data_27412 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; dASCIZ LC8 binding domain (residues 241-388) ; _BMRB_accession_number 27412 _BMRB_flat_file_name bmr27412.str _Entry_type original _Submission_date 2018-02-27 _Accession_date 2018-02-27 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details 'Intrinsically disordered dynein light chain 8 binding domain from Drosophila ASCIZ (ATM-Substrate Chk-Interacting Zn2+ finger)' loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Clark Sarah A. . 2 Barbar Elisar J. . 3 Fiala Radovan . . 4 Novacek Jiri . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 460 "13C chemical shifts" 362 "15N chemical shifts" 133 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2018-03-02 original BMRB . stop_ _Original_release_date 2018-02-27 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; Assigned Chemical Shifts for dASCIZ LC8 Binding Domain (241-388) ; _Citation_status submitted _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID ? loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Clark Sarah . . 2 Fiala Radovan . . 3 Novacek Jiri . . 4 Barbar Elisar . . stop_ _Journal_abbreviation 'Not known' _Journal_volume . _Journal_issue . _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first . _Page_last . _Year . _Details . loop_ _Keyword ASCIZ ATMIN 'Dynein light chain' 'Intrinsically Disordered Protein' LC8 stop_ save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'dASCIZ LC8 binding domain' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label dASCIZ $dASCIZ stop_ _System_molecular_weight 17117.5 _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . loop_ _Biological_function 'DNA damage repair' 'Transcription factor' stop_ _Database_query_date . _Details 'Binding domain of dASCIZ with 7 recognition motifs for dynein light chain 8 (LC8)' save_ ######################## # Monomeric polymers # ######################## save_dASCIZ _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common dASCIZ _Molecular_mass 17117.5 _Mol_thiol_state 'all free' loop_ _Biological_function 'DNA damage repair' 'Transcription factor' stop_ _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 148 _Mol_residue_sequence ; MDVSYALEMSSQKLDMETQT EEDDLNEIRNEVLAPLLRDI ETQTPDTRGDIGTMTDDFPE EQEPVAVGSHFHAYSETEPM FDLQTSAHMYTQTCDDLFEE LGLSHIQTQTHWPDGLYNTQ HTQTCDEIMDELFPDNFQST CTQTRWLD ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 241 MET 2 242 ASP 3 243 VAL 4 244 SER 5 245 TYR 6 246 ALA 7 247 LEU 8 248 GLU 9 249 MET 10 250 SER 11 251 SER 12 252 GLN 13 253 LYS 14 254 LEU 15 255 ASP 16 256 MET 17 257 GLU 18 258 THR 19 259 GLN 20 260 THR 21 261 GLU 22 262 GLU 23 263 ASP 24 264 ASP 25 265 LEU 26 266 ASN 27 267 GLU 28 268 ILE 29 269 ARG 30 270 ASN 31 271 GLU 32 272 VAL 33 273 LEU 34 274 ALA 35 275 PRO 36 276 LEU 37 277 LEU 38 278 ARG 39 279 ASP 40 280 ILE 41 281 GLU 42 282 THR 43 283 GLN 44 284 THR 45 285 PRO 46 286 ASP 47 287 THR 48 288 ARG 49 289 GLY 50 290 ASP 51 291 ILE 52 292 GLY 53 293 THR 54 294 MET 55 295 THR 56 296 ASP 57 297 ASP 58 298 PHE 59 299 PRO 60 300 GLU 61 301 GLU 62 302 GLN 63 303 GLU 64 304 PRO 65 305 VAL 66 306 ALA 67 307 VAL 68 308 GLY 69 309 SER 70 310 HIS 71 311 PHE 72 312 HIS 73 313 ALA 74 314 TYR 75 315 SER 76 316 GLU 77 317 THR 78 318 GLU 79 319 PRO 80 320 MET 81 321 PHE 82 322 ASP 83 323 LEU 84 324 GLN 85 325 THR 86 326 SER 87 327 ALA 88 328 HIS 89 329 MET 90 330 TYR 91 331 THR 92 332 GLN 93 333 THR 94 334 CYS 95 335 ASP 96 336 ASP 97 337 LEU 98 338 PHE 99 339 GLU 100 340 GLU 101 341 LEU 102 342 GLY 103 343 LEU 104 344 SER 105 345 HIS 106 346 ILE 107 347 GLN 108 348 THR 109 349 GLN 110 350 THR 111 351 HIS 112 352 TRP 113 353 PRO 114 354 ASP 115 355 GLY 116 356 LEU 117 357 TYR 118 358 ASN 119 359 THR 120 360 GLN 121 361 HIS 122 362 THR 123 363 GLN 124 364 THR 125 365 CYS 126 366 ASP 127 367 GLU 128 368 ILE 129 369 MET 130 370 ASP 131 371 GLU 132 372 LEU 133 373 PHE 134 374 PRO 135 375 ASP 136 376 ASN 137 377 PHE 138 378 GLN 139 379 SER 140 380 THR 141 381 CYS 142 382 THR 143 383 GLN 144 384 THR 145 385 ARG 146 386 TRP 147 387 LEU 148 388 ASP 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 $dASCIZ 'fruit fly' 7227 Eukaryota Metazoa Drosophila melanogaster 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 $dASCIZ 'recombinant technology' . Escherichia coli 'Rosetta DE3' pET2Zt2 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 $dASCIZ 0.3 mM '[U-100% 13C; U-100% 