data_26871 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Backbone 1H, 13C, and 15N chemical shift assignment for Dpo4 binary complex with DNA ; _BMRB_accession_number 26871 _BMRB_flat_file_name bmr26871.str _Entry_type original _Submission_date 2016-08-08 _Accession_date 2016-08-08 _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 Lee Eunjeong . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 348 "13C chemical shifts" 927 "15N chemical shifts" 294 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2017-03-14 update BMRB 'update entry citation' 2017-02-16 original author 'original release' stop_ _Original_release_date 2016-08-09 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; Backbone assignment of the binary complex of the full length Sulfolobus solfataricus DNA polymerase IV and DNA ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 27738883 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Lee Eunjeong . . 2 Fowler Jason D. . 3 Suo Zucai . . 4 Wu Zhengrong . . stop_ _Journal_abbreviation 'Biomol. NMR Assign.' _Journal_volume 11 _Journal_issue 1 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 39 _Page_last 43 _Year 2017 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'Dpo4 Binary' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'Dpo4 Binary core and little finger domain' $Y-family_DNA_polymerase_IV_Dpo4 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_Y-family_DNA_polymerase_IV_Dpo4 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common Y-family_DNA_polymerase_IV_Dpo4 _Molecular_mass . _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 360 _Mol_residue_sequence ; MIVLFVDFDYFYAQVEEVLN PSLKGKPVVVCVFSGRFEDS GAVATANYEARKFGVKAGIP IVEAKKILPNAVYLPMRKEV YQQVSSRIMNLLREYSEKIE IASIDEAYLDISDKVRDYRE AYNLGLEIKNKILEKEKITV TVGISKNKVFAKIAADMAKP NGIKVIDDEEVKRLIRELDI ADVPGIGNITAEKLKKLGIN KLVDTLSIEFDKLKGMIGEA KAKYLISLARDEYNEPIRTR VRKSIGRIVTMKRNSRNLEE IKPYLFRAIEESYYKLDKRI PKAIHVVAVTEDLDIVSRGR TFPHGISKETAYSESVKLLQ KILEEDERKIRRIGVRFSKF IEAIGLDKFFDTLEHHHHHH ; loop_ _Residue_seq_code _Residue_label 1 MET 2 ILE 3 VAL 4 LEU 5 PHE 6 VAL 7 ASP 8 PHE 9 ASP 10 TYR 11 PHE 12 TYR 13 ALA 14 GLN 15 VAL 16 GLU 17 GLU 18 VAL 19 LEU 20 ASN 21 PRO 22 SER 23 LEU 24 LYS 25 GLY 26 LYS 27 PRO 28 VAL 29 VAL 30 VAL 31 CYS 32 VAL 33 PHE 34 SER 35 GLY 36 ARG 37 PHE 38 GLU 39 ASP 40 SER 41 GLY 42 ALA 43 VAL 44 ALA 45 THR 46 ALA 47 ASN 48 TYR 49 GLU 50 ALA 51 ARG 52 LYS 53 PHE 54 GLY 55 VAL 56 LYS 57 ALA 58 GLY 59 ILE 60 PRO 61 ILE 62 VAL 63 GLU 64 ALA 65 LYS 66 LYS 67 ILE 68 LEU 69 PRO 70 ASN 71 ALA 72 VAL 73 TYR 74 LEU 75 PRO 76 MET 77 ARG 78 LYS 79 GLU 80 VAL 81 TYR 82 GLN 83 GLN 84 VAL 85 SER 86 SER 87 ARG 88 ILE 89 MET 90 ASN 91 LEU 92 LEU 93 ARG 94 GLU 95 TYR 96 SER 97 GLU 98 LYS 99 ILE 100 GLU 101 ILE 102 ALA 103 SER 104 ILE 105 ASP 106 GLU 107 ALA 108 TYR 109 LEU 110 ASP 111 ILE 112 SER 113 ASP 114 LYS 115 VAL 116 ARG 117 ASP 118 TYR 119 ARG 120 GLU 121 ALA 122 TYR 123 ASN 124 LEU 125 GLY 126 LEU 127 GLU 128 ILE 129 LYS 130 ASN 131 LYS 132 ILE 133 LEU 134 GLU 135 LYS 136 GLU 137 LYS 138 ILE 139 THR 140 VAL 141 THR 142 VAL 143 GLY 144 ILE 145 SER 146 LYS 147 ASN 148 LYS 149 VAL 150 PHE 151 ALA 152 LYS 153 ILE 154 ALA 155 ALA 156 ASP 157 MET 158 ALA 159 LYS 160 PRO 161 ASN 162 GLY 163 ILE 164 LYS 165 VAL 166 ILE 167 ASP 168 ASP 169 GLU 170 GLU 171 VAL 172 LYS 173 ARG 174 LEU 175 ILE 176 ARG 177 GLU 178 LEU 179 ASP 180 ILE 181 ALA 182 ASP 183 VAL 184 PRO 185 GLY 186 ILE 187 GLY 188 ASN 189 ILE 190 THR 191 ALA 192 GLU 193 LYS 194 LEU 195 LYS 196 LYS 197 LEU 198 GLY 199 ILE 200 ASN 201 LYS 202 LEU 203 VAL 204 ASP 205 THR 206 LEU 207 SER 208 ILE 209 GLU 210 PHE 211 ASP 212 LYS 213 LEU 214 LYS 215 GLY 216 MET 217 ILE 218 GLY 219 GLU 220 ALA 221 LYS 222 ALA 223 LYS 224 TYR 225 LEU 226 ILE 227 SER 228 LEU 229 ALA 230 ARG 231 ASP 232 GLU 233 TYR 234 ASN 235 GLU 236 PRO 237 ILE 238 ARG 239 THR 240 ARG 241 VAL 242 ARG 243 LYS 244 SER 245 ILE 246 GLY 247 ARG 248 ILE 249 VAL 250 THR 251 MET 252 LYS 253 ARG 254 ASN 255 SER 256 ARG 257 ASN 258 LEU 259 GLU 260 GLU 261 ILE 262 LYS 263 PRO 264 TYR 265 LEU 266 PHE 267 ARG 268 ALA 269 ILE 270 GLU 271 GLU 272 SER 273 TYR 274 TYR 275 LYS 276 LEU 277 ASP 278 LYS 279 ARG 280 ILE 281 PRO 282 LYS 283 ALA 284 ILE 285 HIS 286 VAL 287 VAL 288 ALA 289 VAL 290 THR 291 GLU 292 ASP 293 LEU 294 ASP 295 ILE 296 VAL 297 SER 298 ARG 299 GLY 300 ARG 301 THR 302 PHE 303 PRO 304 HIS 305 GLY 306 ILE 307 SER 308 LYS 309 GLU 310 THR 311 ALA 312 TYR 313 SER 314 GLU 315 SER 316 VAL 317 LYS 318 LEU 319 LEU 320 GLN 321 LYS 322 ILE 323 LEU 324 GLU 325 GLU 326 ASP 327 GLU 328 ARG 329 LYS 330 ILE 331 ARG 332 ARG 333 ILE 334 GLY 335 VAL 336 ARG 337 PHE 338 SER 339 LYS 340 PHE 341 ILE 342 GLU 343 ALA 344 ILE 345 GLY 346 LEU 347 ASP 348 LYS 349 PHE 350 PHE 351 ASP 352 THR 353 LEU 354 GLU 355 HIS 356 HIS 357 HIS 358 HIS 359 HIS 360 HIS stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date . save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $Y-family_DNA_polymerase_IV_Dpo4 'Sulfolobus solfataricus' 2287 Archaea . Sulfolobus solfataricus 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 $Y-family_DNA_polymerase_IV_Dpo4 'recombinant technology' . Sulfolobus solfataricus . pET22b 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 $Y-family_DNA_polymerase_IV_Dpo4 0.6 mM '[U-13C; U-15N; U-2H]' TRIS 50 mM [U-2H] glycerol 1 mM [U-2H] D2O 8 % [U-2H] stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Saveframe_category software _Name NMRPipe _Version . loop_ _Vendor _Address _Electronic_address 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . stop_ loop_ _Task processing stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _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_HNCO_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $sample_1 save_ save_3D_HNCA_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $sample_1 save_ save_3D_HNCACB_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_1 save_ save_3D_HN(CO)CA_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CO)CA' _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' 0.075 . M pH 7.5 . pH pressure 1 . atm temperature 323 . 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 C 13 protons ppm 56.497 na indirect . . . 0.251449530 water H 1 protons ppm 4.53 internal direct . . . 1 water N 15 protons ppm 119.14 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_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . 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 $chemical_shift_reference_1 _Mol_system_component_name 'Dpo4 Binary core and little finger domain' _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 1 1 MET C C 173.3047 . 1 2 1 1 MET CA C 55.0653 . 1 3 1 1 MET CB C 34.4404 . 1 4 2 2 ILE H H 8.2898 . 1 5 2 2 ILE C C 173.3938 . 1 6 2 2 ILE CA C 62.1528 . 1 7 2 2 ILE CB C 40.0472 . 1 8 2 2 ILE N N 122.6127 . 1 9 3 3 VAL H H 8.6733 . 1 10 3 3 VAL C C 172.6516 . 1 11 3 3 VAL CA C 60.2816 . 1 12 3 3 VAL CB C 33.6056 . 1 13 3 3 VAL N N 125.9469 . 1 14 4 4 LEU H H 8.9432 . 1 15 4 4 LEU C C 173.4153 . 1 16 4 4 LEU CA C 53.7726 . 1 17 4 4 LEU CB C 44.8955 . 1 18 4 4 LEU N N 128.9920 . 1 19 5 5 PHE H H 10.0645 . 