data_17652 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Backbone 1H, 13C, and 15N Chemical Shift Assignments of S108C mutant of phosphomannomutase/phosphoglucomutase ; _BMRB_accession_number 17652 _BMRB_flat_file_name bmr17652.str _Entry_type original _Submission_date 2011-05-16 _Accession_date 2011-05-16 _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 VanDoren Steven R. . 2 Akella Sarma V.S. . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 2 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 509 "13C chemical shifts" 1359 "15N chemical shifts" 509 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2012-08-07 original author . stop_ _Original_release_date 2012-08-07 save_ ############################# # Citation for this entry # ############################# save_S108C_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title 'Solution NMR of a 463-residue phosphohexomutase: domain 4 mobility, substates, and phosphoryl transfer defect' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 22242625 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Sarma Akella V.S. . 2 Anbanandam Asokan . . 3 Kelm Allek . . 4 Mehra-Chaudhary Ritcha . . 5 Wei Yirui . . 6 Qin Peiwu . . 7 Lee Yingying . . 8 Berjanskii Mark V. . 9 Mick Jacob A. . 10 Beamer Lesa J. . 11 VanDoren Steven R. . stop_ _Journal_abbreviation Biochemistry _Journal_volume 51 _Journal_issue 3 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 807 _Page_last 819 _Year 2012 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'S108C mutant of Phosphomannomutase/Phosphoglucomutase' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label Monomer $PMM_PGM(S108C) Mg2+ $MG 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_PMM_PGM(S108C) _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common PMM_PGM(S108C) _Molecular_mass . _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 463 _Mol_residue_sequence ; MSTVKAPTLPASIFRAYDIR GVVGDTLTAETAYWIGRAIG SESLARGEPCVAVGRDGRLS GPELVKQLIQGLVDCGCQVS DVGMVPTPVLYYAANVLEGK SGVMLTGCHNPPDYNGFKIV VAGETLANEQIQALRERIEK NDLASGVGSVEQVDILPRYF KQIRDDIAMAKPMKVVVDCG NGVAGVIAPQLIEALGCSVI PLYCEVDGNFPNHHPDPGKP ENLKDLIAKVKAENADLGLA FDGDGDRVGVVTNTGTIIYP DRLLMLFAKDVVSRNPGADI IFDVKCTRRLIALISGYGGR PVMWKTGHSLIKKKMKETGA LLAGEMSGHVFFKERWFGFD DGIYSAARLLEILSQDQRDS EHVFSAFPSDISTPEINITV TEDSKFAIIEALQRDAQWGE GNITTLDGVRVDYPKGWGLV RASNTTPVLVLRFEADTEEE LERIKTVFRNQLKAVDSSLP VPF ; loop_ _Residue_seq_code _Residue_label 1 MET 2 SER 3 THR 4 VAL 5 LYS 6 ALA 7 PRO 8 THR 9 LEU 10 PRO 11 ALA 12 SER 13 ILE 14 PHE 15 ARG 16 ALA 17 TYR 18 ASP 19 ILE 20 ARG 21 GLY 22 VAL 23 VAL 24 GLY 25 ASP 26 THR 27 LEU 28 THR 29 ALA 30 GLU 31 THR 32 ALA 33 TYR 34 TRP 35 ILE 36 GLY 37 ARG 38 ALA 39 ILE 40 GLY 41 SER 42 GLU 43 SER 44 LEU 45 ALA 46 ARG 47 GLY 48 GLU 49 PRO 50 CYS 51 VAL 52 ALA 53 VAL 54 GLY 55 ARG 56 ASP 57 GLY 58 ARG 59 LEU 60 SER 61 GLY 62 PRO 63 GLU 64 LEU 65 VAL 66 LYS 67 GLN 68 LEU 69 ILE 70 GLN 71 GLY 72 LEU 73 VAL 74 ASP 75 CYS 76 GLY 77 CYS 78 GLN 79 VAL 80 SER 81 ASP 82 VAL 83 GLY 84 MET 85 VAL 86 PRO 87 THR 88 PRO 89 VAL 90 LEU 91 TYR 92 TYR 93 ALA 94 ALA 95 ASN 96 VAL 97 LEU 98 GLU 99 GLY 100 LYS 101 SER 102 GLY 103 VAL 104 MET 105 LEU 106 THR 107 GLY 108 CYS 109 HIS 