15N]' beta-mercaptoethanol 10 mM 'natural abundance' 'sodium phosphate' 10 mM 'natural abundance' 'sodium chloride' 10 mM 'natural abundance' DSS 0.01 mM 'natural abundance' 'sodium azide' 1 mM 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Saveframe_category software _Name TOPSPIN _Version . loop_ _Vendor _Address _Electronic_address 'Bruker Biospin' . . stop_ loop_ _Task collection processing 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 processing stop_ _Details . save_ save_SPARKY _Saveframe_category software _Name SPARKY _Version . loop_ _Vendor _Address _Electronic_address Goddard . . stop_ loop_ _Task 'chemical shift assignment' 'data analysis' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 850 _Details . save_ save_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _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_5D_HN(CA)CoNH_2 _Saveframe_category NMR_applied_experiment _Experiment_name '5D HN(CA)CoNH' _Sample_label $sample_1 save_ save_5D_HabCabCONH_3 _Saveframe_category NMR_applied_experiment _Experiment_name '5D HabCabCONH' _Sample_label $sample_1 save_ save_3D_HNCO_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $sample_1 save_ save_3D_HNCO_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _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' 20 . mM pH 6.5 . pH pressure 1 . atm temperature 283.15 . 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 DSS C 13 'methyl protons' ppm 0 internal indirect . . . 0.25 DSS H 1 'methyl protons' ppm 0 internal direct . . . 1.0 DSS N 15 'methyl protons' ppm 0 internal indirect . . . 0.10 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' '5D HN(CA)CoNH' '5D HabCabCONH' '3D HNCO' 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 dASCIZ _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 1 241 1 MET H H 8.612 . 1 2 241 1 MET HA H 4.489 . 1 3 241 1 MET HB2 H 2.097 . 1 4 241 1 MET HB3 H 1.99 . 1 5 241 1 MET C C 176.124 . 1 6 241 1 MET CA C 55.357 . 1 7 241 1 MET CB C 32.45 . 1 8 241 1 MET N N 118.163 . 1 9 242 2 ASP H H 8.193 . 1 10 242 2 ASP HA H 4.595 . 1 11 242 2 ASP HB2 H 2.675 . 1 12 242 2 ASP HB3 H 2.675 . 1 13 242 2 ASP C C 176.432 . 1 14 242 2 ASP CA C 54.702 . 1 15 242 2 ASP CB C 41.196 . 1 16 242 2 ASP N N 121.658 . 1 17 243 3 VAL H H 8.159 . 1 18 243 3 VAL HA H 4.084 . 1 19 243 3 VAL HB H 2.061 . 1 20 243 3 VAL C C 176.311 . 1 21 243 3 VAL CA C 62.657 . 1 22 243 3 VAL N N 120.511 . 1 23 244 4 SER H H 8.383 . 1 24 244 4 SER HA H 4.37 . 1 25 244 4 SER HB2 H 3.808 . 1 26 244 4 SER HB3 H 3.808 . 1 27 244 4 SER C C 174.595 . 1 28 244 4 SER CA C 58.772 . 1 29 244 4 SER CB C 63.667 . 1 30 244 4 SER N N 118.805 . 1 31 245 5 TYR H H 8.2 . 1 32 245 5 TYR C C 175.74 . 1 33 245 5 TYR N N 122.969 . 1 34 246 6 ALA H H 8.131 . 1 35 246 6 ALA HA H 4.216 . 1 36 246 6 ALA HB H 1.348 . 1 37 246 6 ALA C C 177.97 . 1 38 246 6 ALA CA C 52.892 . 1 39 246 6 ALA CB C 19.117 . 1 40 246 6 ALA N N 124.608 . 1 41 247 7 LEU H H 8.121 . 1 42 247 7 LEU HA H 4.257 . 1 43 247 7 LEU HB2 H 1.613 . 1 44 247 7 LEU HB3 H 1.613 . 1 45 247 7 LEU C C 177.947 . 1 46 247 7 LEU CA C 55.736 . 1 47 247 7 LEU CB C 42.301 . 1 48 247 7 LEU N N 121.142 . 1 49 248 8 GLU H H 8.391 . 1 50 248 8 GLU N N 121.643 . 1 51 249 9 MET H H 8.399 . 1 52 249 9 MET HA H 4.467 . 1 53 249 9 MET HB2 H 2.054 . 1 54 249 9 MET HB3 H 2.054 . 1 55 249 9 MET C C 176.868 . 1 56 249 9 MET CA C 55.816 . 1 57 249 9 MET CB C 32.732 . 1 58 249 9 MET N N 121.062 . 1 59 250 10 SER H H 8.362 . 1 60 250 10 SER HA H 4.436 . 1 61 250 10 SER HB2 H 3.915 . 1 62 250 10 SER HB3 H 3.915 . 1 63 250 10 SER C C 174.957 . 1 64 250 10 SER CA C 58.953 . 1 65 250 10 SER CB C 63.704 . 1 66 250 10 SER N N 116.765 . 1 67 251 11 SER H H 8.366 . 1 68 251 11 SER HA H 4.44 . 1 69 251 11 SER HB2 H 3.894 . 1 70 251 11 SER HB3 H 3.894 . 1 71 251 11 SER C C 174.575 . 1 72 251 11 SER CA C 58.821 . 1 73 251 11 SER CB C 63.735 . 1 74 251 11 SER N N 117.777 . 1 75 252 12 GLN H H 8.304 . 1 76 252 12 GLN HA H 4.299 . 1 77 252 12 GLN HB2 H 2.032 . 1 78 252 12 GLN CA C 56.099 . 1 79 252 12 GLN CB C 29.431 . 1 80 252 12 GLN N N 122.055 . 1 81 253 13 LYS H H 8.355 . 1 82 253 13 LYS HA H 4.291 . 1 83 253 13 LYS HB2 H 1.797 . 1 84 253 13 LYS HB3 H 1.797 . 1 85 253 13 LYS C C 176.491 . 1 86 253 13 LYS CA C 56.418 . 1 87 253 13 LYS CB C 32.959 . 1 88 253 13 LYS N N 123.066 . 1 89 254 14 LEU H H 8.10 . 1 90 254 14 LEU HA H 4.338 . 1 91 254 14 LEU HB2 H 1.609 . 