1 20 5 5 PHE C C 172.5983 . 1 21 5 5 PHE CA C 55.0654 . 1 22 5 5 PHE N N 129.8365 . 1 23 6 6 VAL H H 8.0725 . 1 24 6 6 VAL C C 170.9702 . 1 25 6 6 VAL CA C 59.5936 . 1 26 6 6 VAL CB C 32.8936 . 1 27 6 6 VAL N N 126.6700 . 1 28 7 7 ASP H H 8.1498 . 1 29 7 7 ASP C C 176.3722 . 1 30 7 7 ASP CA C 50.9071 . 1 31 7 7 ASP CB C 44.1744 . 1 32 7 7 ASP N N 124.7386 . 1 33 8 8 PHE H H 8.8415 . 1 34 8 8 PHE C C 175.4881 . 1 35 8 8 PHE CA C 53.3187 . 1 36 8 8 PHE CB C 35.8284 . 1 37 8 8 PHE N N 126.2991 . 1 38 9 9 ASP H H 7.4073 . 1 39 9 9 ASP CA C 55.8885 . 1 40 9 9 ASP CB C 40.3580 . 1 41 9 9 ASP N N 124.6113 . 1 42 10 10 TYR C C 178.7541 . 1 43 10 10 TYR CA C 56.0593 . 1 44 10 10 TYR CB C 37.2564 . 1 45 11 11 PHE H H 7.6683 . 1 46 11 11 PHE C C 176.4853 . 1 47 11 11 PHE CA C 62.0882 . 1 48 11 11 PHE CB C 39.4660 . 1 49 11 11 PHE N N 118.1300 . 1 50 12 12 TYR H H 8.9042 . 1 51 12 12 TYR C C 177.3693 . 1 52 12 12 TYR CA C 56.9706 . 1 53 12 12 TYR CB C 36.4648 . 1 54 12 12 TYR N N 114.9069 . 1 55 13 13 ALA H H 6.5935 . 1 56 13 13 ALA HB H 1.3123 . 1 57 13 13 ALA C C 178.0573 . 1 58 13 13 ALA CA C 53.5276 . 1 59 13 13 ALA CB C 17.9815 . 1 60 13 13 ALA N N 113.0422 . 1 61 14 14 GLN H H 8.4400 . 1 62 14 14 GLN C C 178.5677 . 1 63 14 14 GLN CA C 59.2349 . 1 64 14 14 GLN CB C 27.0176 . 1 65 14 14 GLN N N 121.0920 . 1 66 15 15 VAL H H 8.1454 . 1 67 15 15 VAL C C 177.8292 . 1 68 15 15 VAL CA C 66.7546 . 1 69 15 15 VAL CB C 29.9442 . 1 70 15 15 VAL N N 117.6135 . 1 71 16 16 GLU H H 6.9029 . 1 72 16 16 GLU C C 179.4969 . 1 73 16 16 GLU CA C 58.3260 . 1 74 16 16 GLU CB C 26.4688 . 1 75 16 16 GLU N N 115.6024 . 1 76 17 17 GLU H H 7.7233 . 1 77 17 17 GLU C C 177.9070 . 1 78 17 17 GLU CA C 58.3079 . 1 79 17 17 GLU CB C 29.5558 . 1 80 17 17 GLU N N 119.9232 . 1 81 18 18 VAL H H 7.9240 . 1 82 18 18 VAL C C 178.8133 . 1 83 18 18 VAL CA C 65.4434 . 1 84 18 18 VAL CB C 31.1042 . 1 85 18 18 VAL N N 119.9515 . 1 86 19 19 LEU H H 7.8156 . 1 87 19 19 LEU C C 177.7329 . 1 88 19 19 LEU CA C 56.0244 . 1 89 19 19 LEU CB C 40.9684 . 1 90 19 19 LEU N N 118.2473 . 1 91 20 20 ASN H H 7.5166 . 1 92 20 20 ASN CA C 49.8066 . 1 93 20 20 ASN CB C 37.7135 . 1 94 20 20 ASN N N 114.8317 . 1 95 22 22 SER C C 175.1701 . 1 96 22 22 SER CA C 60.7847 . 1 97 22 22 SER CB C 62.6078 . 1 98 23 23 LEU H H 8.2775 . 1 99 23 23 LEU C C 176.7223 . 1 100 23 23 LEU CA C 55.0830 . 1 101 23 23 LEU CB C 41.3684 . 1 102 23 23 LEU N N 120.0501 . 1 103 24 24 LYS H H 7.0691 . 1 104 24 24 LYS C C 176.7223 . 1 105 24 24 LYS CA C 58.1042 . 1 106 24 24 LYS CB C 31.3137 . 1 107 24 24 LYS N N 117.1317 . 1 108 25 25 GLY H H 7.9356 . 1 109 25 25 GLY C C 173.9206 . 1 110 25 25 GLY CA C 44.6814 . 1 111 25 25 GLY N N 114.3050 . 1 112 26 26 LYS H H 7.9797 . 1 113 26 26 LYS CA C 53.2197 . 1 114 26 26 LYS CB C 30.9224 . 1 115 26 26 LYS N N 120.8905 . 1 116 27 27 PRO C C 174.8328 . 1 117 27 27 PRO CA C 62.1447 . 1 118 27 27 PRO CB C 29.8931 . 1 119 28 28 VAL H H 7.6745 . 1 120 28 28 VAL C C 173.5016 . 1 121 28 28 VAL CA C 61.2162 . 1 122 28 28 VAL CB C 33.9606 . 1 123 28 28 VAL N N 125.3957 . 1 124 29 29 VAL H H 8.6287 . 1 125 29 29 VAL C C 174.2670 . 1 126 29 29 VAL CA C 60.4603 . 1 127 29 29 VAL CB C 32.8109 . 1 128 29 29 VAL N N 127.1878 . 1 129 30 30 VAL H H 8.8716 . 1 130 30 30 VAL C C 176.4075 . 1 131 30 30 VAL CA C 61.8330 . 1 132 30 30 VAL CB C 31.3499 . 1 133 30 30 VAL N N 128.0400 . 1 134 31 31 CYS H H 9.3143 . 1 135 31 31 CYS C C 172.1578 . 1 136 31 31 CYS CA C 58.0485 . 1 137 31 31 CYS CB C 31.6157 . 1 138 31 31 CYS N N 126.4189 . 1 139 32 32 VAL H H 8.8294 . 1 140 32 32 VAL C C 175.1006 . 1 141 32 32 VAL CA C 61.2758 . 1 142 32 32 VAL CB C 30.8759 . 1 143 32 32 VAL N N 123.4163 . 1 144 33 33 PHE H H 8.4651 . 1 145 33 33 PHE C C 177.6018 . 1 146 33 33 PHE CA C 57.1922 . 1 147 33 33 PHE CB C 38.2133 . 1 148 33 33 PHE N N 125.3573 . 1 149 34 34 SER H H 8.3561 . 1 150 34 34 SER C C 177.6018 . 1 151 34 34 SER CA C 58.2012 . 1 152 34 34 SER CB C 65.3262 . 1 153 34 34 SER N N 118.6445 . 1 154 35 35 GLY C C 174.5703 . 1 155 35 35 GLY CA C 45.3209 . 1 156 36 36 ARG H H 7.4672 . 1 157 36 36 ARG C C 176.0094 . 1 158 36 36 ARG CA C 59.5854 . 1 159 36 36 ARG CB C 30.0088 . 1 160 36 36 ARG N N 120.7238 . 1 161 37 37 PHE H H 7.4836 . 1 162 37 37 PHE CA C 55.9294 . 1 163 37 37 PHE CB C 38.4236 . 1 164 37 37 PHE N N 111.4882 . 1 165 38 38 GLU CA C 59.8101 . 1 166 38 38 GLU CB C 28.1088 . 1 167 39 39 ASP H H 8.0426 . 1 168 39 39 ASP C C 174.4546 . 1 169 39 39 ASP CA C 53.8418 . 1 170 39 39 ASP CB C 39.1551 . 1 171 39 39 ASP N N 115.6695 . 1 172 40 40 SER H H 7.3360 . 1 173 40 40 SER CA C 58.0843 . 1 174 40 40 SER CB C 62.5939 . 1 175 40 40 SER N N 113.9882 . 1 176 41 41 GLY C C 171.8076 . 1 177 41 41 GLY CA C 44.2184 . 1 178 42 42 ALA H H 7.8313 . 1 179 42 42 ALA HB H 0.2820 . 1 180 42 42 ALA C C 175.6276 . 1 181 42 42 ALA CA C 49.5717 . 1 182 42 42 ALA CB C 21.0644 . 1 183 42 42 ALA N N 120.9500 . 1 184 43 43 VAL H H 8.1305 . 1 185 43 43 VAL C C 174.6435 . 1 186 43 43 VAL CA C 63.2387 . 1 187 43 43 VAL CB C 31.7225 . 1 188 43 43 VAL N N 120.5754 . 1 189 44 44 ALA H H 9.1231 . 1 190 44 44 ALA HB H 1.3445 . 1 191 44 44 ALA C C 178.1428 . 1 192 44 44 ALA CA C 52.5027 . 1 193 44 44 ALA CB C 20.1788 . 1 194 44 44 ALA N N 130.2276 . 1 195 45 45 THR H H 7.5830 . 1 196 45 45 THR CA C 62.5177 . 1 197 45 45 THR N N 110.8595 . 1 198 46 46 ALA HB H 1.1479 . 1 199 46 46 ALA C C 175.7277 . 1 200 46 46 ALA CA C 49.1749 . 1 201 46 46 ALA CB C 21.8795 . 1 202 47 47 ASN H H 8.1400 . 1 203 47 47 ASN CA C 50.3816 . 1 204 47 47 ASN CB C 37.1955 . 1 205 47 47 ASN N N 118.3700 . 1 206 48 48 TYR C C 177.9036 . 1 207 48 48 TYR CA C 57.3114 . 1 208 48 48 TYR CB C 40.3940 . 1 209 49 49 GLU H H 8.3840 . 1 210 49 49 GLU C C 177.5614 . 1 211 49 49 GLU CA C 59.3435 . 1 212 49 49 GLU CB C 27.5562 . 1 213 49 49 GLU N N 118.0856 . 1 214 50 50 ALA H H 7.3570 . 1 215 50 50 ALA HB H 1.1335 . 1 216 50 50 ALA C C 179.7899 . 1 217 50 50 ALA CA C 53.7376 . 1 218 50 50 ALA CB C 18.5032 . 1 219 50 50 ALA N N 117.6999 . 1 220 51 51 ARG H H 8.3476 . 1 221 51 51 ARG C C 180.5811 . 1 222 51 51 ARG CA C 58.0280 . 1 223 51 51 ARG CB C 29.0268 . 1 224 51 51 ARG N N 119.6854 . 1 225 52 52 LYS H H 7.5179 . 1 226 52 52 LYS HB2 H 1.5805 . 2 227 52 52 LYS HB3 H 1.4013 . 2 228 52 52 LYS HG2 H 0.9961 . 2 229 52 52 LYS C C 177.1992 . 1 230 52 52 LYS CA C 58.3420 . 1 231 52 52 LYS CB C 30.8195 . 1 232 52 52 LYS N N 120.2551 . 1 233 53 53 PHE H H 7.0808 . 1 234 53 53 PHE C C 175.3958 . 1 235 53 53 PHE CA C 58.2931 . 1 236 53 53 PHE CB C 39.5118 . 1 237 53 53 PHE N N 115.4741 . 1 238 54 54 GLY H H 7.6971 . 1 239 54 54 GLY C C 174.1552 . 1 240 54 54 GLY CA C 44.4008 . 1 241 54 54 GLY N N 104.6869 . 1 242 55 55 VAL H H 6.8586 . 1 243 55 55 VAL C C 172.7326 . 1 244 55 55 VAL CA C 63.8188 . 1 245 55 55 VAL CB C 30.2280 . 1 246 55 55 VAL N N 119.7825 . 1 247 56 56 LYS H H 6.2465 . 1 248 56 56 LYS C C 172.7326 . 1 249 56 56 LYS CA C 53.3603 . 1 250 56 56 LYS CB C 34.7391 . 1 251 56 56 LYS N N 121.6384 . 1 252 57 57 ALA HB H 0.9379 . 1 253 57 57 ALA C C 178.2883 . 1 254 57 57 ALA CA C 52.4844 . 1 255 57 57 ALA CB C 18.4292 . 1 256 58 58 GLY H H 9.0154 . 1 257 58 58 GLY C C 174.3413 . 