110 ASN 111 PRO 112 PRO 113 ASP 114 TYR 115 ASN 116 GLY 117 PHE 118 LYS 119 ILE 120 VAL 121 VAL 122 ALA 123 GLY 124 GLU 125 THR 126 LEU 127 ALA 128 ASN 129 GLU 130 GLN 131 ILE 132 GLN 133 ALA 134 LEU 135 ARG 136 GLU 137 ARG 138 ILE 139 GLU 140 LYS 141 ASN 142 ASP 143 LEU 144 ALA 145 SER 146 GLY 147 VAL 148 GLY 149 SER 150 VAL 151 GLU 152 GLN 153 VAL 154 ASP 155 ILE 156 LEU 157 PRO 158 ARG 159 TYR 160 PHE 161 LYS 162 GLN 163 ILE 164 ARG 165 ASP 166 ASP 167 ILE 168 ALA 169 MET 170 ALA 171 LYS 172 PRO 173 MET 174 LYS 175 VAL 176 VAL 177 VAL 178 ASP 179 CYS 180 GLY 181 ASN 182 GLY 183 VAL 184 ALA 185 GLY 186 VAL 187 ILE 188 ALA 189 PRO 190 GLN 191 LEU 192 ILE 193 GLU 194 ALA 195 LEU 196 GLY 197 CYS 198 SER 199 VAL 200 ILE 201 PRO 202 LEU 203 TYR 204 CYS 205 GLU 206 VAL 207 ASP 208 GLY 209 ASN 210 PHE 211 PRO 212 ASN 213 HIS 214 HIS 215 PRO 216 ASP 217 PRO 218 GLY 219 LYS 220 PRO 221 GLU 222 ASN 223 LEU 224 LYS 225 ASP 226 LEU 227 ILE 228 ALA 229 LYS 230 VAL 231 LYS 232 ALA 233 GLU 234 ASN 235 ALA 236 ASP 237 LEU 238 GLY 239 LEU 240 ALA 241 PHE 242 ASP 243 GLY 244 ASP 245 GLY 246 ASP 247 ARG 248 VAL 249 GLY 250 VAL 251 VAL 252 THR 253 ASN 254 THR 255 GLY 256 THR 257 ILE 258 ILE 259 TYR 260 PRO 261 ASP 262 ARG 263 LEU 264 LEU 265 MET 266 LEU 267 PHE 268 ALA 269 LYS 270 ASP 271 VAL 272 VAL 273 SER 274 ARG 275 ASN 276 PRO 277 GLY 278 ALA 279 ASP 280 ILE 281 ILE 282 PHE 283 ASP 284 VAL 285 LYS 286 CYS 287 THR 288 ARG 289 ARG 290 LEU 291 ILE 292 ALA 293 LEU 294 ILE 295 SER 296 GLY 297 TYR 298 GLY 299 GLY 300 ARG 301 PRO 302 VAL 303 MET 304 TRP 305 LYS 306 THR 307 GLY 308 HIS 309 SER 310 LEU 311 ILE 312 LYS 313 LYS 314 LYS 315 MET 316 LYS 317 GLU 318 THR 319 GLY 320 ALA 321 LEU 322 LEU 323 ALA 324 GLY 325 GLU 326 MET 327 SER 328 GLY 329 HIS 330 VAL 331 PHE 332 PHE 333 LYS 334 GLU 335 ARG 336 TRP 337 PHE 338 GLY 339 PHE 340 ASP 341 ASP 342 GLY 343 ILE 344 TYR 345 SER 346 ALA 347 ALA 348 ARG 349 LEU 350 LEU 351 GLU 352 ILE 353 LEU 354 SER 355 GLN 356 ASP 357 GLN 358 ARG 359 ASP 360 SER 361 GLU 362 HIS 363 VAL 364 PHE 365 SER 366 ALA 367 PHE 368 PRO 369 SER 370 ASP 371 ILE 372 SER 373 THR 374 PRO 375 GLU 376 ILE 377 ASN 378 ILE 379 THR 380 VAL 381 THR 382 GLU 383 ASP 384 SER 385 LYS 386 PHE 387 ALA 388 ILE 389 ILE 390 GLU 391 ALA 392 LEU 393 GLN 394 ARG 395 ASP 396 ALA 397 GLN 398 TRP 399 GLY 400 GLU 401 GLY 402 ASN 403 ILE 404 THR 405 THR 406 LEU 407 ASP 408 GLY 409 VAL 410 ARG 411 VAL 412 ASP 413 TYR 414 PRO 415 LYS 416 GLY 417 TRP 418 GLY 419 LEU 420 VAL 421 ARG 422 ALA 423 SER 424 ASN 425 THR 426 THR 427 PRO 428 VAL 429 LEU 430 VAL 431 LEU 432 ARG 433 PHE 434 GLU 435 ALA 436 ASP 437 THR 438 GLU 439 GLU 440 GLU 441 LEU 442 GLU 443 ARG 444 ILE 445 LYS 446 THR 447 VAL 448 PHE 449 ARG 450 ASN 451 GLN 452 LEU 453 LYS 454 ALA 455 VAL 456 ASP 457 SER 458 SER 459 LEU 460 PRO 461 VAL 462 PRO 463 PHE stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-07-08 loop_ _Database_name _Database_accession_code _Database_entry_mol_name _Sequence_query_to_submitted_percentage _Sequence_subject_length _Sequence_identity _Sequence_positive _Sequence_homology_expectation_value BMRB 17602 PMM-PGM 100.00 463 99.78 99.78 0.00e+00 PDB 1K2Y "Crystal Structure Of Phosphomannomutase/phosphoglucomutase