656 0.1 1 247 91 91 ALA N N 121.056 0.1 1 248 92 92 GLY H H 7.951 0.02 1 249 92 92 GLY CA C 45.234 0.1 1 250 92 92 GLY N N 106.551 0.1 1 251 93 93 GLY H H 7.959 0.02 1 252 93 93 GLY CA C 44.663 0.1 1 253 93 93 GLY N N 107.318 0.1 1 254 94 94 VAL H H 7.895 0.02 1 255 94 94 VAL CA C 61.861 0.1 1 256 94 94 VAL N N 118.433 0.1 1 257 95 95 THR H H 8.201 0.02 1 258 95 95 THR CA C 61.624 0.1 1 259 95 95 THR N N 117.064 0.1 1 260 96 96 GLY H H 8.364 0.02 1 261 96 96 GLY CA C 44.918 0.1 1 262 96 96 GLY N N 110.967 0.1 1 263 97 97 LYS H H 8.264 0.02 1 264 97 97 LYS CA C 55.853 0.1 1 265 97 97 LYS N N 120.869 0.1 1 266 98 98 GLY H H 8.514 0.02 1 267 98 98 GLY CA C 45.010 0.1 1 268 98 98 GLY N N 109.994 0.1 1 269 99 99 GLN H H 8.328 0.02 1 270 99 99 GLN CA C 55.488 0.1 1 271 99 99 GLN N N 119.823 0.1 1 272 100 100 ASP H H 8.414 0.02 1 273 100 100 ASP CA C 54.288 0.1 1 274 100 100 ASP N N 120.894 0.1 1 275 101 101 GLY H H 8.321 0.02 1 276 101 101 GLY CA C 45.121 0.1 1 277 101 101 GLY N N 108.864 0.1 1 278 102 102 ILE H H 8.024 0.02 1 279 102 102 ILE CA C 61.167 0.1 1 280 102 102 ILE N N 119.948 0.1 1 281 103 103 GLY H H 8.545 0.02 1 282 103 103 GLY CA C 44.953 0.1 1 283 103 103 GLY N N 112.378 0.1 1 284 105 105 LYS CA C 56.038 0.1 1 285 106 106 ALA H H 8.215 0.02 1 286 106 106 ALA CA C 52.168 0.1 1 287 106 106 ALA N N 124.591 0.1 1 288 107 107 GLU H H 8.303 0.02 1 289 107 107 GLU CA C 55.908 0.1 1 290 107 107 GLU N N 119.923 0.1 1 291 108 108 LYS H H 8.567 0.02 1 292 108 108 LYS CA C 55.924 0.1 1 293 108 108 LYS N N 123.501 0.1 1 294 109 109 THR H H 8.102 0.02 1 295 109 109 THR CA C 62.163 0.1 1 296 109 109 THR N N 116.233 0.1 1 297 110 110 LEU H H 8.908 0.02 1 298 110 110 LEU CA C 54.343 0.1 1 299 110 110 LEU N N 127.012 0.1 1 300 111 111 GLY H H 8.441 0.02 1 301 111 111 GLY CA C 45.743 0.1 1 302 111 111 GLY N N 107.063 0.1 1 303 112 112 ASP H H 8.611 0.02 1 304 112 112 ASP CA C 53.745 0.1 1 305 112 112 ASP N N 116.051 0.1 1 306 113 113 PHE H H 7.363 0.02 1 307 113 113 PHE CA C 56.134 0.1 1 308 113 113 PHE N N 116.188 0.1 1 309 114 114 ALA H H 8.406 0.02 1 310 114 114 ALA CA C 50.566 0.1 1 311 114 114 ALA N N 123.422 0.1 1 312 115 115 ALA H H 8.666 0.02 1 313 115 115 ALA CA C 50.047 0.1 1 314 115 115 ALA N N 118.416 0.1 1 315 116 116 GLU H H 8.665 0.02 1 316 116 116 GLU CA C 54.422 0.1 1 317 116 116 GLU N N 115.026 0.1 1 318 117 117 TYR H H 8.138 0.02 1 319 117 117 TYR CA C 57.706 0.1 1 320 117 117 TYR N N 116.821 0.1 1 321 118 118 ALA H H 9.107 0.02 1 322 118 118 ALA CA C 52.612 0.1 1 323 118 118 ALA N N 125.192 0.1 1 324 119 119 LYS CA C 56.740 0.1 1 325 120 120 SER H H 7.774 0.02 1 326 120 120 SER CA C 56.038 0.1 1 327 120 120 SER N N 113.038 0.1 1 328 121 121 ASN CA C 52.243 0.1 1 329 122 122 ARG H H 7.758 0.02 1 330 122 122 ARG CA C 56.811 0.1 1 331 122 122 ARG N N 115.112 0.1 1 332 123 123 SER H H 9.063 0.02 1 333 123 123 SER CA C 57.706 0.1 1 334 123 123 SER N N 118.896 0.1 1 335 124 124 THR H H 8.207 0.02 1 336 124 124 THR CA C 60.719 0.1 1 337 124 124 THR N N 116.148 0.1 1 338 125 125 CYS H H 8.345 0.02 1 339 125 125 CYS CA C 57.162 0.1 1 340 125 125 CYS N N 125.904 0.1 1 341 126 126 LYS H H 8.679 0.02 1 342 126 126 LYS CA C 55.449 0.1 1 343 126 126 LYS N N 128.995 0.1 1 344 