1 258 58 58 GLY CA C 44.6515 . 1 259 58 58 GLY N N 109.1828 . 1 260 59 59 ILE H H 6.8347 . 1 261 59 59 ILE CA C 59.1702 . 1 262 59 59 ILE CB C 36.0636 . 1 263 59 59 ILE N N 114.2370 . 1 264 60 60 PRO C C 178.0375 . 1 265 60 60 PRO CA C 62.0233 . 1 266 60 60 PRO CB C 31.8576 . 1 267 61 61 ILE H H 7.8963 . 1 268 61 61 ILE C C 178.1415 . 1 269 61 61 ILE CA C 65.5989 . 1 270 61 61 ILE CB C 36.4700 . 1 271 61 61 ILE N N 127.8684 . 1 272 62 62 VAL H H 8.4555 . 1 273 62 62 VAL C C 177.9523 . 1 274 62 62 VAL CA C 65.3700 . 1 275 62 62 VAL CB C 30.9667 . 1 276 62 62 VAL N N 113.5249 . 1 277 63 63 GLU H H 6.6536 . 1 278 63 63 GLU C C 178.6164 . 1 279 63 63 GLU CA C 57.9760 . 1 280 63 63 GLU CB C 28.5585 . 1 281 63 63 GLU N N 118.7210 . 1 282 64 64 ALA H H 7.6057 . 1 283 64 64 ALA HB H 1.5237 . 1 284 64 64 ALA C C 178.0760 . 1 285 64 64 ALA CA C 55.0732 . 1 286 64 64 ALA CB C 21.1230 . 1 287 64 64 ALA N N 123.0056 . 1 288 65 65 LYS H H 8.1301 . 1 289 65 65 LYS C C 177.9314 . 1 290 65 65 LYS CA C 58.9848 . 1 291 65 65 LYS CB C 31.8856 . 1 292 65 65 LYS N N 115.1117 . 1 293 66 66 LYS H H 6.9769 . 1 294 66 66 LYS C C 178.1711 . 1 295 66 66 LYS CA C 58.3585 . 1 296 66 66 LYS CB C 31.8312 . 1 297 66 66 LYS N N 117.4205 . 1 298 67 67 ILE H H 7.0997 . 1 299 67 67 ILE HG12 H 1.6432 . 2 300 67 67 ILE C C 175.9714 . 1 301 67 67 ILE CA C 62.8474 . 1 302 67 67 ILE CB C 38.3117 . 1 303 67 67 ILE N N 117.3060 . 1 304 68 68 LEU H H 8.4236 . 1 305 68 68 LEU CA C 51.0765 . 1 306 68 68 LEU CB C 42.5636 . 1 307 68 68 LEU N N 119.5088 . 1 308 70 70 ASN HB2 H 2.7243 . 2 309 70 70 ASN HB3 H 2.8277 . 2 310 70 70 ASN C C 174.9811 . 1 311 70 70 ASN CA C 52.3326 . 1 312 70 70 ASN CB C 37.3316 . 1 313 71 71 ALA H H 6.7348 . 1 314 71 71 ALA HB H 0.8806 . 1 315 71 71 ALA C C 173.8102 . 1 316 71 71 ALA CA C 51.0134 . 1 317 71 71 ALA CB C 18.5921 . 1 318 71 71 ALA N N 120.1553 . 1 319 72 72 VAL H H 7.8149 . 1 320 72 72 VAL C C 174.2756 . 1 321 72 72 VAL CA C 62.2831 . 1 322 72 72 VAL CB C 30.9771 . 1 323 72 72 VAL N N 119.7011 . 1 324 73 73 TYR H H 8.2948 . 1 325 73 73 TYR C C 175.8257 . 1 326 73 73 TYR CA C 57.3259 . 1 327 73 73 TYR CB C 38.0521 . 1 328 73 73 TYR N N 127.5469 . 1 329 74 74 LEU H H 8.7854 . 1 330 74 74 LEU C C 175.8257 . 1 331 74 74 LEU CA C 51.0660 . 1 332 74 74 LEU CB C 43.3412 . 1 333 74 74 LEU N N 124.9655 . 1 334 75 75 PRO C C 176.3261 . 1 335 75 75 PRO CA C 61.3869 . 1 336 75 75 PRO CB C 31.6131 . 1 337 76 76 MET H H 8.1956 . 1 338 76 76 MET C C 176.0778 . 1 339 76 76 MET CA C 56.6013 . 1 340 76 76 MET CB C 32.9933 . 1 341 76 76 MET N N 120.3197 . 1 342 77 77 ARG H H 7.2477 . 1 343 77 77 ARG CA C 53.6341 . 1 344 77 77 ARG CB C 28.7661 . 1 345 77 77 ARG N N 128.3385 . 1 346 79 79 GLU C C 179.3279 . 1 347 79 79 GLU CA C 59.5288 . 1 348 79 79 GLU CB C 27.7103 . 1 349 80 80 VAL H H 6.7993 . 1 350 80 80 VAL C C 178.1801 . 1 351 80 80 VAL CA C 65.0606 . 1 352 80 80 VAL CB C 30.4534 . 1 353 80 80 VAL N N 120.1778 . 1 354 81 81 TYR H H 6.7993 . 1 355 81 81 TYR C C 179.0226 . 1 356 81 81 TYR CA C 57.3242 . 1 357 81 81 TYR CB C 35.2127 . 1 358 81 81 TYR N N 120.1778 . 1 359 82 82 GLN H H 8.7635 . 1 360 82 82 GLN C C 178.2502 . 1 361 82 82 GLN CA C 58.5011 . 1 362 82 82 GLN CB C 27.9350 . 1 363 82 82 GLN N N 118.0341 . 1 364 83 83 GLN H H 7.6200 . 1 365 83 83 GLN C C 178.8271 . 1 366 83 83 GLN CA C 58.9208 . 1 367 83 83 GLN CB C 27.5985 . 1 368 83 83 GLN N N 120.4238 . 1 369 84 84 VAL H H 7.6993 . 1 370 84 84 VAL HG1 H 1.1100 . 1 371 84 84 VAL C C 177.6774 . 1 372 84 84 VAL CA C 66.5137 . 1 373 84 84 VAL CB C 31.3019 . 1 374 84 84 VAL N N 119.1448 . 1 375 85 85 SER H H 8.5282 . 1 376 85 85 SER C C 176.9780 . 1 377 85 85 SER CA C 61.2401 . 1 378 85 85 SER CB C 62.5208 . 1 379 85 85 SER N N 112.0605 . 1 380 86 86 SER H H 8.5808 . 1 381 86 86 SER C C 176.8764 . 1 382 86 86 SER CA C 61.8657 . 1 383 86 86 SER CB C 62.9023 . 1 384 86 86 SER N N 113.1547 . 1 385 87 87 ARG H H 7.4796 . 1 386 87 87 ARG C C 180.2776 . 1 387 87 87 ARG CA C 60.5175 . 1 388 87 87 ARG CB C 29.9253 . 1 389 87 87 ARG N N 119.8888 . 1 390 88 88 ILE H H 8.0491 . 1 391 88 88 ILE C C 178.1064 . 1 392 88 88 ILE CA C 65.9570 . 1 393 88 88 ILE CB C 36.0773 . 1 394 88 88 ILE N N 121.7639 . 1 395 89 89 MET H H 9.2066 . 1 396 89 89 MET C C 179.1275 . 1 397 89 89 MET CA C 57.7761 . 1 398 89 89 MET CB C 29.7199 . 1 399 89 89 MET N N 118.4797 . 1 400 90 90 ASN H H 7.7046 . 1 401 90 90 ASN C C 177.8451 . 1 402 90 90 ASN CA C 55.7987 . 1 403 90 90 ASN CB C 37.6683 . 1 404 90 90 ASN N N 116.0615 . 1 405 91 91 LEU H H 7.4827 . 1 406 91 91 LEU HB2 H 2.3037 . 2 407 91 91 LEU HB3 H 1.8811 . 2 408 91 91 LEU C C 179.8274 . 1 409 91 91 LEU CA C 57.8775 . 1 410 91 91 LEU CB C 40.9370 . 1 411 91 91 LEU N N 123.1171 . 1 412 92 92 LEU H H 8.1513 . 1 413 92 92 LEU HB2 H 1.8870 . 2 414 92 92 LEU C C 178.7969 . 1 415 92 92 LEU CA C 57.7237 . 1 416 92 92 LEU CB C 40.4606 . 1 417 92 92 LEU N N 118.5395 . 1 418 93 93 ARG H H 7.6070 . 1 419 93 93 ARG C C 177.2248 . 1 420 93 93 ARG CA C 57.2586 . 1 421 93 93 ARG CB C 29.3570 . 1 422 93 93 ARG N N 117.6828 . 1 423 94 94 GLU H H 7.3422 . 1 424 94 94 GLU C C 178.0394 . 1 425 94 94 GLU CA C 57.8580 . 1 426 94 94 GLU CB C 28.3808 . 1 427 94 94 GLU N N 116.5835 . 1 428 95 95 TYR H H 7.7382 . 1 429 95 95 TYR C C 176.5107 . 1 430 95 95 TYR CA C 60.5904 . 1 431 95 95 TYR CB C 38.6159 . 1 432 95 95 TYR N N 116.8700 . 1 433 96 96 SER H H 7.1168 . 1 434 96 96 SER CA C 57.7843 . 1 435 96 96 SER CB C 64.7060 . 1 436 96 96 SER N N 109.3896 . 1 437 97 97 GLU C C 177.2307 . 1 438 97 97 GLU CA C 56.8520 . 1 439 97 97 GLU CB C 28.7187 . 1 440 98 98 LYS H H 8.1598 . 1 441 98 98 LYS C C 172.6170 . 1 442 98 98 LYS CA C 55.0724 . 1 443 98 98 LYS CB C 31.4477 . 1 444 98 98 LYS N N 123.3458 . 1 445 99 99 ILE H H 7.3760 . 1 446 99 99 ILE C C 173.2337 . 1 447 99 99 ILE CA C 57.7005 . 1 448 99 99 ILE CB C 40.4637 . 1 449 99 99 ILE N N 121.2908 . 1 450 100 100 GLU H H 9.3602 . 1 451 100 100 GLU C C 175.2123 . 1 452 100 100 GLU CA C 54.0939 . 1 453 100 100 GLU CB C 32.5605 . 1 454 100 100 GLU N N 130.9807 . 1 455 101 101 ILE H H 8.7056 . 1 456 101 101 ILE C C 175.1597 . 1 457 101 101 ILE CA C 62.0094 . 1 458 101 101 ILE CB C 44.7565 . 1 459 101 101 ILE N N 130.0419 . 1 460 102 102 ALA H H 7.9086 . 1 461 102 102 ALA HB H 1.6901 . 1 462 102 102 ALA C C 176.8047 . 1 463 102 102 ALA CA C 53.0948 . 1 464 102 102 ALA CB C 20.5490 . 1 465 102 102 ALA N N 132.3210 . 1 466 103 103 SER H H 8.2768 . 1 467 103 103 SER CA C 56.3458 . 1 468 103 103 SER CB C 64.5473 . 1 469 103 103 SER N N 112.6990 . 1 470 104 104 ILE HD1 H 1.2719 . 1 471 104 104 ILE C C 174.0727 . 1 472 104 104 ILE CA C 62.2000 . 1 473 104 104 ILE CB C 38.0200 . 1 474 105 105 ASP H H 7.9990 . 1 475 105 105 ASP C C 172.2126 . 1 476 105 105 ASP CA C 50.9225 . 1 477 105 105 ASP CB C 42.0718 . 1 478 105 105 ASP N N 117.2459 . 1 479 106 106 GLU H H 6.4054 . 1 480 106 106 GLU C C 174.3263 . 1 481 106 106 GLU CA C 54.2948 . 1 482 106 106 GLU CB C 32.7423 . 1 483 106 106 GLU N N 112.8823 . 1 484 107 107 ALA H H 7.7411 . 1 485 107 107 ALA HB H 1.1268 . 1 486 107 107 ALA C C 174.3163 . 1 487 107 107 ALA CA C 50.3821 . 1 488 107 107 ALA CB C 23.4259 . 