1 92 254 14 LEU HB3 H 1.609 . 1 93 254 14 LEU C C 177.188 . 1 94 254 14 LEU CA C 55.211 . 1 95 254 14 LEU CB C 42.473 . 1 96 254 14 LEU N N 123.99 . 1 97 255 15 ASP H H 8.414 . 1 98 255 15 ASP HA H 4.569 . 1 99 255 15 ASP HB2 H 2.709 . 1 100 255 15 ASP HB3 H 2.598 . 1 101 255 15 ASP C C 176.26 . 1 102 255 15 ASP CA C 54.5 . 1 103 255 15 ASP CB C 40.947 . 1 104 255 15 ASP N N 121.145 . 1 105 256 16 MET H H 8.328 . 1 106 256 16 MET HA H 4.462 . 1 107 256 16 MET HB2 H 2.113 . 1 108 256 16 MET HB3 H 1.998 . 1 109 256 16 MET C C 176.509 . 1 110 256 16 MET CA C 55.612 . 1 111 256 16 MET CB C 32.937 . 1 112 256 16 MET N N 120.44 . 1 113 257 17 GLU H H 8.535 . 1 114 257 17 GLU HA H 4.313 . 1 115 257 17 GLU HB2 H 2.066 . 1 116 257 17 GLU HB3 H 1.993 . 1 117 257 17 GLU C C 176.807 . 1 118 257 17 GLU CA C 56.902 . 1 119 257 17 GLU CB C 30.254 . 1 120 257 17 GLU N N 121.88 . 1 121 258 18 THR H H 8.247 . 1 122 258 18 THR HA H 4.299 . 1 123 258 18 THR HB H 4.168 . 1 124 258 18 THR C C 174.425 . 1 125 258 18 THR CA C 62.138 . 1 126 258 18 THR CB C 69.888 . 1 127 258 18 THR N N 115.734 . 1 128 259 19 GLN H H 8.559 . 1 129 259 19 GLN HA H 4.45 . 1 130 259 19 GLN HB2 H 2.133 . 1 131 259 19 GLN HB3 H 2.011 . 1 132 259 19 GLN C C 176.009 . 1 133 259 19 GLN CA C 55.765 . 1 134 259 19 GLN CB C 29.632 . 1 135 259 19 GLN N N 123.787 . 1 136 260 20 THR H H 8.437 . 1 137 260 20 THR HA H 4.348 . 1 138 260 20 THR HB H 4.211 . 1 139 260 20 THR C C 174.56 . 1 140 260 20 THR CA C 61.944 . 1 141 260 20 THR CB C 70.1 . 1 142 260 20 THR N N 116.733 . 1 143 261 21 GLU H H 8.631 . 1 144 261 21 GLU HA H 4.321 . 1 145 261 21 GLU HB2 H 2.067 . 1 146 261 21 GLU HB3 H 1.933 . 1 147 261 21 GLU C C 176.624 . 1 148 261 21 GLU CA C 56.635 . 1 149 261 21 GLU CB C 30.385 . 1 150 261 21 GLU N N 123.542 . 1 151 262 22 GLU H H 8.545 . 1 152 262 22 GLU HA H 4.242 . 1 153 262 22 GLU HB2 H 2.037 . 1 154 262 22 GLU HB3 H 1.91 . 1 155 262 22 GLU C C 176.445 . 1 156 262 22 GLU CA C 56.742 . 1 157 262 22 GLU CB C 30.428 . 1 158 262 22 GLU N N 122.124 . 1 159 263 23 ASP H H 8.441 . 1 160 263 23 ASP HA H 4.546 . 1 161 263 23 ASP HB2 H 2.629 . 1 162 263 23 ASP HB3 H 2.629 . 1 163 263 23 ASP C C 176.206 . 1 164 263 23 ASP CA C 54.792 . 1 165 263 23 ASP CB C 41.306 . 1 166 263 23 ASP N N 121.738 . 1 167 264 24 ASP H H 8.406 . 1 168 264 24 ASP HA H 4.552 . 1 169 264 24 ASP HB2 H 2.66 . 1 170 264 24 ASP HB3 H 2.66 . 1 171 264 24 ASP C C 176.814 . 1 172 264 24 ASP CA C 54.597 . 1 173 264 24 ASP CB C 40.975 . 1 174 264 24 ASP N N 121.066 . 1 175 265 25 LEU H H 8.318 . 1 176 265 25 LEU HA H 4.256 . 1 177 265 25 LEU HB2 H 1.692 . 1 178 265 25 LEU HB3 H 1.58 . 1 179 265 25 LEU C C 177.738 . 1 180 265 25 LEU CA C 55.787 . 1 181 265 25 LEU CB C 41.893 . 1 182 265 25 LEU N N 122.599 . 1 183 266 26 ASN H H 8.401 . 1 184 266 26 ASN HA H 4.612 . 1 185 266 26 ASN HB2 H 2.784 . 1 186 266 26 ASN HB3 H 2.784 . 1 187 266 26 ASN C C 175.307 . 1 188 266 26 ASN CA C 53.866 . 1 189 266 26 ASN CB C 39.022 . 1 190 266 26 ASN N N 118.563 . 1 191 267 27 GLU H H 8.215 . 1 192 267 27 GLU HA H 4.225 . 1 193 267 27 GLU HB2 H 2.008 . 1 194 267 27 GLU HB3 H 1.951 . 1 195 267 27 GLU C C 176.509 . 1 196 267 27 GLU CA C 56.821 . 1 197 267 27 GLU CB C 30.361 . 1 198 267 27 GLU N N 120.987 . 1 199 268 28 ILE H H 8.25 . 1 200 268 28 ILE C C 176.483 . 1 201 268 28 ILE N N 122.733 . 1 202 269 29 ARG H H 8.484 . 1 203 269 29 ARG HA H 4.351 . 1 204 269 29 ARG HB2 H 1.796 . 1 205 269 29 ARG HB3 H 1.796 . 1 206 269 29 ARG C C 175.983 . 1 207 269 29 ARG CA C 56.04 . 1 208 269 29 ARG CB C 30.933 . 1 209 269 29 ARG N N 125.744 . 1 210 270 30 ASN H H 8.523 . 1 211 270 30 ASN HA H 4.676 . 1 212 270 30 ASN HB2 H 2.789 . 1 213 270 30 ASN HB3 H 2.718 . 1 214 270 30 ASN C C 175.124 . 1 215 270 30 ASN CA C 53.4 . 1 216 270 30 ASN CB C 39.056 . 1 217 270 30 ASN N N 120.53 . 1 218 271 31 GLU H H 8.488 . 1 219 271 31 GLU HA H 4.264 . 1 220 271 31 GLU HB2 H 2.009 . 1 221 271 31 GLU HB3 H 1.919 . 1 222 271 31 GLU C C 176.274 . 1 223 271 31 GLU CA C 56.687 . 1 224 271 31 GLU CB C 30.41 . 1 225 271 31 GLU N N 121.932 . 1 226 272 32 VAL H H 8.29 . 1 227 272 32 VAL C C 176.106 . 1 228 272 32 VAL N N 122.371 . 1 229 273 33 LEU C C 176.624 . 1 230 275 35 PRO HA H 4.36 . 1 231 275 35 PRO HB2 H 2.268 . 1 232 275 35 PRO HB3 H 1.844 . 1 233 275 35 PRO C C 176.829 . 1 234 275 35 PRO CA C 63.072 . 1 235 275 35 PRO CB C 32.128 . 1 236 276 36 LEU H H 8.386 . 1 237 276 36 LEU HA H 4.284 . 