127 127 GLY H H 9.175 0.02 1 345 127 127 GLY CA C 45.559 0.1 1 346 127 127 GLY N N 111.297 0.1 1 347 128 128 CYS H H 8.060 0.02 1 348 128 128 CYS CA C 58.145 0.1 1 349 128 128 CYS N N 119.236 0.1 1 350 129 129 MET H H 8.126 0.02 1 351 129 129 MET CA C 56.705 0.1 1 352 129 129 MET N N 117.245 0.1 1 353 130 130 GLU H H 8.439 0.02 1 354 130 130 GLU CA C 54.571 0.1 1 355 130 130 GLU N N 119.309 0.1 1 356 131 131 LYS H H 8.687 0.02 1 357 131 131 LYS CA C 56.451 0.1 1 358 131 131 LYS N N 119.535 0.1 1 359 132 132 ILE H H 8.114 0.02 1 360 132 132 ILE CA C 60.631 0.1 1 361 132 132 ILE N N 124.502 0.1 1 362 133 133 GLU H H 8.706 0.02 1 363 133 133 GLU CA C 55.757 0.1 1 364 133 133 GLU N N 127.960 0.1 1 365 134 134 LYS H H 8.353 0.02 1 366 134 134 LYS CA C 57.904 0.1 1 367 134 134 LYS N N 122.476 0.1 1 368 135 135 GLY H H 9.028 0.02 1 369 135 135 GLY CA C 44.575 0.1 1 370 135 135 GLY N N 114.500 0.1 1 371 136 136 GLN H H 7.813 0.02 1 372 136 136 GLN CA C 54.141 0.1 1 373 136 136 GLN N N 118.239 0.1 1 374 137 137 VAL H H 8.707 0.02 1 375 137 137 VAL CA C 63.319 0.1 1 376 137 137 VAL N N 121.866 0.1 1 377 138 138 ARG H H 9.132 0.02 1 378 138 138 ARG CA C 53.017 0.1 1 379 138 138 ARG N N 121.249 0.1 1 380 139 139 LEU H H 9.095 0.02 1 381 139 139 LEU CA C 52.401 0.1 1 382 139 139 LEU N N 121.914 0.1 1 383 140 140 SER H H 9.190 0.02 1 384 140 140 SER CA C 54.544 0.1 1 385 140 140 SER N N 115.431 0.1 1 386 141 141 LYS H H 7.908 0.02 1 387 141 141 LYS CA C 54.667 0.1 1 388 141 141 LYS N N 118.731 0.1 1 389 142 142 LYS H H 8.188 0.02 1 390 142 142 LYS CA C 54.685 0.1 1 391 142 142 LYS N N 127.041 0.1 1 392 143 143 MET H H 8.832 0.02 1 393 143 143 MET CA C 54.685 0.1 1 394 143 143 MET N N 120.534 0.1 1 395 144 144 VAL H H 8.412 0.02 1 396 144 144 VAL CA C 61.624 0.1 1 397 144 144 VAL N N 122.130 0.1 1 398 145 145 ASP H H 9.418 0.02 1 399 145 145 ASP CA C 50.662 0.1 1 400 145 145 ASP N N 129.502 0.1 1 401 146 146 PRO CA C 63.697 0.1 1 402 147 147 GLU H H 8.388 0.02 1 403 147 147 GLU CA C 56.722 0.1 1 404 147 147 GLU N N 115.682 0.1 1 405 148 148 LYS H H 7.807 0.02 1 406 148 148 LYS CA C 53.245 0.1 1 407 148 148 LYS N N 118.256 0.1 1 408 149 149 PRO CA C 64.645 0.1 1 409 150 150 GLN H H 9.268 0.02 1 410 150 150 GLN CA C 57.082 0.1 1 411 150 150 GLN N N 119.015 0.1 1 412 151 151 LEU H H 7.622 0.02 1 413 151 151 LEU CA C 54.992 0.1 1 414 151 151 LEU N N 119.010 0.1 1 415 152 152 GLY H H 7.712 0.02 1 416 152 152 GLY CA C 44.397 0.1 1 417 152 152 GLY N N 105.311 0.1 1 418 153 153 MET H H 8.327 0.02 1 419 153 153 MET CA C 55.472 0.1 1 420 153 153 MET N N 119.339 0.1 1 421 154 154 ILE H H 8.602 0.02 1 422 154 154 ILE CA C 59.029 0.1 1 423 154 154 ILE N N 122.600 0.1 1 424 155 155 ASP H H 8.010 0.02 1 425 155 155 ASP CA C 55.080 0.1 1 426 155 155 ASP N N 120.143 0.1 1 427 156 156 ARG H H 8.087 0.02 1 428 156 156 ARG CA C 54.553 0.1 1 429 156 156 ARG N N 123.976 0.1 1 430 157 157 TRP H H 8.011 0.02 1 431 157 157 TRP CA C 56.529 0.1 1 432 157 157 TRP N N 122.044 0.1 1 433 158 158 TYR H H 9.839 0.02 1 434 158 158 TYR CA C 56.486 0.1 1 435 158 158 TYR N N 115.438 0.1 1 436 159 159 HIS H H 9.404 0.02 1 437 159 159 HIS CA C 57.285 0.1 1 438 159 159 HIS N N 120.323 0.1 1 439 160 160 PRO CA C 66.542 0.1 1 440 