1 489 107 107 ALA N N 119.9112 . 1 490 108 108 TYR H H 8.8416 . 1 491 108 108 TYR C C 174.9044 . 1 492 108 108 TYR CA C 56.3367 . 1 493 108 108 TYR CB C 41.3945 . 1 494 108 108 TYR N N 115.5745 . 1 495 109 109 LEU H H 9.9003 . 1 496 109 109 LEU C C 176.2082 . 1 497 109 109 LEU CA C 54.2361 . 1 498 109 109 LEU CB C 44.1197 . 1 499 109 109 LEU N N 121.8234 . 1 500 110 110 ASP H H 8.3621 . 1 501 110 110 ASP C C 178.3426 . 1 502 110 110 ASP CA C 53.2672 . 1 503 110 110 ASP CB C 40.4782 . 1 504 110 110 ASP N N 121.3706 . 1 505 111 111 ILE H H 8.1700 . 1 506 111 111 ILE C C 176.2865 . 1 507 111 111 ILE CA C 60.4124 . 1 508 111 111 ILE CB C 36.7632 . 1 509 111 111 ILE N N 120.5516 . 1 510 112 112 SER H H 8.8699 . 1 511 112 112 SER CA C 62.2010 . 1 512 112 112 SER CB C 63.0780 . 1 513 112 112 SER N N 120.0937 . 1 514 113 113 ASP C C 176.3309 . 1 515 113 113 ASP CA C 53.8472 . 1 516 113 113 ASP CB C 39.4640 . 1 517 114 114 LYS H H 7.7907 . 1 518 114 114 LYS C C 176.2252 . 1 519 114 114 LYS CA C 55.2598 . 1 520 114 114 LYS CB C 33.5919 . 1 521 114 114 LYS N N 117.4135 . 1 522 115 115 VAL H H 7.2411 . 1 523 115 115 VAL C C 174.8566 . 1 524 115 115 VAL CA C 57.9052 . 1 525 115 115 VAL CB C 34.8977 . 1 526 115 115 VAL N N 109.4124 . 1 527 116 116 ARG H H 8.8390 . 1 528 116 116 ARG C C 176.3185 . 1 529 116 116 ARG CA C 56.3813 . 1 530 116 116 ARG CB C 30.9382 . 1 531 116 116 ARG N N 118.2053 . 1 532 117 117 ASP H H 7.2038 . 1 533 117 117 ASP C C 176.3185 . 1 534 117 117 ASP CA C 52.3304 . 1 535 117 117 ASP CB C 41.6248 . 1 536 117 117 ASP N N 113.7705 . 1 537 118 118 TYR C C 178.0736 . 1 538 118 118 TYR CA C 60.6815 . 1 539 118 118 TYR CB C 37.4551 . 1 540 119 119 ARG H H 8.1200 . 1 541 119 119 ARG C C 179.2388 . 1 542 119 119 ARG CA C 58.9300 . 1 543 119 119 ARG CB C 28.1617 . 1 544 119 119 ARG N N 123.7918 . 1 545 120 120 GLU H H 8.6607 . 1 546 120 120 GLU C C 180.5605 . 1 547 120 120 GLU CA C 59.1176 . 1 548 120 120 GLU CB C 29.6597 . 1 549 120 120 GLU N N 120.6039 . 1 550 121 121 ALA H H 8.0926 . 1 551 121 121 ALA HB H 1.6680 . 1 552 121 121 ALA C C 177.4500 . 1 553 121 121 ALA CA C 55.2174 . 1 554 121 121 ALA CB C 19.2022 . 1 555 121 121 ALA N N 121.0730 . 1 556 122 122 TYR H H 8.2548 . 1 557 122 122 TYR C C 176.3162 . 1 558 122 122 TYR CA C 61.3458 . 1 559 122 122 TYR CB C 37.6032 . 1 560 122 122 TYR N N 120.3393 . 1 561 123 123 ASN H H 7.6707 . 1 562 123 123 ASN HB2 H 0.0000 . 2 563 123 123 ASN C C 178.2715 . 1 564 123 123 ASN CA C 55.9643 . 1 565 123 123 ASN CB C 37.3548 . 1 566 123 123 ASN N N 117.1369 . 1 567 124 124 LEU H H 7.9660 . 1 568 124 124 LEU C C 178.4977 . 1 569 124 124 LEU CA C 57.3812 . 1 570 124 124 LEU CB C 40.7601 . 1 571 124 124 LEU N N 123.9041 . 1 572 125 125 GLY H H 8.5758 . 1 573 125 125 GLY C C 174.7812 . 1 574 125 125 GLY CA C 47.4946 . 1 575 125 125 GLY N N 107.1414 . 1 576 126 126 LEU H H 7.9137 . 1 577 126 126 LEU C C 178.9283 . 1 578 126 126 LEU CA C 57.4326 . 1 579 126 126 LEU CB C 40.7725 . 1 580 126 126 LEU N N 121.4808 . 1 581 127 127 GLU H H 7.5586 . 1 582 127 127 GLU C C 178.9283 . 1 583 127 127 GLU CA C 59.3983 . 1 584 127 127 GLU CB C 28.2270 . 1 585 127 127 GLU N N 121.5867 . 1 586 128 128 ILE H H 8.1690 . 1 587 128 128 ILE C C 177.6375 . 1 588 128 128 ILE CA C 65.6483 . 1 589 128 128 ILE CB C 37.5272 . 1 590 128 128 ILE N N 120.5900 . 1 591 129 129 LYS H H 7.9292 . 1 592 129 129 LYS C C 179.8152 . 1 593 129 129 LYS CA C 59.5146 . 1 594 129 129 LYS CB C 30.6762 . 1 595 129 129 LYS N N 118.2666 . 1 596 130 130 ASN H H 8.2500 . 1 597 130 130 ASN C C 177.3304 . 1 598 130 130 ASN CA C 55.9919 . 1 599 130 130 ASN CB C 37.6568 . 1 600 130 130 ASN N N 119.1680 . 1 601 131 131 LYS H H 8.5393 . 1 602 131 131 LYS C C 178.8386 . 1 603 131 131 LYS CA C 58.3882 . 1 604 131 131 LYS CB C 30.8406 . 1 605 131 131 LYS N N 122.9273 . 1 606 132 132 ILE H H 8.1820 . 1 607 132 132 ILE C C 178.3242 . 1 608 132 132 ILE CA C 65.8804 . 1 609 132 132 ILE CB C 37.2668 . 1 610 132 132 ILE N N 119.0000 . 1 611 133 133 LEU H H 7.5888 . 1 612 133 133 LEU C C 179.9943 . 1 613 133 133 LEU CA C 57.8914 . 1 614 133 133 LEU CB C 41.2452 . 1 615 133 133 LEU N N 121.5867 . 1 616 134 134 GLU H H 8.2224 . 1 617 134 134 GLU C C 178.3254 . 1 618 134 134 GLU CA C 59.0016 . 1 619 134 134 GLU CB C 29.3609 . 1 620 134 134 GLU N N 119.8420 . 1 621 135 135 LYS H H 8.1301 . 1 622 135 135 LYS C C 178.2264 . 1 623 135 135 LYS CA C 57.5993 . 1 624 135 135 LYS CB C 32.4740 . 1 625 135 135 LYS N N 115.2117 . 1 626 136 136 GLU H H 8.1478 . 1 627 136 136 GLU C C 175.7379 . 1 628 136 136 GLU CA C 54.1699 . 1 629 136 136 GLU CB C 30.2091 . 1 630 136 136 GLU N N 114.0473 . 1 631 137 137 LYS H H 7.6098 . 1 632 137 137 LYS C C 173.7236 . 1 633 137 137 LYS CA C 57.3165 . 1 634 137 137 LYS CB C 27.9093 . 1 635 137 137 LYS N N 113.1316 . 1 636 138 138 ILE H H 6.2108 . 1 637 138 138 ILE C C 175.5272 . 1 638 138 138 ILE CA C 56.6916 . 1 639 138 138 ILE CB C 40.1179 . 1 640 138 138 ILE N N 114.7669 . 1 641 139 139 THR H H 10.2348 . 1 642 139 139 THR C C 174.0833 . 1 643 139 139 THR CA C 61.3073 . 1 644 139 139 THR CB C 69.3051 . 1 645 139 139 THR N N 119.0412 . 1 646 140 140 VAL H H 7.4488 . 1 647 140 140 VAL C C 173.6266 . 1 648 140 140 VAL CA C 57.5004 . 1 649 140 140 VAL CB C 33.3144 . 1 650 140 140 VAL N N 114.0454 . 1 651 141 141 THR H H 8.9253 . 1 652 141 141 THR C C 173.0086 . 1 653 141 141 THR CA C 61.7146 . 1 654 141 141 THR CB C 69.5962 . 1 655 141 141 THR N N 118.3932 . 1 656 142 142 VAL H H 7.6880 . 1 657 142 142 VAL C C 174.5415 . 1 658 142 142 VAL CA C 59.3183 . 1 659 142 142 VAL CB C 34.0745 . 1 660 142 142 VAL N N 125.7557 . 1 661 143 143 GLY H H 9.4374 . 1 662 143 143 GLY C C 173.0440 . 1 663 143 143 GLY CA C 43.7349 . 1 664 143 143 GLY N N 114.6574 . 1 665 144 144 ILE H H 8.4886 . 1 666 144 144 ILE C C 175.6467 . 1 667 144 144 ILE CA C 59.3392 . 1 668 144 144 ILE CB C 41.9080 . 1 669 144 144 ILE N N 124.1258 . 1 670 145 145 SER H H 8.5893 . 1 671 145 145 SER C C 174.6894 . 1 672 145 145 SER CA C 56.8320 . 1 673 145 145 SER CB C 63.2463 . 1 674 145 145 SER N N 56.8322 . 1 675 146 146 LYS H H 8.7804 . 1 676 146 146 LYS C C 175.0552 . 1 677 146 146 LYS CA C 55.5131 . 1 678 146 146 LYS CB C 31.0936 . 1 679 146 146 LYS N N 116.4656 . 1 680 147 147 ASN H H 7.4895 . 1 681 147 147 ASN C C 175.3270 . 1 682 147 147 ASN CA C 51.7740 . 1 683 147 147 ASN CB C 40.1188 . 1 684 147 147 ASN N N 110.9837 . 1 685 148 148 LYS H H 8.8462 . 1 686 148 148 LYS C C 176.6243 . 1 687 148 148 LYS CA C 60.8237 . 1 688 148 148 LYS CB C 32.4448 . 1 689 148 148 LYS N N 115.7816 . 1 690 149 149 VAL H H 6.6217 . 1 691 149 149 VAL C C 177.8818 . 1 692 149 149 VAL CA C 65.6317 . 1 693 149 149 VAL CB C 30.4709 . 1 694 149 149 VAL N N 117.1326 . 1 695 150 150 PHE H H 8.1645 . 1 696 150 150 PHE C C 177.3739 . 1 697 150 150 PHE CA C 61.3297 . 1 698 150 150 PHE CB C 38.2291 . 1 699 150 150 PHE N N 115.5348 . 1 700 151 151 ALA H H 7.6970 . 1 701 151 151 ALA HB H 1.4517 . 1 702 151 151 ALA C C 177.6166 . 1 703 151 151 ALA CA C 57.0805 . 1 704 151 151 ALA CB C 36.4024 . 1 705 151 151 ALA N N 123.2274 . 1 706 152 152 LYS H H 7.1602 . 1 707 152 152 LYS C C 178.3115 . 1 708 152 152 LYS CA C 58.9728 . 