1 238 276 36 LEU HB2 H 1.581 . 1 239 276 36 LEU HB3 H 1.581 . 1 240 276 36 LEU C C 177.445 . 1 241 276 36 LEU CA C 55.216 . 1 242 276 36 LEU CB C 42.237 . 1 243 276 36 LEU N N 122.273 . 1 244 277 37 LEU H H 8.312 . 1 245 277 37 LEU HA H 4.351 . 1 246 277 37 LEU HB2 H 1.636 . 1 247 277 37 LEU HB3 H 1.57 . 1 248 277 37 LEU C C 177.15 . 1 249 277 37 LEU CA C 55.118 . 1 250 277 37 LEU CB C 42.179 . 1 251 277 37 LEU N N 123.753 . 1 252 278 38 ARG H H 7.307 . 1 253 278 38 ARG HB2 H 1.798 . 1 254 278 38 ARG HB3 H 1.74 . 1 255 278 38 ARG C C 175.906 . 1 256 278 38 ARG CB C 31.227 . 1 257 278 38 ARG N N 121.8 . 1 258 279 39 ASP H H 8.424 . 1 259 279 39 ASP N N 121.776 . 1 260 282 42 THR H H 8.245 . 1 261 282 42 THR HA H 4.296 . 1 262 282 42 THR HB H 4.183 . 1 263 282 42 THR C C 174.457 . 1 264 282 42 THR CA C 62.097 . 1 265 282 42 THR CB C 69.818 . 1 266 282 42 THR N N 115.844 . 1 267 283 43 GLN H H 8.489 . 1 268 283 43 GLN HA H 4.409 . 1 269 283 43 GLN HB2 H 2.092 . 1 270 283 43 GLN HB3 H 1.97 . 1 271 283 43 GLN C C 175.839 . 1 272 283 43 GLN CA C 55.59 . 1 273 283 43 GLN CB C 29.648 . 1 274 283 43 GLN N N 123.405 . 1 275 284 44 THR H H 8.457 . 1 276 284 44 THR N N 118.889 . 1 277 285 45 PRO HA H 4.396 . 1 278 285 45 PRO HB2 H 2.293 . 1 279 285 45 PRO HB3 H 1.896 . 1 280 285 45 PRO C C 176.586 . 1 281 285 45 PRO CA C 63.437 . 1 282 285 45 PRO CB C 32.233 . 1 283 286 46 ASP H H 8.573 . 1 284 286 46 ASP HA H 4.625 . 1 285 286 46 ASP HB2 H 2.747 . 1 286 286 46 ASP HB3 H 2.636 . 1 287 286 46 ASP C C 176.881 . 1 288 286 46 ASP CA C 54.368 . 1 289 286 46 ASP CB C 41.152 . 1 290 286 46 ASP N N 120.911 . 1 291 287 47 THR H H 8.246 . 1 292 287 47 THR HA H 4.334 . 1 293 287 47 THR HB H 4.326 . 1 294 287 47 THR C C 175.034 . 1 295 287 47 THR CA C 61.866 . 1 296 287 47 THR CB C 69.573 . 1 297 287 47 THR N N 115.204 . 1 298 288 48 ARG H H 8.399 . 1 299 288 48 ARG HA H 4.279 . 1 300 288 48 ARG HB2 H 1.861 . 1 301 288 48 ARG HB3 H 1.861 . 1 302 288 48 ARG C C 177.052 . 1 303 288 48 ARG CA C 56.841 . 1 304 288 48 ARG CB C 30.721 . 1 305 288 48 ARG N N 123.243 . 1 306 289 49 GLY H H 8.442 . 1 307 289 49 GLY HA2 H 3.889 . 1 308 289 49 GLY HA3 H 3.889 . 1 309 289 49 GLY C C 173.793 . 1 310 289 49 GLY CA C 45.245 . 1 311 289 49 GLY N N 109.291 . 1 312 290 50 ASP H H 8.327 . 1 313 290 50 ASP HA H 4.624 . 1 314 290 50 ASP HB2 H 2.63 . 1 315 290 50 ASP HB3 H 2.63 . 1 316 290 50 ASP C C 176.586 . 1 317 290 50 ASP CA C 54.209 . 1 318 290 50 ASP CB C 41.138 . 1 319 290 50 ASP N N 120.555 . 1 320 291 51 ILE H H 8.192 . 1 321 291 51 ILE HA H 4.173 . 1 322 291 51 ILE HB H 1.925 . 1 323 291 51 ILE C C 176.996 . 1 324 291 51 ILE CA C 61.683 . 1 325 291 51 ILE CB C 38.662 . 1 326 291 51 ILE N N 120.966 . 1 327 292 52 GLY H H 8.575 . 1 328 292 52 GLY HA2 H 3.984 . 1 329 292 52 GLY HA3 H 3.984 . 1 330 292 52 GLY C C 174.316 . 1 331 292 52 GLY CA C 45.416 . 1 332 292 52 GLY N N 112.481 . 1 333 293 53 THR H H 8.106 . 1 334 293 53 THR HA H 4.334 . 1 335 293 53 THR HB H 4.211 . 1 336 293 53 THR C C 174.714 . 1 337 293 53 THR CA C 61.951 . 1 338 293 53 THR CB C 69.944 . 1 339 293 53 THR N N 113.829 . 1 340 294 54 MET H H 8.544 . 1 341 294 54 MET HA H 4.576 . 1 342 294 54 MET HB2 H 2.102 . 1 343 294 54 MET HB3 H 2.054 . 1 344 294 54 MET C C 176.342 . 1 345 294 54 MET CA C 55.603 . 1 346 294 54 MET CB C 32.864 . 1 347 294 54 MET N N 123.406 . 1 348 295 55 THR H H 8.265 . 1 349 295 55 THR HA H 4.333 . 1 350 295 55 THR HB H 4.212 . 1 351 295 55 THR C C 174.175 . 1 352 295 55 THR CA C 61.724 . 1 353 295 55 THR CB C 69.96 . 1 354 295 55 THR N N 115.438 . 1 355 296 56 ASP H H 8.362 . 1 356 296 56 ASP HA H 4.549 . 1 357 296 56 ASP HB2 H 2.54 . 1 358 296 56 ASP HB3 H 2.54 . 1 359 296 56 ASP C C 175.517 . 1 360 296 56 ASP CA C 54.376 . 1 361 296 56 ASP CB C 41.274 . 1 362 296 56 ASP N N 122.695 . 1 363 297 57 ASP H H 8.202 . 1 364 297 57 ASP HA H 4.487 . 1 365 297 57 ASP HB2 H 2.463 . 1 366 297 57 ASP HB3 H 2.463 . 1 367 297 57 ASP C C 175.419 . 1 368 297 57 ASP CA C 54.259 . 1 369 297 57 ASP CB C 41.319 . 1 370 297 57 ASP N N 120.486 . 1 371 298 58 PHE H H 8.253 . 1 372 298 58 PHE N N 121.388 . 1 373 299 59 PRO HA H 4.427 . 1 374 299 59 PRO HB2 H 2.25 . 1 375 299 59 PRO HB3 H 1.901 . 1 376 299 59 PRO C C 176.943 . 1 377 299 59 PRO CA C 63.149 . 1 378 299 59 PRO CB C 32.092 . 1 379 300 60 GLU H H 8.599 . 1 380 300 60 GLU HA H 4.244 . 1 381 300 60 GLU HB2 H 2.03 . 1 382 300 60 GLU HB3 H 1.939 . 1 383 300 60 GLU C C 176.714 . 