161 161 GLY H H 9.277 0.02 1 441 161 161 GLY CA C 46.526 0.1 1 442 161 161 GLY N N 102.681 0.1 1 443 162 162 CYS H H 7.192 0.02 1 444 162 162 CYS CA C 62.019 0.1 1 445 162 162 CYS N N 122.270 0.1 1 446 163 163 PHE H H 8.671 0.02 1 447 163 163 PHE CA C 60.728 0.1 1 448 163 163 PHE N N 124.139 0.1 1 449 164 164 VAL H H 8.237 0.02 1 450 164 164 VAL CA C 66.604 0.1 1 451 164 164 VAL N N 115.950 0.1 1 452 165 165 LYS H H 7.536 0.02 1 453 165 165 LYS CA C 58.734 0.1 1 454 165 165 LYS N N 118.531 0.1 1 455 166 166 ASN H H 7.203 0.02 1 456 166 166 ASN CA C 52.524 0.1 1 457 166 166 ASN N N 115.667 0.1 1 458 167 167 ARG H H 7.146 0.02 1 459 167 167 ARG CA C 60.517 0.1 1 460 167 167 ARG N N 119.312 0.1 1 461 168 168 GLU H H 8.452 0.02 1 462 168 168 GLU CA C 59.147 0.1 1 463 168 168 GLU N N 118.523 0.1 1 464 169 169 GLU H H 8.446 0.02 1 465 169 169 GLU CA C 58.910 0.1 1 466 169 169 GLU N N 123.137 0.1 1 467 170 170 LEU H H 7.817 0.02 1 468 170 170 LEU CA C 54.904 0.1 1 469 170 170 LEU N N 116.011 0.1 1 470 171 171 GLY H H 7.798 0.02 1 471 171 171 GLY CA C 45.278 0.1 1 472 171 171 GLY N N 106.954 0.1 1 473 172 172 PHE H H 8.152 0.02 1 474 172 172 PHE CA C 57.733 0.1 1 475 172 172 PHE N N 123.724 0.1 1 476 173 173 ARG H H 5.989 0.02 1 477 173 173 ARG CA C 55.230 0.1 1 478 173 173 ARG N N 126.764 0.1 1 479 174 174 PRO CA C 64.926 0.1 1 480 175 175 GLU H H 9.000 0.02 1 481 175 175 GLU CA C 56.933 0.1 1 482 175 175 GLU N N 112.634 0.1 1 483 176 176 TYR H H 7.551 0.02 1 484 176 176 TYR CA C 52.937 0.1 1 485 176 176 TYR N N 122.477 0.1 1 486 177 177 SER H H 8.131 0.02 1 487 177 177 SER CA C 55.352 0.1 1 488 177 177 SER N N 112.082 0.1 1 489 178 178 ALA H H 8.470 0.02 1 490 178 178 ALA CA C 53.991 0.1 1 491 178 178 ALA N N 122.022 0.1 1 492 179 179 SER H H 7.501 0.02 1 493 179 179 SER CA C 58.822 0.1 1 494 179 179 SER N N 106.487 0.1 1 495 180 180 GLN H H 7.638 0.02 1 496 180 180 GLN CA C 56.020 0.1 1 497 180 180 GLN N N 118.402 0.1 1 498 181 181 LEU H H 7.701 0.02 1 499 181 181 LEU CA C 55.124 0.1 1 500 181 181 LEU N N 119.579 0.1 1 501 182 182 LYS H H 9.084 0.02 1 502 182 182 LYS CA C 58.567 0.1 1 503 182 182 LYS N N 128.266 0.1 1 504 183 183 GLY H H 8.977 0.02 1 505 183 183 GLY CA C 44.831 0.1 1 506 183 183 GLY N N 114.218 0.1 1 507 184 184 PHE H H 8.208 0.02 1 508 184 184 PHE CA C 61.624 0.1 1 509 184 184 PHE N N 123.069 0.1 1 510 185 185 SER H H 8.535 0.02 1 511 185 185 SER CA C 60.543 0.1 1 512 185 185 SER N N 107.795 0.1 1 513 186 186 LEU H H 7.393 0.02 1 514 186 186 LEU CA C 54.597 0.1 1 515 186 186 LEU N N 119.771 0.1 1 516 187 187 LEU H H 7.284 0.02 1 517 187 187 LEU CA C 54.132 0.1 1 518 187 187 LEU N N 119.160 0.1 1 519 188 188 ALA H H 8.851 0.02 1 520 188 188 ALA CA C 51.716 0.1 1 521 188 188 ALA N N 122.303 0.1 1 522 189 189 THR H H 8.900 0.02 1 523 189 189 THR CA C 67.113 0.1 1 524 189 189 THR N N 118.999 0.1 1 525 190 190 GLU H H 9.653 0.02 1 526 190 190 GLU CA C 59.595 0.1 1 527 190 190 GLU N N 118.400 0.1 1 528 191 191 ASP H H 7.123 0.02 1 529 191 191 ASP CA C 56.995 0.1 1 530 191 191 ASP N N 118.544 0.1 1 531 192 192 LYS H H 8.255 0.02 1 532 192 192 LYS CA C 60.157 0.1 1 533 192 192 LYS N N 120.868 0.1 1 534 193 193 GLU H H 8.281 0.02 1 535 193 193 GLU CA C 58.523 0.1 1 536 