1 709 152 152 LYS N N 119.4406 . 1 710 153 153 ILE H H 8.0181 . 1 711 153 153 ILE C C 177.5851 . 1 712 153 153 ILE CA C 65.0843 . 1 713 153 153 ILE CB C 37.9276 . 1 714 153 153 ILE N N 120.4076 . 1 715 154 154 ALA H H 7.8811 . 1 716 154 154 ALA HB H 1.5094 . 1 717 154 154 ALA C C 178.4168 . 1 718 154 154 ALA CA C 55.3740 . 1 719 154 154 ALA CB C 16.9127 . 1 720 154 154 ALA N N 120.7800 . 1 721 155 155 ALA H H 7.2178 . 1 722 155 155 ALA HB H 1.6406 . 1 723 155 155 ALA C C 179.9531 . 1 724 155 155 ALA CA C 54.1618 . 1 725 155 155 ALA CB C 18.0700 . 1 726 155 155 ALA N N 118.0000 . 1 727 156 156 ASP H H 8.5039 . 1 728 156 156 ASP C C 179.2389 . 1 729 156 156 ASP CA C 57.4278 . 1 730 156 156 ASP CB C 39.7450 . 1 731 156 156 ASP N N 120.5763 . 1 732 157 157 MET H H 7.9008 . 1 733 157 157 MET C C 176.9664 . 1 734 157 157 MET CA C 57.6022 . 1 735 157 157 MET CB C 32.8363 . 1 736 157 157 MET N N 116.0674 . 1 737 158 158 ALA H H 7.5045 . 1 738 158 158 ALA HB H 1.3088 . 1 739 158 158 ALA C C 176.0932 . 1 740 158 158 ALA CA C 51.4033 . 1 741 158 158 ALA CB C 20.4919 . 1 742 158 158 ALA N N 121.7676 . 1 743 159 159 LYS H H 7.1087 . 1 744 159 159 LYS CA C 54.5662 . 1 745 159 159 LYS CB C 31.3564 . 1 746 159 159 LYS N N 118.4430 . 1 747 160 160 PRO CA C 55.2045 . 1 748 161 161 ASN H H 8.7116 . 1 749 161 161 ASN C C 176.5286 . 1 750 161 161 ASN CA C 52.2011 . 1 751 161 161 ASN CB C 38.7800 . 1 752 161 161 ASN N N 121.1092 . 1 753 162 162 GLY H H 7.8065 . 1 754 162 162 GLY C C 174.0790 . 1 755 162 162 GLY CA C 43.9623 . 1 756 162 162 GLY N N 105.9565 . 1 757 163 163 ILE H H 8.1865 . 1 758 163 163 ILE C C 172.9365 . 1 759 163 163 ILE CA C 59.6560 . 1 760 163 163 ILE CB C 38.9715 . 1 761 163 163 ILE N N 117.8915 . 1 762 164 164 LYS H H 8.1381 . 1 763 164 164 LYS C C 173.1652 . 1 764 164 164 LYS CA C 55.2556 . 1 765 164 164 LYS CB C 35.7188 . 1 766 164 164 LYS N N 127.7580 . 1 767 165 165 VAL H H 8.5343 . 1 768 165 165 VAL C C 176.1735 . 1 769 165 165 VAL CA C 59.6401 . 1 770 165 165 VAL CB C 33.2504 . 1 771 165 165 VAL N N 126.5394 . 1 772 166 166 ILE H H 8.5157 . 1 773 166 166 ILE C C 174.8199 . 1 774 166 166 ILE CA C 60.7271 . 1 775 166 166 ILE CB C 38.0696 . 1 776 166 166 ILE N N 127.7426 . 1 777 167 167 ASP H H 8.4896 . 1 778 167 167 ASP CA C 52.3377 . 1 779 167 167 ASP CB C 39.8548 . 1 780 167 167 ASP N N 128.5317 . 1 781 168 168 ASP C C 178.7993 . 1 782 168 168 ASP CB C 39.6955 . 1 783 169 169 GLU H H 7.8522 . 1 784 169 169 GLU C C 178.9654 . 1 785 169 169 GLU CA C 58.3990 . 1 786 169 169 GLU CB C 28.4374 . 1 787 169 169 GLU N N 119.0130 . 1 788 170 170 GLU H H 8.0946 . 1 789 170 170 GLU C C 178.7543 . 1 790 170 170 GLU CA C 58.5400 . 1 791 170 170 GLU CB C 28.2753 . 1 792 170 170 GLU N N 123.7318 . 1 793 171 171 VAL H H 8.1660 . 1 794 171 171 VAL HA H 2.8805 . 1 795 171 171 VAL C C 176.5540 . 1 796 171 171 VAL CA C 66.7194 . 1 797 171 171 VAL CB C 30.3455 . 1 798 171 171 VAL N N 120.9916 . 1 799 172 172 LYS H H 6.7318 . 1 800 172 172 LYS C C 179.2500 . 1 801 172 172 LYS CA C 59.0931 . 1 802 172 172 LYS CB C 31.1451 . 1 803 172 172 LYS N N 114.6016 . 1 804 173 173 ARG H H 7.1511 . 1 805 173 173 ARG C C 178.7604 . 1 806 173 173 ARG CA C 58.7900 . 1 807 173 173 ARG CB C 29.4432 . 1 808 173 173 ARG N N 118.0339 . 1 809 174 174 LEU H H 8.5616 . 1 810 174 174 LEU C C 179.3808 . 1 811 174 174 LEU CA C 57.2908 . 1 812 174 174 LEU CB C 41.3467 . 1 813 174 174 LEU N N 120.8978 . 1 814 175 175 ILE H H 8.2190 . 1 815 175 175 ILE C C 176.1252 . 1 816 175 175 ILE CA C 66.0688 . 1 817 175 175 ILE CB C 38.0179 . 1 818 175 175 ILE N N 119.1680 . 1 819 176 176 ARG H H 6.7865 . 1 820 176 176 ARG C C 176.6292 . 1 821 176 176 ARG CA C 57.5101 . 1 822 176 176 ARG CB C 29.9670 . 1 823 176 176 ARG N N 113.3161 . 1 824 177 177 GLU H H 7.5920 . 1 825 177 177 GLU C C 177.5046 . 1 826 177 177 GLU CA C 56.5559 . 1 827 177 177 GLU CB C 31.4810 . 1 828 177 177 GLU N N 115.2772 . 1 829 178 178 LEU H H 8.4200 . 1 830 178 178 LEU C C 176.5255 . 1 831 178 178 LEU CA C 55.7449 . 1 832 178 178 LEU CB C 46.8842 . 1 833 178 178 LEU N N 124.5300 . 1 834 179 179 ASP H H 8.8716 . 1 835 179 179 ASP C C 178.0975 . 1 836 179 179 ASP CA C 54.5066 . 1 837 179 179 ASP CB C 41.1010 . 1 838 179 179 ASP N N 128.1860 . 1 839 180 180 ILE H H 8.0378 . 1 840 180 180 ILE HG12 H 1.3184 . 2 841 180 180 ILE HG13 H 1.1100 . 2 842 180 180 ILE C C 175.3147 . 1 843 180 180 ILE CA C 61.3974 . 1 844 180 180 ILE CB C 37.8579 . 1 845 180 180 ILE N N 125.0044 . 1 846 181 181 ALA H H 8.2400 . 1 847 181 181 ALA HB H 1.2857 . 1 848 181 181 ALA C C 177.9238 . 1 849 181 181 ALA CA C 52.7832 . 1 850 181 181 ALA CB C 17.8501 . 1 851 181 181 ALA N N 119.0000 . 1 852 182 182 ASP H H 7.7382 . 1 853 182 182 ASP C C 175.7048 . 1 854 182 182 ASP CA C 54.1331 . 1 855 182 182 ASP CB C 40.6169 . 1 856 182 182 ASP N N 116.9909 . 1 857 183 183 VAL H H 7.2338 . 1 858 183 183 VAL HG1 H 0.0000 . 2 859 183 183 VAL CA C 60.5270 . 1 860 183 183 VAL CB C 31.3170 . 1 861 183 183 VAL N N 122.6195 . 1 862 185 185 GLY C C 173.0185 . 1 863 185 185 GLY CA C 44.4416 . 1 864 186 186 ILE H H 7.7132 . 1 865 186 186 ILE C C 175.0167 . 1 866 186 186 ILE CA C 58.0748 . 1 867 186 186 ILE CB C 33.4368 . 1 868 186 186 ILE N N 121.8601 . 1 869 187 187 GLY H H 7.9356 . 1 870 187 187 GLY CA C 43.7792 . 1 871 187 187 GLY N N 114.3050 . 1 872 188 188 ASN C C 177.8094 . 1 873 188 188 ASN CA C 56.7719 . 1 874 188 188 ASN CB C 38.3621 . 1 875 189 189 ILE H H 8.3078 . 1 876 189 189 ILE C C 179.2831 . 1 877 189 189 ILE CA C 63.7518 . 1 878 189 189 ILE CB C 35.6829 . 1 879 189 189 ILE N N 119.2538 . 1 880 190 190 THR H H 7.8678 . 1 881 190 190 THR C C 176.1378 . 1 882 190 190 THR CA C 67.3349 . 1 883 190 190 THR CB C 66.5266 . 1 884 190 190 THR N N 118.1684 . 1 885 191 191 ALA H H 8.6840 . 1 886 191 191 ALA HB H 1.3995 . 1 887 191 191 ALA C C 179.3084 . 1 888 191 191 ALA CA C 55.5138 . 1 889 191 191 ALA CB C 17.1089 . 1 890 191 191 ALA N N 122.9600 . 1 891 192 192 GLU H H 7.6556 . 1 892 192 192 GLU C C 179.2543 . 1 893 192 192 GLU CA C 59.1451 . 1 894 192 192 GLU CB C 28.5049 . 1 895 192 192 GLU N N 117.6141 . 1 896 193 193 LYS H H 7.4941 . 1 897 193 193 LYS C C 178.7714 . 1 898 193 193 LYS CA C 59.6849 . 1 899 193 193 LYS CB C 32.2771 . 1 900 193 193 LYS N N 119.4544 . 1 901 194 194 LEU H H 7.7927 . 1 902 194 194 LEU C C 179.4331 . 1 903 194 194 LEU CA C 57.3979 . 1 904 194 194 LEU CB C 39.3869 . 1 905 194 194 LEU N N 117.3400 . 1 906 195 195 LYS H H 8.3326 . 1 907 195 195 LYS C C 181.4287 . 1 908 195 195 LYS CA C 59.5230 . 1 909 195 195 LYS CB C 31.1217 . 1 910 195 195 LYS N N 122.0051 . 1 911 196 196 LYS H H 7.6319 . 1 912 196 196 LYS C C 181.4287 . 1 913 196 196 LYS CA C 58.7831 . 1 914 196 196 LYS CB C 40.3233 . 1 915 196 196 LYS N N 120.6238 . 1 916 197 197 LEU H H 7.2178 . 1 917 197 197 LEU C C 177.3212 . 1 918 197 197 LEU CA C 54.1386 . 1 919 197 197 LEU CB C 42.0460 . 1 920 197 197 LEU N N 118.0000 . 1 921 198 198 GLY H H 7.6934 . 1 922 198 198 GLY C C 173.6365 . 1 923 198 198 GLY CA C 44.6636 . 1 924 198 198 GLY N N 106.5117 . 1 925 199 199 ILE H H 7.6172 . 1 926 199 199 ILE C C 172.4406 . 1 927 199 199 ILE CA C 59.6887 . 1 928 199 199 ILE CB C 35.7865 . 