1 384 300 60 GLU CA C 56.642 . 1 385 300 60 GLU CB C 30.453 . 1 386 300 60 GLU N N 121.576 . 1 387 301 61 GLU H H 8.58 . 1 388 301 61 GLU HA H 4.262 . 1 389 301 61 GLU HB2 H 2.023 . 1 390 301 61 GLU HB3 H 1.931 . 1 391 301 61 GLU C C 176.317 . 1 392 301 61 GLU CA C 56.492 . 1 393 301 61 GLU CB C 30.393 . 1 394 301 61 GLU N N 122.618 . 1 395 302 62 GLN H H 8.506 . 1 396 302 62 GLN HA H 4.328 . 1 397 302 62 GLN HB2 H 2.076 . 1 398 302 62 GLN HB3 H 1.928 . 1 399 302 62 GLN C C 175.778 . 1 400 302 62 GLN CA C 55.413 . 1 401 302 62 GLN CB C 29.963 . 1 402 302 62 GLN N N 122.047 . 1 403 303 63 GLU H H 8.583 . 1 404 303 63 GLU N N 124.211 . 1 405 304 64 PRO HA H 4.424 . 1 406 304 64 PRO HB2 H 2.255 . 1 407 304 64 PRO HB3 H 1.858 . 1 408 304 64 PRO C C 176.886 . 1 409 304 64 PRO CA C 63.062 . 1 410 304 64 PRO CB C 32.089 . 1 411 305 65 VAL H H 8.303 . 1 412 305 65 VAL C C 176.044 . 1 413 305 65 VAL N N 121.085 . 1 414 306 66 ALA H H 8.493 . 1 415 306 66 ALA HA H 4.324 . 1 416 306 66 ALA HB H 1.337 . 1 417 306 66 ALA C C 177.78 . 1 418 306 66 ALA CA C 52.346 . 1 419 306 66 ALA CB C 19.252 . 1 420 306 66 ALA N N 128.635 . 1 421 307 67 VAL H H 8.296 . 1 422 307 67 VAL N N 120.607 . 1 423 308 68 GLY H H 8.579 . 1 424 308 68 GLY HA2 H 3.954 . 1 425 308 68 GLY HA3 H 3.954 . 1 426 308 68 GLY C C 174.209 . 1 427 308 68 GLY CA C 45.24 . 1 428 308 68 GLY N N 112.65 . 1 429 309 69 SER H H 8.242 . 1 430 309 69 SER HA H 4.35 . 1 431 309 69 SER HB2 H 3.765 . 1 432 309 69 SER HB3 H 3.765 . 1 433 309 69 SER C C 174.419 . 1 434 309 69 SER CA C 58.529 . 1 435 309 69 SER CB C 63.888 . 1 436 309 69 SER N N 115.561 . 1 437 310 70 HIS H H 8.474 . 1 438 310 70 HIS HA H 4.613 . 1 439 310 70 HIS HB2 H 3.09 . 1 440 310 70 HIS HB3 H 2.999 . 1 441 310 70 HIS C C 174.381 . 1 442 310 70 HIS CA C 55.721 . 1 443 310 70 HIS CB C 29.84 . 1 444 310 70 HIS N N 120.678 . 1 445 311 71 PHE H H 8.224 . 1 446 311 71 PHE HA H 4.499 . 1 447 311 71 PHE HB2 H 2.959 . 1 448 311 71 PHE HB3 H 2.959 . 1 449 311 71 PHE C C 175.214 . 1 450 311 71 PHE CA C 57.98 . 1 451 311 71 PHE CB C 39.685 . 1 452 311 71 PHE N N 121.588 . 1 453 312 72 HIS H H 8.296 . 1 454 312 72 HIS N N 122.034 . 1 455 313 73 ALA H H 8.273 . 1 456 313 73 ALA HA H 4.192 . 1 457 313 73 ALA HB H 1.29 . 1 458 313 73 ALA C C 177.188 . 1 459 313 73 ALA CA C 52.374 . 1 460 313 73 ALA CB C 19.29 . 1 461 313 73 ALA N N 125.909 . 1 462 314 74 TYR H H 8.291 . 1 463 314 74 TYR HA H 4.517 . 1 464 314 74 TYR HB2 H 2.982 . 1 465 314 74 TYR HB3 H 2.982 . 1 466 314 74 TYR C C 175.791 . 1 467 314 74 TYR CA C 58.163 . 1 468 314 74 TYR CB C 38.856 . 1 469 314 74 TYR N N 120.25 . 1 470 315 75 SER H H 8.18 . 1 471 315 75 SER HA H 4.396 . 1 472 315 75 SER HB2 H 3.764 . 1 473 315 75 SER HB3 H 3.764 . 1 474 315 75 SER C C 174.227 . 1 475 315 75 SER CA C 57.859 . 1 476 315 75 SER CB C 64.108 . 1 477 315 75 SER N N 116.825 . 1 478 316 76 GLU H H 8.561 . 1 479 316 76 GLU HA H 4.251 . 1 480 316 76 GLU HB2 H 2.074 . 1 481 316 76 GLU HB3 H 1.944 . 1 482 316 76 GLU C C 176.663 . 1 483 316 76 GLU CA C 56.978 . 1 484 316 76 GLU CB C 30.248 . 1 485 316 76 GLU N N 123.091 . 1 486 317 77 THR C C 174.381 . 1 487 319 79 PRO HA H 4.335 . 1 488 319 79 PRO HB2 H 2.19 . 1 489 319 79 PRO HB3 H 1.747 . 1 490 319 79 PRO C C 176.766 . 1 491 319 79 PRO CA C 63.283 . 1 492 319 79 PRO CB C 32.12 . 1 493 319 79 PRO N N 120.14 . 1 494 320 80 MET H H 8.424 . 1 495 320 80 MET HA H 4.354 . 1 496 320 80 MET HB2 H 1.9 . 1 497 320 80 MET HB3 H 1.9 . 1 498 320 80 MET C C 175.969 . 1 499 320 80 MET CA C 55.449 . 1 500 320 80 MET CB C 32.965 . 1 501 320 80 MET N N 120.146 . 1 502 321 81 PHE H H 8.206 . 1 503 321 81 PHE HA H 4.576 . 1 504 321 81 PHE HB2 H 3.104 . 1 505 321 81 PHE HB3 H 2.97 . 1 506 321 81 PHE C C 175.252 . 1 507 321 81 PHE CA C 57.789 . 1 508 321 81 PHE CB C 39.934 . 1 509 321 81 PHE N N 121.286 . 1 510 322 82 ASP H H 8.367 . 1 511 322 82 ASP HA H 4.548 . 1 512 322 82 ASP HB2 H 2.691 . 1 513 322 82 ASP HB3 H 2.559 . 1 514 322 82 ASP C C 176.12 . 1 515 322 82 ASP CA C 54.087 . 1 516 322 82 ASP CB C 41.288 . 1 517 322 82 ASP N N 122.125 . 1 518 323 83 LEU H H 8.271 . 1 519 323 83 LEU HA H 4.228 . 1 520 323 83 LEU HB2 H 1.625 . 1 521 323 83 LEU HB3 H 1.625 . 1 522 323 83 LEU C C 177.932 . 1 523 323 83 LEU CA C 55.949 . 1 524 323 83 LEU CB C 42.242 . 1 525 323 83 LEU N N 123.237 . 1 526 324 84 GLN H H 8.484 . 1 527 324 84 GLN HA H 4.308 . 1 528 324 84 GLN HB2 H 2.118 . 1 529 324 84 GLN HB3 H 2.044 . 