193 193 GLU N N 115.853 0.1 1 537 194 194 ALA H H 7.625 0.02 1 538 194 194 ALA CA C 54.790 0.1 1 539 194 194 ALA N N 121.209 0.1 1 540 195 195 LEU H H 8.153 0.02 1 541 195 195 LEU CA C 57.328 0.1 1 542 195 195 LEU N N 118.254 0.1 1 543 196 196 LYS H H 8.455 0.02 1 544 196 196 LYS CA C 59.445 0.1 1 545 196 196 LYS N N 118.862 0.1 1 546 197 197 LYS H H 7.353 0.02 1 547 197 197 LYS CA C 58.128 0.1 1 548 197 197 LYS N N 115.473 0.1 1 549 198 198 GLN H H 7.362 0.02 1 550 198 198 GLN CA C 57.320 0.1 1 551 198 198 GLN N N 115.853 0.1 1 552 199 199 LEU H H 8.075 0.02 1 553 199 199 LEU CA C 51.382 0.1 1 554 199 199 LEU N N 118.025 0.1 1 555 200 200 PRO CA C 63.486 0.1 1 556 201 201 GLY H H 8.421 0.02 1 557 201 201 GLY CA C 44.277 0.1 1 558 201 201 GLY N N 108.575 0.1 1 559 202 202 VAL H H 8.088 0.02 1 560 202 202 VAL CA C 61.334 0.1 1 561 202 202 VAL N N 120.220 0.1 1 562 203 203 LYS H H 8.398 0.02 1 563 203 203 LYS CA C 55.642 0.1 1 564 203 203 LYS N N 125.060 0.1 1 565 204 204 SER H H 8.403 0.02 1 566 204 204 SER N N 117.805 0.1 1 567 205 205 GLU H H 8.556 0.02 1 568 205 205 GLU CA C 56.336 0.1 1 569 205 205 GLU N N 123.084 0.1 1 570 206 206 GLY H H 8.411 0.02 1 571 206 206 GLY CA C 44.883 0.1 1 572 206 206 GLY N N 109.644 0.1 1 573 207 207 LYS H H 8.159 0.02 1 574 207 207 LYS CA C 55.862 0.1 1 575 207 207 LYS N N 120.949 0.1 1 576 208 208 ARG H H 8.437 0.02 1 577 208 208 ARG CA C 55.651 0.1 1 578 208 208 ARG N N 122.800 0.1 1 579 209 209 LYS CA C 56.389 0.1 1 580 210 210 GLY H H 8.564 0.02 1 581 210 210 GLY CA C 44.953 0.1 1 582 210 210 GLY N N 110.364 0.1 1 583 211 211 ASP H H 8.232 0.02 1 584 211 211 ASP CA C 54.055 0.1 1 585 211 211 ASP N N 120.179 0.1 1 586 212 212 GLU H H 8.427 0.02 1 587 212 212 GLU CA C 56.426 0.1 1 588 212 212 GLU N N 120.539 0.1 1 589 213 213 VAL H H 8.059 0.02 1 590 213 213 VAL CA C 61.633 0.1 1 591 213 213 VAL N N 119.809 0.1 1 592 214 214 ASP H H 8.348 0.02 1 593 214 214 ASP CA C 53.816 0.1 1 594 214 214 ASP N N 123.578 0.1 1 595 215 215 GLY H H 8.384 0.02 1 596 215 215 GLY CA C 44.840 0.1 1 597 215 215 GLY N N 108.956 0.1 1 598 216 216 VAL H H 8.072 0.02 1 599 216 216 VAL CA C 62.180 0.1 1 600 216 216 VAL N N 118.786 0.1 1 601 217 217 ASP H H 8.405 0.02 1 602 217 217 ASP CA C 54.157 0.1 1 603 217 217 ASP N N 122.912 0.1 1 604 218 218 GLU H H 8.280 0.02 1 605 218 218 GLU CA C 56.981 0.1 1 606 218 218 GLU N N 121.301 0.1 1 607 219 219 VAL H H 8.061 0.02 1 608 219 219 VAL CA C 63.303 0.1 1 609 219 219 VAL N N 120.407 0.1 1 610 220 220 ALA H H 8.169 0.02 1 611 220 220 ALA CA C 52.805 0.1 1 612 220 220 ALA N N 125.057 0.1 1 613 221 221 LYS H H 8.049 0.02 1 614 221 221 LYS CA C 56.546 0.1 1 615 221 221 LYS N N 119.331 0.1 1 616 222 222 LYS H H 8.227 0.02 1 617 222 222 LYS CA C 56.335 0.1 1 618 222 222 LYS N N 121.909 0.1 1 619 226 226 LYS H H 8.282 0.02 1 620 226 226 LYS CA C 56.458 0.1 1 621 226 226 LYS N N 121.745 0.1 1 622 227 227 GLU H H 8.357 0.02 1 623 227 227 GLU CA C 56.599 0.1 1 624 227 227 GLU N N 121.601 0.1 1 625 228 228 LYS H H 8.329 0.02 1 626 228 228 LYS CA C 56.784 0.1 1 627 228 228 LYS N N 121.864 0.1 1 628 229 229 ASP H H 8.424 0.02 1 629 229 229 ASP CA C 54.557 0.1 1 630 229 229 ASP N N 121.101 0.1 1 631 230 230 LYS H H 8.183 0.02 1 632 