1 929 199 199 ILE N N 121.8656 . 1 930 200 200 ASN H H 8.5902 . 1 931 200 200 ASN C C 175.1550 . 1 932 200 200 ASN CA C 54.2219 . 1 933 200 200 ASN CB C 41.3015 . 1 934 200 200 ASN N N 123.0756 . 1 935 201 201 LYS H H 8.5139 . 1 936 201 201 LYS C C 178.3626 . 1 937 201 201 LYS CA C 52.7476 . 1 938 201 201 LYS CB C 34.8543 . 1 939 201 201 LYS N N 120.7633 . 1 940 202 202 LEU H H 8.9002 . 1 941 202 202 LEU HB2 H 2.0458 . 2 942 202 202 LEU C C 179.3313 . 1 943 202 202 LEU CA C 58.8867 . 1 944 202 202 LEU CB C 40.3327 . 1 945 202 202 LEU N N 123.0358 . 1 946 203 203 VAL H H 7.8598 . 1 947 203 203 VAL C C 176.3230 . 1 948 203 203 VAL CA C 63.9459 . 1 949 203 203 VAL CB C 30.7140 . 1 950 203 203 VAL N N 115.6152 . 1 951 204 204 ASP H H 7.6732 . 1 952 204 204 ASP C C 178.8436 . 1 953 204 204 ASP CA C 56.8330 . 1 954 204 204 ASP CB C 40.9598 . 1 955 204 204 ASP N N 123.1087 . 1 956 205 205 THR H H 7.7774 . 1 957 205 205 THR C C 174.4482 . 1 958 205 205 THR CA C 65.0896 . 1 959 205 205 THR CB C 68.3220 . 1 960 205 205 THR N N 110.8424 . 1 961 206 206 LEU H H 7.1295 . 1 962 206 206 LEU C C 178.2230 . 1 963 206 206 LEU CA C 55.0657 . 1 964 206 206 LEU CB C 40.0918 . 1 965 206 206 LEU N N 115.9593 . 1 966 207 207 SER H H 7.5178 . 1 967 207 207 SER C C 172.9478 . 1 968 207 207 SER CA C 58.3310 . 1 969 207 207 SER CB C 64.1718 . 1 970 207 207 SER N N 113.0858 . 1 971 208 208 ILE H H 6.8501 . 1 972 208 208 ILE HG12 H 1.5340 . 2 973 208 208 ILE HG13 H 1.4259 . 2 974 208 208 ILE C C 174.1740 . 1 975 208 208 ILE CA C 57.9815 . 1 976 208 208 ILE CB C 39.4912 . 1 977 208 208 ILE N N 119.7825 . 1 978 209 209 GLU H H 8.6397 . 1 979 209 209 GLU CA C 57.3188 . 1 980 209 209 GLU CB C 28.9951 . 1 981 209 209 GLU N N 126.7332 . 1 982 210 210 PHE C C 177.0743 . 1 983 210 210 PHE CA C 62.1329 . 1 984 210 210 PHE CB C 38.3974 . 1 985 211 211 ASP H H 8.8734 . 1 986 211 211 ASP C C 179.2627 . 1 987 211 211 ASP CA C 57.2293 . 1 988 211 211 ASP CB C 39.7388 . 1 989 211 211 ASP N N 115.9863 . 1 990 212 212 LYS H H 7.1492 . 1 991 212 212 LYS C C 178.6350 . 1 992 212 212 LYS CA C 58.0469 . 1 993 212 212 LYS CB C 31.4443 . 1 994 212 212 LYS N N 119.7106 . 1 995 213 213 LEU H H 7.2516 . 1 996 213 213 LEU C C 178.4764 . 1 997 213 213 LEU CA C 57.6216 . 1 998 213 213 LEU CB C 41.3347 . 1 999 213 213 LEU N N 120.9621 . 1 1000 214 214 LYS H H 8.4533 . 1 1001 214 214 LYS C C 178.8371 . 1 1002 214 214 LYS CA C 58.2144 . 1 1003 214 214 LYS CB C 30.6603 . 1 1004 214 214 LYS N N 118.8208 . 1 1005 215 215 GLY H H 7.5723 . 1 1006 215 215 GLY C C 174.0692 . 1 1007 215 215 GLY CA C 46.0133 . 1 1008 215 215 GLY N N 106.6739 . 1 1009 216 216 MET H H 7.1964 . 1 1010 216 216 MET HB2 H 2.1574 . 2 1011 216 216 MET HB3 H 1.9775 . 2 1012 216 216 MET C C 177.2845 . 1 1013 216 216 MET CA C 56.2021 . 1 1014 216 216 MET CB C 33.5288 . 1 1015 216 216 MET N N 117.3439 . 1 1016 217 217 ILE H H 7.5059 . 1 1017 217 217 ILE C C 175.8971 . 1 1018 217 217 ILE CA C 60.1453 . 1 1019 217 217 ILE CB C 39.3293 . 1 1020 217 217 ILE N N 107.1847 . 1 1021 218 218 GLY H H 7.8648 . 1 1022 218 218 GLY C C 173.1333 . 1 1023 218 218 GLY CA C 44.4770 . 1 1024 218 218 GLY N N 113.9064 . 1 1025 219 219 GLU H H 8.6422 . 1 1026 219 219 GLU C C 177.4621 . 1 1027 219 219 GLU CA C 60.4929 . 1 1028 219 219 GLU CB C 29.6382 . 1 1029 219 219 GLU N N 121.8801 . 1 1030 220 220 ALA H H 8.7664 . 1 1031 220 220 ALA HB H 1.5662 . 1 1032 220 220 ALA C C 181.9504 . 1 1033 220 220 ALA CA C 55.7231 . 1 1034 220 220 ALA CB C 17.7300 . 1 1035 220 220 ALA N N 121.9238 . 1 1036 221 221 LYS H H 9.0200 . 1 1037 221 221 LYS C C 178.3189 . 1 1038 221 221 LYS CA C 58.6232 . 1 1039 221 221 LYS CB C 31.1635 . 1 1040 221 221 LYS N N 119.4660 . 1 1041 222 222 ALA H H 7.8130 . 1 1042 222 222 ALA HB H 1.2246 . 1 1043 222 222 ALA C C 178.5528 . 1 1044 222 222 ALA CA C 55.7414 . 1 1045 222 222 ALA CB C 17.9140 . 1 1046 222 222 ALA N N 121.1020 . 1 1047 223 223 LYS H H 8.6485 . 1 1048 223 223 LYS C C 179.4257 . 1 1049 223 223 LYS CA C 59.8343 . 1 1050 223 223 LYS CB C 31.5954 . 1 1051 223 223 LYS N N 116.8320 . 1 1052 224 224 TYR H H 7.8646 . 1 1053 224 224 TYR C C 176.7596 . 1 1054 224 224 TYR CA C 59.7063 . 1 1055 224 224 TYR CB C 37.9033 . 1 1056 224 224 TYR N N 121.8429 . 1 1057 225 225 LEU H H 7.9816 . 1 1058 225 225 LEU HB2 H 2.0088 . 2 1059 225 225 LEU C C 178.5677 . 1 1060 225 225 LEU CA C 57.6926 . 1 1061 225 225 LEU CB C 41.5772 . 1 1062 225 225 LEU N N 118.2512 . 1 1063 226 226 ILE H H 8.1090 . 1 1064 226 226 ILE C C 178.3513 . 1 1065 226 226 ILE CA C 63.9707 . 1 1066 226 226 ILE CB C 36.6904 . 1 1067 226 226 ILE N N 117.5135 . 1 1068 227 227 SER H H 8.1301 . 1 1069 227 227 SER C C 176.9259 . 1 1070 227 227 SER CA C 61.6541 . 1 1071 227 227 SER CB C 62.7580 . 1 1072 227 227 SER N N 115.7117 . 1 1073 228 228 LEU H H 7.6581 . 1 1074 228 228 LEU C C 179.4482 . 1 1075 228 228 LEU CA C 57.2270 . 1 1076 228 228 LEU CB C 34.2515 . 1 1077 228 228 LEU N N 123.7200 . 1 1078 229 229 ALA H H 8.2551 . 1 1079 229 229 ALA HB H 1.3123 . 1 1080 229 229 ALA C C 177.6549 . 1 1081 229 229 ALA CA C 54.0629 . 1 1082 229 229 ALA CB C 18.0105 . 1 1083 229 229 ALA N N 121.1298 . 1 1084 230 230 ARG H H 7.8149 . 1 1085 230 230 ARG C C 175.9380 . 1 1086 230 230 ARG CA C 55.8827 . 1 1087 230 230 ARG CB C 29.9941 . 1 1088 230 230 ARG N N 113.1962 . 1 1089 231 231 ASP H H 8.1185 . 1 1090 231 231 ASP C C 175.3258 . 1 1091 231 231 ASP CA C 54.3058 . 1 1092 231 231 ASP CB C 38.7344 . 1 1093 231 231 ASP N N 120.3700 . 1 1094 232 232 GLU H H 8.4691 . 1 1095 232 232 GLU C C 175.8749 . 1 1096 232 232 GLU CA C 54.5077 . 1 1097 232 232 GLU CB C 30.7694 . 1 1098 232 232 GLU N N 116.1270 . 1 1099 233 233 TYR H H 7.4366 . 1 1100 233 233 TYR CA C 58.8687 . 1 1101 233 233 TYR CB C 38.0618 . 1 1102 233 233 TYR N N 123.8381 . 1 1103 234 234 ASN C C 173.5155 . 1 1104 234 234 ASN CA C 52.3404 . 1 1105 235 235 GLU H H 5.8364 . 1 1106 235 235 GLU CA C 53.7884 . 1 1107 235 235 GLU CB C 30.2261 . 1 1108 235 235 GLU N N 121.2407 . 1 1109 236 236 PRO CA C 61.9338 . 1 1110 236 236 PRO CB C 31.8252 . 1 1111 237 237 ILE H H 8.2026 . 1 1112 237 237 ILE HG12 H 0.8130 . 2 1113 237 237 ILE C C 175.7530 . 1 1114 237 237 ILE CA C 60.6906 . 1 1115 237 237 ILE CB C 36.0308 . 1 1116 237 237 ILE N N 122.4426 . 1 1117 238 238 ARG H H 8.5243 . 1 1118 238 238 ARG C C 175.6231 . 1 1119 238 238 ARG CA C 54.3111 . 1 1120 238 238 ARG CB C 32.2579 . 1 1121 238 238 ARG N N 128.6407 . 1 1122 241 241 VAL HG2 H 0.0000 . 2 1123 242 242 ARG C C 177.3496 . 1 1124 243 243 LYS H H 9.4864 . 1 1125 243 243 LYS C C 175.6399 . 1 1126 243 243 LYS CA C 56.8970 . 1 1127 243 243 LYS CB C 33.0480 . 1 1128 243 243 LYS N N 125.6083 . 1 1129 244 244 SER H H 7.6882 . 1 1130 244 244 SER C C 171.6745 . 1 1131 244 244 SER CA C 57.3089 . 1 1132 244 244 SER CB C 65.8762 . 1 1133 244 244 SER N N 113.5961 . 1 1134 245 245 ILE H H 8.8120 . 1 1135 245 245 ILE C C 175.0426 . 1 1136 245 245 ILE CA C 60.0236 . 1 1137 245 245 ILE CB C 42.5622 . 1 1138 245 245 ILE N N 120.4099 . 1 1139 246 246 GLY H H 8.7426 . 1 1140 246 246 GLY C C 171.4702 . 1 1141 246 246 GLY CA C 45.9273 . 1 1142 246 246 GLY N N 115.2515 . 1 1143 247 247 ARG H H 8.2061 . 