1 530 324 84 GLN C C 176.763 . 1 531 324 84 GLN CA C 56.485 . 1 532 324 84 GLN CB C 29.119 . 1 533 324 84 GLN N N 120.001 . 1 534 325 85 THR H H 8.123 . 1 535 325 85 THR HA H 4.298 . 1 536 325 85 THR HB H 4.25 . 1 537 325 85 THR C C 175.009 . 1 538 325 85 THR CA C 62.458 . 1 539 325 85 THR CB C 69.708 . 1 540 325 85 THR N N 114.362 . 1 541 326 86 SER H H 8.274 . 1 542 326 86 SER C C 174.494 . 1 543 326 86 SER N N 117.651 . 1 544 327 87 ALA H H 8.256 . 1 545 327 87 ALA HA H 4.218 . 1 546 327 87 ALA HB H 1.316 . 1 547 327 87 ALA C C 177.726 . 1 548 327 87 ALA CA C 53.031 . 1 549 327 87 ALA CB C 19.096 . 1 550 327 87 ALA N N 125.224 . 1 551 328 88 HIS H H 8.264 . 1 552 328 88 HIS HA H 4.558 . 1 553 328 88 HIS HB2 H 3.062 . 1 554 328 88 HIS HB3 H 3.062 . 1 555 328 88 HIS C C 174.829 . 1 556 328 88 HIS CA C 55.878 . 1 557 328 88 HIS CB C 29.652 . 1 558 328 88 HIS N N 117.424 . 1 559 329 89 MET H H 8.184 . 1 560 329 89 MET HA H 4.37 . 1 561 329 89 MET HB2 H 1.876 . 1 562 329 89 MET HB3 H 1.876 . 1 563 329 89 MET C C 175.791 . 1 564 329 89 MET CA C 55.671 . 1 565 329 89 MET CB C 32.852 . 1 566 329 89 MET N N 121.246 . 1 567 330 90 TYR H H 8.286 . 1 568 330 90 TYR HA H 4.638 . 1 569 330 90 TYR HB2 H 3.063 . 1 570 330 90 TYR HB3 H 2.933 . 1 571 330 90 TYR C C 175.855 . 1 572 330 90 TYR CA C 57.942 . 1 573 330 90 TYR CB C 38.846 . 1 574 330 90 TYR N N 121.312 . 1 575 331 91 THR H H 8.095 . 1 576 331 91 THR HA H 4.278 . 1 577 331 91 THR HB H 4.124 . 1 578 331 91 THR C C 173.985 . 1 579 331 91 THR CA C 61.812 . 1 580 331 91 THR CB C 70.021 . 1 581 331 91 THR N N 116.586 . 1 582 332 92 GLN H H 8.463 . 1 583 332 92 GLN HA H 4.395 . 1 584 332 92 GLN HB2 H 2.11 . 1 585 332 92 GLN HB3 H 1.992 . 1 586 332 92 GLN C C 176.093 . 1 587 332 92 GLN CA C 55.987 . 1 588 332 92 GLN CB C 29.746 . 1 589 332 92 GLN N N 123.285 . 1 590 333 93 THR H H 8.432 . 1 591 333 93 THR HA H 4.366 . 1 592 333 93 THR HB H 4.249 . 1 593 333 93 THR C C 174.573 . 1 594 333 93 THR CA C 61.912 . 1 595 333 93 THR CB C 70.072 . 1 596 333 93 THR N N 116.078 . 1 597 334 94 CYS H H 8.518 . 1 598 334 94 CYS HA H 4.507 . 1 599 334 94 CYS HB2 H 2.916 . 1 600 334 94 CYS HB3 H 2.916 . 1 601 334 94 CYS C C 174.381 . 1 602 334 94 CYS CA C 58.615 . 1 603 334 94 CYS CB C 28.172 . 1 604 334 94 CYS N N 121.104 . 1 605 335 95 ASP H H 8.45 . 1 606 335 95 ASP HA H 4.58 . 1 607 335 95 ASP HB2 H 2.7 . 1 608 335 95 ASP HB3 H 2.574 . 1 609 335 95 ASP C C 176.046 . 1 610 335 95 ASP CA C 54.975 . 1 611 335 95 ASP CB C 41.184 . 1 612 335 95 ASP N N 123.185 . 1 613 336 96 ASP H H 8.232 . 1 614 336 96 ASP HA H 4.507 . 1 615 336 96 ASP HB2 H 2.591 . 1 616 336 96 ASP HB3 H 2.591 . 1 617 336 96 ASP C C 176.248 . 1 618 336 96 ASP CA C 54.896 . 1 619 336 96 ASP CB C 41.017 . 1 620 336 96 ASP N N 120.513 . 1 621 337 97 LEU H H 8.145 . 1 622 337 97 LEU HA H 4.251 . 1 623 337 97 LEU HB2 H 1.549 . 1 624 337 97 LEU HB3 H 1.451 . 1 625 337 97 LEU C C 177.291 . 1 626 337 97 LEU CA C 55.435 . 1 627 337 97 LEU CB C 42.154 . 1 628 337 97 LEU N N 121.979 . 1 629 338 98 PHE H H 8.23 . 1 630 338 98 PHE HA H 4.503 . 1 631 338 98 PHE HB2 H 3.079 . 1 632 338 98 PHE HB3 H 3.079 . 1 633 338 98 PHE C C 176.111 . 1 634 338 98 PHE CA C 58.387 . 1 635 338 98 PHE CB C 39.313 . 1 636 338 98 PHE N N 120.694 . 1 637 339 99 GLU H H 8.248 . 1 638 339 99 GLU HA H 4.178 . 1 639 339 99 GLU HB2 H 1.926 . 1 640 339 99 GLU HB3 H 1.926 . 1 641 339 99 GLU C C 176.509 . 1 642 339 99 GLU CA C 56.864 . 1 643 339 99 GLU CB C 30.532 . 1 644 339 99 GLU N N 122.433 . 1 645 340 100 GLU H H 8.459 . 1 646 340 100 GLU HA H 4.173 . 1 647 340 100 GLU HB2 H 2.006 . 1 648 340 100 GLU HB3 H 2.006 . 1 649 340 100 GLU C C 176.962 . 1 650 340 100 GLU CA C 57.106 . 1 651 340 100 GLU CB C 30.046 . 1 652 340 100 GLU N N 122.194 . 1 653 341 101 LEU H H 8.351 . 1 654 341 101 LEU HA H 4.283 . 1 655 341 101 LEU HB2 H 1.685 . 1 656 341 101 LEU HB3 H 1.552 . 1 657 341 101 LEU C C 178.265 . 1 658 341 101 LEU CA C 55.599 . 1 659 341 101 LEU CB C 42.284 . 1 660 341 101 LEU N N 122.575 . 1 661 342 102 GLY H H 8.41 . 1 662 342 102 GLY HA2 H 3.907 . 1 663 342 102 GLY HA3 H 3.907 . 1 664 342 102 GLY C C 174.573 . 1 665 342 102 GLY CA C 45.721 . 1 666 342 102 GLY N N 109.061 . 1 667 343 103 LEU H H 8.051 . 1 668 343 103 LEU HA H 4.323 . 1 669 343 103 LEU HB2 H 1.574 . 1 670 343 103 LEU HB3 H 1.574 . 1 671 343 103 LEU C C 177.74 . 1 672 343 103 LEU CA C 55.326 . 1 673 343 103 LEU CB C 42.4 . 