230 230 LYS CA C 56.819 0.1 1 633 230 230 LYS N N 121.306 0.1 1 634 231 231 ASP H H 8.399 0.02 1 635 231 231 ASP CA C 54.632 0.1 1 636 231 231 ASP N N 121.062 0.1 1 637 232 232 SER H H 8.425 0.02 1 638 232 232 SER CA C 59.339 0.1 1 639 232 232 SER N N 117.529 0.1 1 640 233 233 LYS H H 8.369 0.02 1 641 233 233 LYS CA C 59.067 0.1 1 642 233 233 LYS N N 122.574 0.1 1 643 234 234 LEU H H 8.128 0.02 1 644 234 234 LEU CA C 57.354 0.1 1 645 234 234 LEU N N 121.825 0.1 1 646 235 235 GLU H H 8.175 0.02 1 647 235 235 GLU CA C 59.422 0.1 1 648 235 235 GLU N N 118.995 0.1 1 649 236 236 LYS H H 8.105 0.02 1 650 236 236 LYS CA C 59.162 0.1 1 651 236 236 LYS N N 119.063 0.1 1 652 237 237 ALA H H 8.059 0.02 1 653 237 237 ALA CA C 54.517 0.1 1 654 237 237 ALA N N 123.673 0.1 1 655 238 238 LEU H H 8.713 0.02 1 656 238 238 LEU CA C 57.631 0.1 1 657 238 238 LEU N N 121.876 0.1 1 658 239 239 LYS H H 7.950 0.02 1 659 239 239 LYS CA C 59.181 0.1 1 660 239 239 LYS N N 120.124 0.1 1 661 240 240 ALA H H 7.966 0.02 1 662 240 240 ALA CA C 54.575 0.1 1 663 240 240 ALA N N 119.909 0.1 1 664 241 241 GLN H H 8.044 0.02 1 665 241 241 GLN CA C 59.055 0.1 1 666 241 241 GLN N N 119.854 0.1 1 667 242 242 ASN H H 8.585 0.02 1 668 242 242 ASN CA C 55.761 0.1 1 669 242 242 ASN N N 118.645 0.1 1 670 243 243 ASP H H 8.756 0.02 1 671 243 243 ASP CA C 57.042 0.1 1 672 243 243 ASP N N 121.772 0.1 1 673 244 244 LEU H H 7.846 0.02 1 674 244 244 LEU CA C 58.140 0.1 1 675 244 244 LEU N N 122.671 0.1 1 676 245 245 ILE H H 8.076 0.02 1 677 245 245 ILE CA C 64.524 0.1 1 678 245 245 ILE N N 118.331 0.1 1 679 246 246 TRP H H 8.410 0.02 1 680 246 246 TRP CA C 61.584 0.1 1 681 246 246 TRP N N 119.321 0.1 1 682 247 247 ASN H H 8.438 0.02 1 683 247 247 ASN CA C 56.415 0.1 1 684 247 247 ASN N N 117.920 0.1 1 685 248 248 ILE H H 8.397 0.02 1 686 248 248 ILE CA C 64.344 0.1 1 687 248 248 ILE N N 120.684 0.1 1 688 249 249 LYS H H 8.230 0.02 1 689 249 249 LYS CA C 60.858 0.1 1 690 249 249 LYS N N 118.763 0.1 1 691 250 250 ASP H H 7.960 0.02 1 692 250 250 ASP CA C 57.130 0.1 1 693 250 250 ASP N N 117.636 0.1 1 694 251 251 GLU H H 7.860 0.02 1 695 251 251 GLU CA C 58.812 0.1 1 696 251 251 GLU N N 118.069 0.1 1 697 252 252 LEU H H 8.786 0.02 1 698 252 252 LEU CA C 57.767 0.1 1 699 252 252 LEU N N 118.968 0.1 1 700 253 253 LYS H H 7.812 0.02 1 701 253 253 LYS CA C 57.863 0.1 1 702 253 253 LYS N N 115.119 0.1 1 703 254 254 LYS H H 7.393 0.02 1 704 254 254 LYS CA C 58.141 0.1 1 705 254 254 LYS N N 116.105 0.1 1 706 255 255 VAL H H 7.597 0.02 1 707 255 255 VAL CA C 61.846 0.1 1 708 255 255 VAL N N 110.027 0.1 1 709 256 256 CYS H H 8.278 0.02 1 710 256 256 CYS CA C 58.223 0.1 1 711 256 256 CYS N N 118.797 0.1 1 712 257 257 SER H H 9.326 0.02 1 713 257 257 SER CA C 56.309 0.1 1 714 257 257 SER N N 118.962 0.1 1 715 258 258 THR H H 8.974 0.02 1 716 258 258 THR CA C 66.918 0.1 1 717 258 258 THR N N 117.564 0.1 1 718 259 259 ASN H H 8.446 0.02 1 719 259 259 ASN CA C 56.588 0.1 1 720 259 259 ASN N N 118.931 0.1 1 721 260 260 ASP H H 7.982 0.02 1 722 260 260 ASP CA C 57.284 0.1 1 723 260 260 ASP N N 120.868 0.1 1 724 261 261 LEU H H 7.787 0.02 1 725 261 261 LEU CA C 57.605 0.1 1 726 261 261 LEU N N 117.486 0.1 1 727 262 262 LYS H H 8.236 0.02 1 728 