1 1144 247 247 ARG C C 173.8101 . 1 1145 247 247 ARG CA C 54.3328 . 1 1146 247 247 ARG CB C 32.8574 . 1 1147 247 247 ARG N N 119.1190 . 1 1148 248 248 ILE H H 8.9606 . 1 1149 248 248 ILE C C 174.1858 . 1 1150 248 248 ILE CA C 60.4912 . 1 1151 248 248 ILE CB C 39.4835 . 1 1152 248 248 ILE N N 128.2211 . 1 1153 249 249 VAL H H 8.6177 . 1 1154 249 249 VAL C C 175.6231 . 1 1155 249 249 VAL CA C 59.3336 . 1 1156 249 249 VAL CB C 34.0476 . 1 1157 249 249 VAL N N 122.0609 . 1 1158 250 250 THR H H 8.5941 . 1 1159 250 250 THR C C 174.5032 . 1 1160 250 250 THR CA C 66.3389 . 1 1161 250 250 THR CB C 66.3112 . 1 1162 250 250 THR N N 122.0609 . 1 1163 251 251 MET H H 7.8952 . 1 1164 251 251 MET C C 177.7612 . 1 1165 251 251 MET CA C 55.5007 . 1 1166 251 251 MET CB C 33.6408 . 1 1167 251 251 MET N N 125.6436 . 1 1168 252 252 LYS C C 175.0597 . 1 1169 254 254 ASN CA C 52.2709 . 1 1170 254 254 ASN CB C 36.4661 . 1 1171 255 255 SER H H 8.5611 . 1 1172 255 255 SER CA C 57.7527 . 1 1173 255 255 SER CB C 65.9712 . 1 1174 255 255 SER N N 114.0384 . 1 1175 258 258 LEU HB2 H 1.7715 . 2 1176 258 258 LEU HB3 H 1.6881 . 2 1177 258 258 LEU C C 177.8968 . 1 1178 258 258 LEU CA C 59.4024 . 1 1179 258 258 LEU CB C 41.5791 . 1 1180 259 259 GLU H H 8.0425 . 1 1181 259 259 GLU C C 178.3294 . 1 1182 259 259 GLU CA C 58.4010 . 1 1183 259 259 GLU CB C 28.1933 . 1 1184 259 259 GLU N N 114.4620 . 1 1185 260 260 GLU H H 7.4245 . 1 1186 260 260 GLU C C 177.7201 . 1 1187 260 260 GLU CA C 57.1874 . 1 1188 260 260 GLU CB C 29.7861 . 1 1189 260 260 GLU N N 118.5394 . 1 1190 261 261 ILE H H 7.6298 . 1 1191 261 261 ILE C C 177.9101 . 1 1192 261 261 ILE CA C 62.6732 . 1 1193 261 261 ILE CB C 38.8348 . 1 1194 261 261 ILE N N 118.3462 . 1 1195 262 262 LYS H H 8.0924 . 1 1196 262 262 LYS CA C 63.4462 . 1 1197 262 262 LYS CB C 29.9332 . 1 1198 262 262 LYS N N 120.2230 . 1 1199 263 263 PRO C C 180.2177 . 1 1200 263 263 PRO CA C 65.9889 . 1 1201 263 263 PRO CB C 30.1712 . 1 1202 264 264 TYR H H 7.2516 . 1 1203 264 264 TYR C C 176.9864 . 1 1204 264 264 TYR CA C 61.0280 . 1 1205 264 264 TYR CB C 45.2256 . 1 1206 264 264 TYR N N 115.4950 . 1 1207 265 265 LEU H H 7.3200 . 1 1208 265 265 LEU C C 178.1363 . 1 1209 265 265 LEU CA C 57.3865 . 1 1210 265 265 LEU CB C 41.5874 . 1 1211 265 265 LEU N N 120.9600 . 1 1212 266 266 PHE H H 8.8012 . 1 1213 266 266 PHE C C 178.3746 . 1 1214 266 266 PHE CA C 57.6547 . 1 1215 266 266 PHE CB C 35.5654 . 1 1216 266 266 PHE N N 117.7151 . 1 1217 267 267 ARG H H 7.6784 . 1 1218 267 267 ARG C C 178.1508 . 1 1219 267 267 ARG CA C 59.3114 . 1 1220 267 267 ARG CB C 28.7602 . 1 1221 267 267 ARG N N 121.3341 . 1 1222 268 268 ALA H H 8.1579 . 1 1223 268 268 ALA HB H 1.8556 . 1 1224 268 268 ALA C C 181.0421 . 1 1225 268 268 ALA CA C 55.3790 . 1 1226 268 268 ALA CB C 16.9073 . 1 1227 268 268 ALA N N 121.9605 . 1 1228 269 269 ILE H H 8.3421 . 1 1229 269 269 ILE HG12 H 0.0000 . 2 1230 269 269 ILE C C 177.6322 . 1 1231 269 269 ILE CA C 66.3136 . 1 1232 269 269 ILE CB C 37.5922 . 1 1233 269 269 ILE N N 120.9906 . 1 1234 270 270 GLU H H 8.5039 . 1 1235 270 270 GLU C C 180.0098 . 1 1236 270 270 GLU CA C 59.6916 . 1 1237 270 270 GLU CB C 28.4479 . 1 1238 270 270 GLU N N 121.0033 . 1 1239 271 271 GLU H H 8.5900 . 1 1240 271 271 GLU C C 180.0098 . 1 1241 271 271 GLU CA C 59.2502 . 1 1242 271 271 GLU CB C 29.0093 . 1 1243 271 271 GLU N N 116.9800 . 1 1244 272 272 SER H H 8.0747 . 1 1245 272 272 SER C C 175.9288 . 1 1246 272 272 SER CA C 62.9374 . 1 1247 272 272 SER N N 115.6730 . 1 1248 273 273 TYR H H 8.7889 . 1 1249 273 273 TYR C C 179.2181 . 1 1250 273 273 TYR CA C 62.5408 . 1 1251 273 273 TYR CB C 37.1744 . 1 1252 273 273 TYR N N 122.4651 . 1 1253 274 274 TYR H H 7.6354 . 1 1254 274 274 TYR C C 177.7612 . 1 1255 274 274 TYR CA C 60.0998 . 1 1256 274 274 TYR CB C 37.1722 . 1 1257 274 274 TYR N N 118.9454 . 1 1258 275 275 LYS H H 7.3198 . 1 1259 275 275 LYS C C 175.3409 . 1 1260 275 275 LYS CA C 57.2736 . 1 1261 275 275 LYS CB C 32.3818 . 1 1262 275 275 LYS N N 118.0324 . 1 1263 276 276 LEU H H 7.6354 . 1 1264 276 276 LEU CA C 56.9380 . 1 1265 276 276 LEU CB C 40.3769 . 1 1266 276 276 LEU N N 118.9454 . 1 1267 278 278 LYS C C 176.1987 . 1 1268 278 278 LYS CA C 56.4976 . 1 1269 279 279 ARG H H 7.4045 . 1 1270 279 279 ARG C C 175.0521 . 1 1271 279 279 ARG CA C 55.6191 . 1 1272 279 279 ARG CB C 30.8648 . 1 1273 279 279 ARG N N 119.5669 . 1 1274 280 280 ILE H H 8.4064 . 1 1275 280 280 ILE CA C 56.9477 . 1 1276 280 280 ILE CB C 39.3442 . 1 1277 280 280 ILE N N 121.4976 . 1 1278 281 281 PRO C C 176.1588 . 1 1279 281 281 PRO CA C 62.3546 . 1 1280 282 282 LYS H H 7.9732 . 1 1281 282 282 LYS C C 174.8033 . 1 1282 282 282 LYS CA C 56.7366 . 1 1283 282 282 LYS CB C 32.7023 . 1 1284 282 282 LYS N N 116.5796 . 1 1285 283 283 ALA H H 8.1660 . 1 1286 283 283 ALA HB H 1.3052 . 1 1287 283 283 ALA C C 175.4296 . 1 1288 283 283 ALA CA C 50.4443 . 1 1289 283 283 ALA CB C 21.3297 . 1 1290 283 283 ALA N N 120.9916 . 1 1291 284 284 ILE H H 8.2715 . 1 1292 284 284 ILE C C 171.6355 . 1 1293 284 284 ILE CA C 57.7652 . 1 1294 284 284 ILE CB C 41.2485 . 1 1295 284 284 ILE N N 118.0873 . 1 1296 285 285 HIS H H 8.5239 . 1 1297 285 285 HIS C C 171.6355 . 1 1298 285 285 HIS CA C 54.8909 . 1 1299 285 285 HIS CB C 32.1160 . 1 1300 285 285 HIS N N 123.7922 . 1 1301 286 286 VAL H H 8.9818 . 1 1302 286 286 VAL C C 173.9140 . 1 1303 286 286 VAL CA C 62.0328 . 1 1304 286 286 VAL CB C 31.6322 . 1 1305 286 286 VAL N N 123.9364 . 1 1306 287 287 VAL H H 8.1276 . 1 1307 287 287 VAL C C 172.7167 . 1 1308 287 287 VAL CA C 60.7916 . 1 1309 287 287 VAL CB C 33.4209 . 1 1310 287 287 VAL N N 127.6091 . 1 1311 288 288 ALA H H 9.2397 . 1 1312 288 288 ALA HB H 1.2852 . 1 1313 288 288 ALA C C 175.3661 . 1 1314 288 288 ALA CA C 48.9911 . 1 1315 288 288 ALA CB C 21.2524 . 1 1316 288 288 ALA N N 128.0166 . 1 1317 289 289 VAL H H 8.4929 . 1 1318 289 289 VAL C C 178.1027 . 1 1319 289 289 VAL CA C 59.7636 . 1 1320 289 289 VAL CB C 31.8817 . 1 1321 289 289 VAL N N 122.6457 . 1 1322 290 290 THR H H 9.0432 . 1 1323 290 290 THR C C 177.0164 . 1 1324 290 290 THR CA C 62.5415 . 1 1325 290 290 THR CB C 70.8353 . 1 1326 290 290 THR N N 119.3660 . 1 1327 291 291 GLU H H 8.3019 . 1 1328 291 291 GLU C C 174.5336 . 1 1329 291 291 GLU CA C 57.8677 . 1 1330 291 291 GLU CB C 29.4468 . 1 1331 291 291 GLU N N 117.1281 . 1 1332 292 292 ASP H H 8.4370 . 1 1333 292 292 ASP C C 174.9335 . 1 1334 292 292 ASP CA C 52.6284 . 1 1335 292 292 ASP CB C 38.5822 . 1 1336 292 292 ASP N N 117.2403 . 1 1337 293 293 LEU H H 8.1052 . 1 1338 293 293 LEU C C 175.4283 . 1 1339 293 293 LEU CA C 55.4840 . 1 1340 293 293 LEU CB C 35.5024 . 1 1341 293 293 LEU N N 115.8555 . 1 1342 294 294 ASP H H 7.0778 . 1 1343 294 294 ASP C C 174.2449 . 1 1344 294 294 ASP CA C 52.1587 . 1 1345 294 294 ASP CB C 40.6873 . 1 1346 294 294 ASP N N 119.5683 . 1 1347 295 295 ILE H H 8.0924 . 1 1348 295 295 ILE C C 176.2543 . 1 1349 295 295 ILE CA C 60.2463 . 1 1350 295 295 ILE CB C 38.8153 . 1 1351 295 295 ILE N N 120.2230 . 1 1352 296 296 VAL H H 9.3581 . 1 1353 296 296 VAL C C 173.5035 . 1 1354 296 296 VAL CA C 60.6588 . 1 1355 296 296 VAL CB C 34.1616 . 1 1356 296 296 VAL N N 132.0538 . 