1 674 343 103 LEU N N 120.98 . 1 675 344 104 SER H H 8.321 . 1 676 344 104 SER HA H 4.371 . 1 677 344 104 SER HB2 H 3.828 . 1 678 344 104 SER HB3 H 3.828 . 1 679 344 104 SER C C 174.56 . 1 680 344 104 SER CA C 58.75 . 1 681 344 104 SER CB C 63.705 . 1 682 344 104 SER N N 115.66 . 1 683 345 105 HIS H H 8.433 . 1 684 345 105 HIS HA H 4.655 . 1 685 345 105 HIS HB2 H 3.19 . 1 686 345 105 HIS HB3 H 3.09 . 1 687 345 105 HIS C C 174.881 . 1 688 345 105 HIS CA C 56.054 . 1 689 345 105 HIS CB C 29.66 . 1 690 345 105 HIS N N 120.784 . 1 691 346 106 ILE H H 8.079 . 1 692 346 106 ILE C C 176.522 . 1 693 346 106 ILE N N 121.976 . 1 694 347 107 GLN H H 8.568 . 1 695 347 107 GLN HA H 4.375 . 1 696 347 107 GLN HB2 H 2.091 . 1 697 347 107 GLN HB3 H 1.991 . 1 698 347 107 GLN C C 176.213 . 1 699 347 107 GLN CA C 56.037 . 1 700 347 107 GLN CB C 29.453 . 1 701 347 107 GLN N N 124.712 . 1 702 348 108 THR H H 8.291 . 1 703 348 108 THR HA H 4.281 . 1 704 348 108 THR HB H 4.188 . 1 705 348 108 THR C C 174.47 . 1 706 348 108 THR CA C 62.207 . 1 707 348 108 THR CB C 69.841 . 1 708 348 108 THR N N 116.217 . 1 709 349 109 GLN H H 8.434 . 1 710 349 109 GLN HA H 4.333 . 1 711 349 109 GLN HB2 H 1.993 . 1 712 349 109 GLN HB3 H 1.888 . 1 713 349 109 GLN CA C 55.909 . 1 714 349 109 GLN CB C 29.532 . 1 715 349 109 GLN N N 122.828 . 1 716 350 110 THR H H 8.242 . 1 717 350 110 THR HA H 4.165 . 1 718 350 110 THR HB H 3.959 . 1 719 350 110 THR C C 173.842 . 1 720 350 110 THR CA C 61.861 . 1 721 350 110 THR CB C 69.852 . 1 722 350 110 THR N N 115.734 . 1 723 351 111 HIS C C 173.906 . 1 724 354 114 ASP H H 8.43 . 1 725 354 114 ASP HA H 4.569 . 1 726 354 114 ASP HB2 H 2.692 . 1 727 354 114 ASP HB3 H 2.692 . 1 728 354 114 ASP C C 176.957 . 1 729 354 114 ASP CA C 54.816 . 1 730 354 114 ASP CB C 41.189 . 1 731 354 114 ASP N N 120.174 . 1 732 355 115 GLY H H 8.376 . 1 733 355 115 GLY HA2 H 3.874 . 1 734 355 115 GLY HA3 H 3.874 . 1 735 355 115 GLY C C 174.201 . 1 736 355 115 GLY CA C 45.653 . 1 737 355 115 GLY N N 109.052 . 1 738 356 116 LEU H H 8.021 . 1 739 356 116 LEU HA H 4.226 . 1 740 356 116 LEU HB2 H 1.472 . 1 741 356 116 LEU HB3 H 1.349 . 1 742 356 116 LEU C C 177.121 . 1 743 356 116 LEU CA C 55.442 . 1 744 356 116 LEU CB C 42.337 . 1 745 356 116 LEU N N 121.466 . 1 746 357 117 TYR H H 8.185 . 1 747 357 117 TYR HA H 4.442 . 1 748 357 117 TYR HB2 H 2.994 . 1 749 357 117 TYR HB3 H 2.82 . 1 750 357 117 TYR C C 175.637 . 1 751 357 117 TYR CA C 57.907 . 1 752 357 117 TYR CB C 38.685 . 1 753 357 117 TYR N N 119.891 . 1 754 358 118 ASN H H 8.244 . 1 755 358 118 ASN HA H 4.651 . 1 756 358 118 ASN HB2 H 2.758 . 1 757 358 118 ASN HB3 H 2.634 . 1 758 358 118 ASN C C 175.457 . 1 759 358 118 ASN CA C 53.293 . 1 760 358 118 ASN CB C 38.776 . 1 761 358 118 ASN N N 120.185 . 1 762 359 119 THR H H 8.112 . 1 763 359 119 THR HA H 4.235 . 1 764 359 119 THR HB H 4.215 . 1 765 359 119 THR C C 174.715 . 1 766 359 119 THR CA C 62.345 . 1 767 359 119 THR CB C 69.604 . 1 768 359 119 THR N N 114.217 . 1 769 360 120 GLN H H 8.349 . 1 770 360 120 GLN C C 175.752 . 1 771 360 120 GLN N N 121.863 . 1 772 361 121 HIS H H 8.44 . 1 773 361 121 HIS HB2 H 3.167 . 1 774 361 121 HIS HB3 H 3.054 . 1 775 361 121 HIS C C 174.842 . 1 776 361 121 HIS CB C 29.785 . 1 777 361 121 HIS N N 120.238 . 1 778 362 122 THR H H 8.253 . 1 779 362 122 THR HA H 4.293 . 1 780 362 122 THR HB H 4.156 . 1 781 362 122 THR C C 174.316 . 1 782 362 122 THR CA C 62.076 . 1 783 362 122 THR CB C 69.818 . 1 784 362 122 THR N N 116.476 . 1 785 363 123 GLN H H 8.615 . 1 786 363 123 GLN HA H 4.431 . 1 787 363 123 GLN HB2 H 2.109 . 1 788 363 123 GLN HB3 H 1.984 . 1 789 363 123 GLN C C 176.188 . 1 790 363 123 GLN CA C 55.951 . 1 791 363 123 GLN CB C 29.83 . 1 792 363 123 GLN N N 123.351 . 1 793 364 124 THR H H 8.444 . 1 794 364 124 THR N N 116.216 . 1 795 365 125 CYS H H 8.537 . 1 796 365 125 CYS HA H 4.515 . 1 797 365 125 CYS HB2 H 2.931 . 1 798 365 125 CYS HB3 H 2.931 . 1 799 365 125 CYS C C 174.331 . 1 800 365 125 CYS CA C 58.652 . 1 801 365 125 CYS CB C 28.153 . 1 802 365 125 CYS N N 120.981 . 1 803 366 126 ASP H H 8.453 . 1 804 366 126 ASP HA H 4.577 . 1 805 366 126 ASP HB2 H 2.701 . 1 806 366 126 ASP HB3 H 2.573 . 1 807 366 126 ASP C C 176.073 . 1 808 366 126 ASP CA C 54.94 . 1 809 366 126 ASP CB C 41.181 . 1 810 366 126 ASP N N 122.802 . 1 811 367 127 GLU H H 8.251 . 1 812 367 127 GLU HA H 4.234 . 1 813 367 127 GLU HB2 H 1.965 . 1 814 367 127 GLU HB3 H 1.965 . 