262 262 LYS CA C 60.568 0.1 1 729 262 262 LYS N N 117.776 0.1 1 730 263 263 GLU H H 8.065 0.02 1 731 263 263 GLU CA C 59.067 0.1 1 732 263 263 GLU N N 116.910 0.1 1 733 264 264 LEU H H 8.056 0.02 1 734 264 264 LEU CA C 57.947 0.1 1 735 264 264 LEU N N 119.929 0.1 1 736 265 265 LEU H H 7.848 0.02 1 737 265 265 LEU CA C 58.495 0.1 1 738 265 265 LEU N N 119.722 0.1 1 739 266 266 ILE H H 8.502 0.02 1 740 266 266 ILE CA C 64.889 0.1 1 741 266 266 ILE N N 121.295 0.1 1 742 267 267 PHE H H 8.868 0.02 1 743 267 267 PHE CA C 60.985 0.1 1 744 267 267 PHE N N 123.138 0.1 1 745 268 268 ASN H H 7.121 0.02 1 746 268 268 ASN CA C 53.722 0.1 1 747 268 268 ASN N N 113.077 0.1 1 748 269 269 LYS H H 8.334 0.02 1 749 269 269 LYS CA C 56.599 0.1 1 750 269 269 LYS N N 118.087 0.1 1 751 270 270 GLN H H 8.362 0.02 1 752 270 270 GLN CA C 51.804 0.1 1 753 270 270 GLN N N 116.325 0.1 1 754 271 271 GLN H H 8.195 0.02 1 755 271 271 GLN CA C 55.523 0.1 1 756 271 271 GLN N N 120.569 0.1 1 757 272 272 VAL H H 8.601 0.02 1 758 272 272 VAL CA C 59.312 0.1 1 759 272 272 VAL N N 123.790 0.1 1 760 273 273 PRO CA C 61.692 0.1 1 761 274 274 SER H H 8.256 0.02 1 762 274 274 SER CA C 58.870 0.1 1 763 274 274 SER N N 111.215 0.1 1 764 275 275 GLY H H 8.220 0.02 1 765 275 275 GLY CA C 44.550 0.1 1 766 275 275 GLY N N 111.638 0.1 1 767 276 276 GLU H H 8.815 0.02 1 768 276 276 GLU CA C 60.103 0.1 1 769 276 276 GLU N N 124.284 0.1 1 770 277 277 SER CA C 61.192 0.1 1 771 278 278 ALA H H 7.607 0.02 1 772 278 278 ALA CA C 54.290 0.1 1 773 278 278 ALA N N 124.467 0.1 1 774 279 279 ILE H H 7.990 0.02 1 775 279 279 ILE CA C 66.197 0.1 1 776 279 279 ILE N N 118.980 0.1 1 777 280 280 LEU H H 7.825 0.02 1 778 280 280 LEU CA C 58.171 0.1 1 779 280 280 LEU N N 118.459 0.1 1 780 281 281 ASP H H 8.115 0.02 1 781 281 281 ASP CA C 57.727 0.1 1 782 281 281 ASP N N 117.478 0.1 1 783 282 282 ARG H H 8.273 0.02 1 784 282 282 ARG CA C 58.711 0.1 1 785 282 282 ARG N N 117.953 0.1 1 786 283 283 VAL H H 8.470 0.02 1 787 283 283 VAL CA C 66.322 0.1 1 788 283 283 VAL N N 121.611 0.1 1 789 284 284 ALA H H 8.205 0.02 1 790 284 284 ALA CA C 55.514 0.1 1 791 284 284 ALA N N 120.584 0.1 1 792 285 285 ASP H H 7.570 0.02 1 793 285 285 ASP CA C 56.867 0.1 1 794 285 285 ASP N N 113.875 0.1 1 795 286 286 GLY H H 7.531 0.02 1 796 286 286 GLY CA C 45.806 0.1 1 797 286 286 GLY N N 105.346 0.1 1 798 287 287 MET H H 7.725 0.02 1 799 287 287 MET CA C 58.285 0.1 1 800 287 287 MET N N 117.644 0.1 1 801 288 288 VAL H H 7.344 0.02 1 802 288 288 VAL CA C 64.792 0.1 1 803 288 288 VAL N N 115.297 0.1 1 804 289 289 PHE H H 7.846 0.02 1 805 289 289 PHE CA C 57.982 0.1 1 806 289 289 PHE N N 114.331 0.1 1 807 290 290 GLY H H 7.924 0.02 1 808 290 290 GLY CA C 43.852 0.1 1 809 290 290 GLY N N 108.543 0.1 1 810 291 291 ALA H H 8.404 0.02 1 811 291 291 ALA CA C 51.167 0.1 1 812 291 291 ALA N N 124.358 0.1 1 813 292 292 LEU H H 8.415 0.02 1 814 292 292 LEU CA C 56.081 0.1 1 815 292 292 LEU N N 125.316 0.1 1 816 293 293 LEU H H 7.736 0.02 1 817 293 293 LEU CA C 52.805 0.1 1 818 293 293 LEU N N 122.990 0.1 1 819 294 294 PRO CA C 62.342 0.1 1 820 295 295 CYS H H 9.034 0.02 1 821 295 295 CYS CA C 60.006 0.1 1 822 295 295 CYS N N 124.973 0.1 1 823 296 296 GLU H H 8.880 0.02 1 