1 1357 297 297 SER H H 9.0678 . 1 1358 297 297 SER C C 174.9238 . 1 1359 297 297 SER CA C 55.4417 . 1 1360 297 297 SER CB C 66.8448 . 1 1361 297 297 SER N N 120.7094 . 1 1362 298 298 ARG H H 8.5248 . 1 1363 298 298 ARG C C 175.2899 . 1 1364 298 298 ARG CA C 53.1813 . 1 1365 298 298 ARG CB C 33.4725 . 1 1366 298 298 ARG N N 122.4712 . 1 1367 299 299 GLY H H 9.0602 . 1 1368 299 299 GLY C C 172.3507 . 1 1369 299 299 GLY CA C 44.7157 . 1 1370 299 299 GLY N N 110.4943 . 1 1371 300 300 ARG H H 8.3622 . 1 1372 300 300 ARG C C 174.0380 . 1 1373 300 300 ARG CA C 55.5072 . 1 1374 300 300 ARG CB C 33.7054 . 1 1375 300 300 ARG N N 117.7996 . 1 1376 301 301 THR H H 7.9951 . 1 1377 301 301 THR C C 174.0358 . 1 1378 301 301 THR CA C 62.3426 . 1 1379 301 301 THR CB C 69.2387 . 1 1380 301 301 THR N N 121.4100 . 1 1381 302 302 PHE H H 9.7287 . 1 1382 302 302 PHE CA C 55.5425 . 1 1383 302 302 PHE CB C 39.5302 . 1 1384 302 302 PHE N N 128.7743 . 1 1385 303 303 PRO C C 175.0681 . 1 1386 303 303 PRO CA C 59.1222 . 1 1387 304 304 HIS H H 7.1803 . 1 1388 304 304 HIS C C 174.1738 . 1 1389 304 304 HIS CA C 53.4844 . 1 1390 304 304 HIS CB C 32.5036 . 1 1391 304 304 HIS N N 111.7310 . 1 1392 305 305 GLY H H 8.2034 . 1 1393 305 305 GLY C C 173.6491 . 1 1394 305 305 GLY CA C 44.6272 . 1 1395 305 305 GLY N N 104.6186 . 1 1396 306 306 ILE H H 8.2688 . 1 1397 306 306 ILE CA C 60.6280 . 1 1398 306 306 ILE CB C 38.9857 . 1 1399 306 306 ILE N N 121.8953 . 1 1400 308 308 LYS C C 175.3931 . 1 1401 308 308 LYS CB C 30.4008 . 1 1402 309 309 GLU H H 8.2700 . 1 1403 309 309 GLU C C 179.8069 . 1 1404 309 309 GLU CA C 60.0082 . 1 1405 309 309 GLU CB C 28.0160 . 1 1406 309 309 GLU N N 116.3676 . 1 1407 310 310 THR H H 7.5891 . 1 1408 310 310 THR C C 175.5074 . 1 1409 310 310 THR CA C 65.3933 . 1 1410 310 310 THR CB C 67.5007 . 1 1411 310 310 THR N N 119.3648 . 1 1412 311 311 ALA H H 8.4988 . 1 1413 311 311 ALA HB H 1.7004 . 1 1414 311 311 ALA C C 180.4190 . 1 1415 311 311 ALA CA C 55.6372 . 1 1416 311 311 ALA CB C 17.1045 . 1 1417 311 311 ALA N N 125.1684 . 1 1418 312 312 TYR H H 8.2146 . 1 1419 312 312 TYR C C 178.0046 . 1 1420 312 312 TYR CA C 62.0191 . 1 1421 312 312 TYR CB C 37.6308 . 1 1422 312 312 TYR N N 118.5916 . 1 1423 313 313 SER H H 7.4903 . 1 1424 313 313 SER C C 178.0408 . 1 1425 313 313 SER CA C 60.9975 . 1 1426 313 313 SER CB C 62.8711 . 1 1427 313 313 SER N N 112.5817 . 1 1428 314 314 GLU H H 9.1973 . 1 1429 314 314 GLU C C 179.8058 . 1 1430 314 314 GLU CA C 58.0954 . 1 1431 314 314 GLU CB C 28.2738 . 1 1432 314 314 GLU N N 120.9042 . 1 1433 315 315 SER H H 8.4410 . 1 1434 315 315 SER C C 176.5169 . 1 1435 315 315 SER CA C 62.4349 . 1 1436 315 315 SER CB C 61.3128 . 1 1437 315 315 SER N N 114.8781 . 1 1438 316 316 VAL H H 7.0481 . 1 1439 316 316 VAL C C 177.4061 . 1 1440 316 316 VAL CA C 66.6097 . 1 1441 316 316 VAL CB C 31.0148 . 1 1442 316 316 VAL N N 122.1947 . 1 1443 317 317 LYS H H 6.9988 . 1 1444 317 317 LYS C C 180.1465 . 1 1445 317 317 LYS CA C 59.2615 . 1 1446 317 317 LYS CB C 31.4285 . 1 1447 317 317 LYS N N 119.7075 . 1 1448 318 318 LEU H H 7.9700 . 1 1449 318 318 LEU C C 178.4357 . 1 1450 318 318 LEU CA C 57.4402 . 1 1451 318 318 LEU CB C 39.8865 . 1 1452 318 318 LEU N N 120.7500 . 1 1453 319 319 LEU H H 8.3300 . 1 1454 319 319 LEU CA C 57.3378 . 1 1455 319 319 LEU CB C 40.3327 . 1 1456 319 319 LEU N N 120.4300 . 1 1457 320 320 GLN C C 177.9719 . 1 1458 320 320 GLN CB C 27.5606 . 1 1459 321 321 LYS H H 7.3707 . 1 1460 321 321 LYS C C 178.0935 . 1 1461 321 321 LYS CA C 59.2728 . 1 1462 321 321 LYS CB C 31.4314 . 1 1463 321 321 LYS N N 119.0974 . 1 1464 322 322 ILE H H 7.5521 . 1 1465 322 322 ILE C C 176.9432 . 1 1466 322 322 ILE CA C 66.8006 . 1 1467 322 322 ILE CB C 37.2623 . 1 1468 322 322 ILE N N 119.6329 . 1 1469 323 323 LEU H H 7.8035 . 1 1470 323 323 LEU C C 179.3708 . 1 1471 323 323 LEU CA C 56.8531 . 1 1472 323 323 LEU CB C 40.7255 . 1 1473 323 323 LEU N N 115.1729 . 1 1474 324 324 GLU H H 7.9684 . 1 1475 324 324 GLU C C 178.2935 . 1 1476 324 324 GLU CA C 57.7412 . 1 1477 324 324 GLU CB C 29.6392 . 1 1478 324 324 GLU N N 117.3022 . 1 1479 325 325 GLU H H 7.7830 . 1 1480 325 325 GLU C C 175.3815 . 1 1481 325 325 GLU CA C 56.7755 . 1 1482 325 325 GLU CB C 29.8849 . 1 1483 325 325 GLU N N 117.4135 . 1 1484 326 326 ASP H H 8.4127 . 1 1485 326 326 ASP C C 175.3379 . 1 1486 326 326 ASP CA C 53.6389 . 1 1487 326 326 ASP CB C 44.8149 . 1 1488 326 326 ASP N N 124.9398 . 1 1489 327 327 GLU H H 8.4240 . 1 1490 327 327 GLU C C 177.0208 . 1 1491 327 327 GLU CA C 56.8978 . 1 1492 327 327 GLU CB C 29.7771 . 1 1493 327 327 GLU N N 123.4646 . 1 1494 328 328 ARG H H 8.4818 . 1 1495 328 328 ARG C C 177.2180 . 1 1496 328 328 ARG CA C 56.9390 . 1 1497 328 328 ARG CB C 30.9592 . 1 1498 328 328 ARG N N 121.1920 . 1 1499 329 329 LYS H H 8.5806 . 1 1500 329 329 LYS C C 175.3267 . 1 1501 329 329 LYS CA C 56.3005 . 1 1502 329 329 LYS CB C 33.2738 . 1 1503 329 329 LYS N N 117.4173 . 1 1504 330 330 ILE H H 7.9137 . 1 1505 330 330 ILE C C 173.2390 . 1 1506 330 330 ILE CA C 61.2425 . 1 1507 330 330 ILE CB C 37.3442 . 1 1508 330 330 ILE N N 121.4808 . 1 1509 331 331 ARG H H 9.1229 . 1 1510 331 331 ARG C C 175.0597 . 1 1511 331 331 ARG CA C 57.1347 . 1 1512 331 331 ARG CB C 33.7765 . 1 1513 331 331 ARG N N 126.6290 . 1 1514 332 332 ARG H H 7.9936 . 1 1515 332 332 ARG C C 173.5344 . 1 1516 332 332 ARG CA C 52.8265 . 1 1517 332 332 ARG CB C 31.9746 . 1 1518 332 332 ARG N N 114.3595 . 1 1519 333 333 ILE H H 8.9838 . 1 1520 333 333 ILE C C 172.2392 . 1 1521 333 333 ILE CA C 55.2823 . 1 1522 333 333 ILE CB C 42.6847 . 1 1523 333 333 ILE N N 119.9447 . 1 1524 334 334 GLY H H 8.7225 . 1 1525 334 334 GLY C C 170.9620 . 1 1526 334 334 GLY CA C 45.6254 . 1 1527 334 334 GLY N N 113.2420 . 1 1528 335 335 VAL H H 8.2361 . 1 1529 335 335 VAL C C 173.6566 . 1 1530 335 335 VAL CA C 57.5204 . 1 1531 335 335 VAL CB C 35.9498 . 1 1532 335 335 VAL N N 114.0663 . 1 1533 336 336 ARG H H 8.6218 . 1 1534 336 336 ARG C C 174.7652 . 1 1535 336 336 ARG CA C 54.8848 . 1 1536 336 336 ARG N N 118.7204 . 1 1537 337 337 PHE H H 9.5226 . 1 1538 337 337 PHE C C 174.5193 . 1 1539 337 337 PHE CA C 56.3048 . 1 1540 337 337 PHE CB C 41.5480 . 1 1541 337 337 PHE N N 123.4975 . 1 1542 338 338 SER H H 8.3784 . 1 1543 338 338 SER C C 172.0793 . 1 1544 338 338 SER CA C 57.5870 . 1 1545 338 338 SER CB C 64.8836 . 1 1546 338 338 SER N N 113.9868 . 1 1547 339 339 LYS H H 8.0425 . 1 1548 339 339 LYS C C 175.3373 . 1 1549 339 339 LYS CA C 56.6190 . 1 1550 339 339 LYS CB C 29.3765 . 1 1551 339 339 LYS N N 114.8600 . 1 1552 340 340 PHE H H 7.5387 . 1 1553 340 340 PHE C C 177.7070 . 1 1554 340 340 PHE CA C 56.6345 . 1 1555 340 340 PHE CB C 38.5084 . 1 1556 340 340 PHE N N 118.5868 . 1 1557 341 341 ILE H H 9.0427 . 1 1558 341 341 ILE HG12 H 1.6737 . 2 1559 341 341 ILE HG13 H 1.1553 . 2 1560 341 341 ILE HG2 H 0.9792 . 1 1561 341 341 ILE C C 177.7070 . 1 1562 341 341 ILE CA C 61.3458 . 1 1563 341 341 ILE CB C 38.6783 . 1 1564 341 341 ILE N N 122.2273 . 1 1565 344 344 ILE CA C 55.1650 . 1 1566 351 351 ASP CA C 56.6000 . 1 1567 351 351 ASP CB C 40.3393 . 1 1568 352 352 THR CA C 65.3500 . 1 1569 352 352 THR CB C 67.5000 . 1 stop_ save_