1 815 367 127 GLU C C 176.336 . 1 816 367 127 GLU CA C 56.77 . 1 817 367 127 GLU CB C 30.415 . 1 818 367 127 GLU N N 120.963 . 1 819 368 128 ILE H H 8.27 . 1 820 368 128 ILE C C 176.408 . 1 821 368 128 ILE N N 122.653 . 1 822 369 129 MET H H 8.513 . 1 823 369 129 MET HA H 4.483 . 1 824 369 129 MET HB2 H 1.971 . 1 825 369 129 MET HB3 H 1.971 . 1 826 369 129 MET C C 175.953 . 1 827 369 129 MET CA C 55.349 . 1 828 369 129 MET CB C 32.885 . 1 829 369 129 MET N N 125.302 . 1 830 370 130 ASP H H 8.364 . 1 831 370 130 ASP HA H 4.516 . 1 832 370 130 ASP HB2 H 2.67 . 1 833 370 130 ASP HB3 H 2.55 . 1 834 370 130 ASP C C 176.201 . 1 835 370 130 ASP CA C 54.69 . 1 836 370 130 ASP CB C 41.328 . 1 837 370 130 ASP N N 122.125 . 1 838 371 131 GLU H H 8.33 . 1 839 371 131 GLU HA H 4.123 . 1 840 371 131 GLU HB2 H 1.897 . 1 841 371 131 GLU HB3 H 1.897 . 1 842 371 131 GLU C C 176.047 . 1 843 371 131 GLU CA C 56.74 . 1 844 371 131 GLU CB C 30.394 . 1 845 371 131 GLU N N 121.316 . 1 846 372 132 LEU H H 8.202 . 1 847 372 132 LEU HA H 4.205 . 1 848 372 132 LEU HB2 H 1.534 . 1 849 372 132 LEU HB3 H 1.534 . 1 850 372 132 LEU C C 176.727 . 1 851 372 132 LEU CA C 55.099 . 1 852 372 132 LEU CB C 42.481 . 1 853 372 132 LEU N N 122.705 . 1 854 373 133 PHE H H 8.316 . 1 855 373 133 PHE N N 121.123 . 1 856 374 134 PRO HA H 4.392 . 1 857 374 134 PRO HB2 H 2.234 . 1 858 374 134 PRO HB3 H 1.91 . 1 859 374 134 PRO C C 176.864 . 1 860 374 134 PRO CA C 63.436 . 1 861 374 134 PRO CB C 32.174 . 1 862 375 135 ASP H H 8.42 . 1 863 375 135 ASP HA H 4.519 . 1 864 375 135 ASP HB2 H 2.616 . 1 865 375 135 ASP HB3 H 2.616 . 1 866 375 135 ASP C C 176.234 . 1 867 375 135 ASP CA C 54.673 . 1 868 375 135 ASP CB C 41.02 . 1 869 375 135 ASP N N 119.924 . 1 870 376 136 ASN H H 8.323 . 1 871 376 136 ASN HA H 4.646 . 1 872 376 136 ASN HB2 H 2.742 . 1 873 376 136 ASN HB3 H 2.742 . 1 874 376 136 ASN C C 175.324 . 1 875 376 136 ASN CA C 53.373 . 1 876 376 136 ASN CB C 38.612 . 1 877 376 136 ASN N N 118.57 . 1 878 377 137 PHE H H 8.256 . 1 879 377 137 PHE HA H 4.522 . 1 880 377 137 PHE HB2 H 3.101 . 1 881 377 137 PHE HB3 H 3.101 . 1 882 377 137 PHE C C 175.919 . 1 883 377 137 PHE CA C 58.573 . 1 884 377 137 PHE CB C 39.321 . 1 885 377 137 PHE N N 120.632 . 1 886 378 138 GLN H H 8.284 . 1 887 378 138 GLN HA H 4.25 . 1 888 378 138 GLN HB2 H 2.037 . 1 889 378 138 GLN HB3 H 1.914 . 1 890 378 138 GLN C C 175.906 . 1 891 378 138 GLN CA C 56.012 . 1 892 378 138 GLN CB C 29.336 . 1 893 378 138 GLN N N 121.598 . 1 894 379 139 SER H H 8.33 . 1 895 379 139 SER HA H 4.413 . 1 896 379 139 SER HB2 H 3.877 . 1 897 379 139 SER HB3 H 3.877 . 1 898 379 139 SER C C 175.096 . 1 899 379 139 SER CA C 58.756 . 1 900 379 139 SER CB C 63.769 . 1 901 379 139 SER N N 116.8 . 1 902 380 140 THR H H 8.22 . 1 903 380 140 THR HB H 4.279 . 1 904 380 140 THR C C 174.727 . 1 905 380 140 THR CA C 62.1 . 1 906 380 140 THR CB C 69.743 . 1 907 380 140 THR N N 115.38 . 1 908 381 141 CYS H H 8.351 . 1 909 381 141 CYS HA H 4.57 . 1 910 381 141 CYS HB2 H 2.91 . 1 911 381 141 CYS C C 174.955 . 1 912 381 141 CYS CA C 58.86 . 1 913 381 141 CYS CB C 27.9 . 1 914 381 141 CYS N N 121.44 . 1 915 382 142 THR H H 8.32 . 1 916 382 142 THR HA H 4.308 . 1 917 382 142 THR HB H 4.219 . 1 918 382 142 THR C C 174.509 . 1 919 382 142 THR CA C 62.321 . 1 920 382 142 THR CB C 69.61 . 1 921 382 142 THR N N 117.1 . 1 922 383 143 GLN H H 8.417 . 1 923 383 143 GLN HA H 4.369 . 1 924 383 143 GLN HB2 H 2.068 . 1 925 383 143 GLN HB3 H 1.967 . 1 926 383 143 GLN C C 175.996 . 1 927 383 143 GLN CA C 56.032 . 1 928 383 143 GLN CB C 29.511 . 1 929 383 143 GLN N N 123.142 . 1 930 384 144 THR H H 8.292 . 1 931 384 144 THR HA H 4.184 . 1 932 384 144 THR HB H 4.036 . 1 933 384 144 THR C C 174.214 . 1 934 384 144 THR CA C 62.172 . 1 935 384 144 THR CB C 69.747 . 1 936 384 144 THR N N 116.497 . 1 937 385 145 ARG H H 8.256 . 1 938 385 145 ARG HA H 4.281 . 1 939 385 145 ARG HB2 H 1.634 . 1 940 385 145 ARG HB3 H 1.634 . 1 941 385 145 ARG C C 175.56 . 1 942 385 145 ARG CA C 56.043 . 1 943 385 145 ARG CB C 30.973 . 1 944 385 145 ARG N N 123.834 . 1 945 386 146 TRP H H 8.291 . 1 946 386 146 TRP HA H 4.682 . 1 947 386 146 TRP HB2 H 3.297 . 1 948 386 146 TRP HB3 H 3.189 . 1 949 386 146 TRP C C 175.791 . 1 950 386 146 TRP CA C 57.273 . 1 951 386 146 TRP CB C 29.633 . 1 952 386 146 TRP N N 122.934 . 1 953 387 147 LEU H H 8.069 . 1 954 387 147 LEU C C 175.948 . 1 955 387 147 LEU N N 124.129 . 1 stop_ save_