824 296 296 GLU CA C 58.316 0.1 1 825 296 296 GLU N N 129.116 0.1 1 826 297 297 GLU H H 9.557 0.02 1 827 297 297 GLU CA C 57.662 0.1 1 828 297 297 GLU N N 120.843 0.1 1 829 298 298 CYS H H 8.514 0.02 1 830 298 298 CYS CA C 58.549 0.1 1 831 298 298 CYS N N 119.133 0.1 1 832 299 299 SER H H 7.967 0.02 1 833 299 299 SER CA C 61.099 0.1 1 834 299 299 SER N N 117.147 0.1 1 835 300 300 GLY H H 10.009 0.02 1 836 300 300 GLY CA C 43.017 0.1 1 837 300 300 GLY N N 116.698 0.1 1 838 301 301 GLN H H 8.192 0.02 1 839 301 301 GLN CA C 53.341 0.1 1 840 301 301 GLN N N 117.037 0.1 1 841 302 302 LEU H H 10.005 0.02 1 842 302 302 LEU CA C 55.725 0.1 1 843 302 302 LEU N N 133.365 0.1 1 844 303 303 VAL H H 9.240 0.02 1 845 303 303 VAL CA C 60.520 0.1 1 846 303 303 VAL N N 118.119 0.1 1 847 304 304 PHE H H 9.111 0.02 1 848 304 304 PHE CA C 59.036 0.1 1 849 304 304 PHE N N 127.732 0.1 1 850 305 305 LYS H H 8.018 0.02 1 851 305 305 LYS CA C 54.755 0.1 1 852 305 305 LYS N N 129.403 0.1 1 853 306 306 SER H H 6.540 0.02 1 854 306 306 SER CA C 63.453 0.1 1 855 306 306 SER N N 111.349 0.1 1 856 307 307 ASP H H 9.344 0.02 1 857 307 307 ASP CA C 53.112 0.1 1 858 307 307 ASP N N 119.685 0.1 1 859 308 308 ALA H H 7.510 0.02 1 860 308 308 ALA CA C 51.330 0.1 1 861 308 308 ALA N N 117.722 0.1 1 862 309 309 TYR H H 8.461 0.02 1 863 309 309 TYR CA C 58.044 0.1 1 864 309 309 TYR N N 116.211 0.1 1 865 310 310 TYR H H 9.221 0.02 1 866 310 310 TYR CA C 56.020 0.1 1 867 310 310 TYR N N 121.612 0.1 1 868 311 311 CYS H H 8.539 0.02 1 869 311 311 CYS CA C 61.666 0.1 1 870 311 311 CYS N N 124.365 0.1 1 871 312 312 THR H H 7.829 0.02 1 872 312 312 THR CA C 61.574 0.1 1 873 312 312 THR N N 118.142 0.1 1 874 313 313 GLY H H 10.482 0.02 1 875 313 313 GLY CA C 44.902 0.1 1 876 313 313 GLY N N 120.196 0.1 1 877 314 314 ASP H H 8.201 0.02 1 878 314 314 ASP CA C 53.622 0.1 1 879 314 314 ASP N N 119.150 0.1 1 880 315 315 VAL H H 8.333 0.02 1 881 315 315 VAL CA C 64.651 0.1 1 882 315 315 VAL N N 123.132 0.1 1 883 316 316 THR H H 7.985 0.02 1 884 316 316 THR CA C 59.553 0.1 1 885 316 316 THR N N 109.469 0.1 1 886 317 317 ALA H H 8.319 0.02 1 887 317 317 ALA CA C 53.364 0.1 1 888 317 317 ALA N N 120.280 0.1 1 889 318 318 TRP H H 7.766 0.02 1 890 318 318 TRP CA C 57.075 0.1 1 891 318 318 TRP N N 114.294 0.1 1 892 319 319 THR H H 7.384 0.02 1 893 319 319 THR CA C 60.907 0.1 1 894 319 319 THR N N 115.895 0.1 1 895 320 320 LYS H H 8.567 0.02 1 896 320 320 LYS CA C 54.650 0.1 1 897 320 320 LYS N N 126.398 0.1 1 898 321 321 CYS H H 8.313 0.02 1 899 321 321 CYS CA C 60.836 0.1 1 900 321 321 CYS N N 124.581 0.1 1 901 322 322 MET H H 8.450 0.02 1 902 322 322 MET CA C 54.074 0.1 1 903 322 322 MET N N 125.077 0.1 1 904 323 323 VAL H H 8.707 0.02 1 905 323 323 VAL CA C 65.793 0.1 1 906 323 323 VAL N N 125.531 0.1 1 907 324 324 LYS H H 7.832 0.02 1 908 324 324 LYS CA C 54.258 0.1 1 909 324 324 LYS N N 127.382 0.1 1 910 325 325 THR H H 9.201 0.02 1 911 325 325 THR CA C 59.269 0.1 1 912 325 325 THR N N 117.422 0.1 1 913 326 326 GLN H H 9.029 0.02 1 914 326 326 GLN CA C 56.243 0.1 1 915 326 326 GLN N N 126.016 0.1 1 916 327 327 THR H H 8.857 0.02 1 917 327 327 THR CA C 57.156 0.1 1 918 327 327 THR N N 111.495 0.1 1 919 328 328 PRO CA C 61.828 0.1 1 920 329 329 ASN H H 8.390 0.02 1 921 329 329 ASN CA C 53.433 0.1 1 922 329 329 ASN N N 118.342 0.1 1 923 330 330 ARG H H 8.614 0.02 1 924 330 330 ARG CA C 54.469 0.1 1 925 330 330 ARG N N 122.250 0.1 1 926 331 331 LYS H H 9.167 0.02 1 927 331 331 LYS CA C 53.732 0.1 1 928 331 331 LYS N N 119.036 0.1 1 929 332 332 GLU H H 8.556 0.02 1 930 332 332 GLU CA C 57.350 0.1 1 931 332 332 GLU N N 119.907 0.1 1 932 333 333 TRP H H 9.114 0.02 1 933 333 333 TRP HE1 H 9.521 0.02 1 934 333 333 TRP CA C 57.464 0.1 1 935 333 333 TRP N N 126.050 0.1 1 936 333 333 TRP NE1 N 127.892 0.1 1 937 334 334 VAL H H 8.614 0.02 1 938 334 334 VAL CA C 60.234 0.1 1 939 334 334 VAL N N 128.180 0.1 1 940 335 335 THR H H 8.417 0.02 1 941 335 335 THR CA C 58.637 0.1 1 942 335 335 THR N N 119.450 0.1 1 943 336 336 PRO CA C 62.074 0.1 1 944 337 337 LYS H H 8.519 0.02 1 945 337 337 LYS CA C 58.533 0.1 1 946 337 337 LYS N N 122.400 0.1 1 947 338 338 GLU H H 8.866 0.02 1 948 338 338 GLU CA C 57.490 0.1 1 949 338 338 GLU N N 116.625 0.1 1 950 339 339 PHE H H 7.693 0.02 1 951 339 339 PHE CA C 57.578 0.1 1 952 339 339 PHE N N 120.199 0.1 1 953 340 340 ARG H H 7.588 0.02 1 954 340 340 ARG CA C 56.919 0.1 1 955 340 340 ARG N N 122.560 0.1 1 956 341 341 GLU H H 8.094 0.02 1 957 341 341 GLU CA C 56.406 0.1 1 958 341 341 GLU N N 118.400 0.1 1 959 342 342 ILE H H 7.873 0.02 1 960 342 342 ILE CA C 60.441 0.1 1 961 342 342 ILE N N 121.758 0.1 1 962 343 343 SER CA C 61.543 0.1 1 963 344 344 TYR H H 8.328 0.02 1 964 344 344 TYR CA C 60.621 0.1 1 965 344 344 TYR N N 120.302 0.1 1 966 345 345 LEU H H 7.279 0.02 1 967 345 345 LEU CA C 56.199 0.1 1 968 345 345 LEU N N 115.465 0.1 1 969 346 346 LYS H H 7.850 0.02 1 970 346 346 LYS CA C 58.140 0.1 1 971 346 346 LYS N N 118.962 0.1 1 972 347 347 LYS H H 7.598 0.02 1 973 347 347 LYS CA C 56.691 0.1 1 974 347 347 LYS N N 116.450 0.1 1 975 348 348 LEU H H 7.361 0.02 1 976 348 348 LEU CA C 55.014 0.1 1 977 348 348 LEU N N 119.833 0.1 1 978 349 349 LYS H H 7.998 0.02 1 979 349 349 LYS CA C 55.980 0.1 1 980 349 349 LYS N N 121.257 0.1 1 981 350 350 VAL H H 7.872 0.02 1 982 350 350 VAL CA C 61.495 0.1 1 983 350 350 VAL N N 119.480 0.1 1 984 351 351 LYS H H 8.234 0.02 1 985 351 351 LYS CA C 55.435 0.1 1 986 351 351 LYS N N 124.503 0.1 1 987 352 352 LYS H H 8.236 0.02 1 988 352 352 LYS CA C 56.340 0.1 1 989 352 352 LYS N N 122.926 0.1 1 990 353 353 GLN H H 8.595 0.02 1 991 353 353 GLN CA C 54.338 0.1 1 992 353 353 GLN N N 122.316 0.1 1 993 354 354 ASP H H 8.267 0.02 1 994 354 354 ASP CA C 53.055 0.1 1 995 354 354 ASP N N 119.052 0.1 1 996 355 355 ARG H H 8.306 0.02 1 997 355 355 ARG CA C 56.331 0.1 1 998 355 355 ARG N N 124.077 0.1 1 999 356 356 ILE H H 8.819 0.02 1 1000 356 356 ILE CA C 60.256 0.1 1 1001 356 356 ILE N N 127.336 0.1 1 1002 357 357 PHE H H 8.672 0.02 1 1003 357 357 PHE CA C 55.506 0.1 1 1004 357 357 PHE N N 125.007 0.1 1 1005 359 359 PRO CA C 62.566 0.1 1 1006 360 360 GLU H H 8.605 0.02 1 1007 360 360 GLU CA C 56.375 0.1 1 1008 360 360 GLU N N 120.684 0.1 1 1009 361 361 THR H H 8.249 0.02 1 1010 361 361 THR CA C 61.196 0.1 1 1011 361 361 THR N N 114.777 0.1 1 1012 362 362 SER H H 8.014 0.02 1 1013 362 362 SER CA C 59.721 0.1 1 1014 362 362 SER N N 123.381 0.1 1 stop_ save_