S108a Mutant From P. Aeruginosa" 100.00 463 99.57 99.57 0.00e+00 PDB 1K35 "Crystal Structure Of Phosphomannomutase/phosphoglucomutase From P.aeruginosa" 100.00 463 97.84 97.84 0.00e+00 PDB 1P5D "Enzyme-Ligand Complex Of P. Aeruginosa PmmPGM" 100.00 463 99.57 99.57 0.00e+00 PDB 1P5G "Enzyme-Ligand Complex Of P. Aeruginosa PmmPGM" 100.00 463 99.57 99.57 0.00e+00 PDB 1PCJ "Enzyme-Ligand Complex Of P. Aeruginosa PmmPGM" 100.00 463 99.57 99.57 0.00e+00 PDB 1PCM "Enzyme-Ligand Complex Of P. Aeruginosa PmmPGM" 100.00 463 99.57 99.57 0.00e+00 PDB 2FKF "PhosphomannomutasePHOSPHOGLUCOMUTASE FROM PSEUDOMONAS AERUGINOSA WITH Alpha-D-Glucose 1,6-Bisphosphate Bound" 99.78 462 99.57 99.57 0.00e+00 PDB 2FKM "Pmm/pgm S108d Mutant With Alpha-d-glucose 1,6-bisphosphate Bound" 99.78 462 99.57 99.57 0.00e+00 PDB 2H4L "Complex Of PmmPGM WITH RIBOSE 1-Phosphate" 100.00 463 99.78 99.78 0.00e+00 PDB 2H5A "Complex Of The Enzyme PmmPGM WITH XYLOSE 1-Phosphate" 100.00 463 99.78 99.78 0.00e+00 PDB 3BKQ "Structure Of The P368g Mutant Of PmmPGM IN COMPLEX WITH ITS SUBSTRATE" 100.00 463 99.35 99.35 0.00e+00 PDB 3C04 "Structure Of The P368g Mutant Of PmmPGM FROM P. AERUGINOSA" 100.00 463 99.35 99.35 0.00e+00 PDB 3RSM "Crystal Structure Of S108c Mutant Of PmmPGM" 100.00 463 100.00 100.00 0.00e+00 PDB 4IL8 "Crystal Structure Of An H329a Mutant Of P. Aeruginosa Pmm/pgm" 100.00 463 99.57 99.57 0.00e+00 PDB 4MRQ "Crystal Structure Of Wild-type Unphosphorylated Pmm/pgm" 98.27 455 99.78 99.78 0.00e+00 DBJ BAK92897 "phosphomannomutase [Pseudomonas aeruginosa NCGM2.S1]" 100.00 868 99.57 99.57 0.00e+00 DBJ BAP25224 "phosphomannomutase [Pseudomonas aeruginosa]" 100.00 868 99.57 99.57 0.00e+00 DBJ BAP54026 "phosphomannomutase [Pseudomonas aeruginosa]" 100.00 868 99.57 99.57 0.00e+00 DBJ BAQ43263 "phosphomannomutase [Pseudomonas aeruginosa]" 100.00 870 99.57 99.57 0.00e+00 DBJ BAR70810 "phosphomannomutase/phosphoglucomutase [Pseudomonas aeruginosa]" 100.00 868 99.35 99.57 0.00e+00 EMBL CAW30471 "phosphomannomutase AlgC [Pseudomonas aeruginosa LESB58]" 100.00 463 99.57 99.57 0.00e+00 EMBL CCQ87804 "Phosphomannomutase / Phosphoglucomutase [Pseudomonas aeruginosa 18A]" 100.00 741 99.35 99.35 0.00e+00 EMBL CDH74092 "Phosphomannomutase/phosphoglucomutase [Pseudomonas aeruginosa MH38]" 100.00 868 99.57 99.57 0.00e+00 EMBL CDH80443 "Phosphomannomutase/phosphoglucomutase [Pseudomonas aeruginosa MH27]" 100.00 868 99.57 99.57 0.00e+00 EMBL CDI93917 "phosphomannomutase [Pseudomonas aeruginosa PA38182]" 100.00 868 99.57 99.57 0.00e+00 GB AAA25701 "phosphomannomutase [Pseudomonas aeruginosa]" 100.00 463 99.35 99.35 0.00e+00 GB AAG08707 "phosphomannomutase AlgC [Pseudomonas aeruginosa PAO1]" 100.00 463 99.57 99.57 0.00e+00 GB ABJ14705 "phosphomannomutase AlgC [Pseudomonas aeruginosa UCBPP-PA14]" 100.00 854 99.57 99.57 0.00e+00 GB ABR82184 "phosphomannomutase AlgC [Pseudomonas aeruginosa PA7]" 100.00 868 98.27 99.35 0.00e+00 GB AEO77919 "phosphomannomutase AlgC [Pseudomonas aeruginosa M18]" 100.00 863 99.57 99.57 0.00e+00 REF NP_254009 "phosphomannomutase [Pseudomonas aeruginosa PAO1]" 100.00 868 99.57 99.57 0.00e+00 REF WP_003098295 "phosphomannomutase [Pseudomonas aeruginosa]" 100.00 863 99.57 99.57 0.00e+00 REF WP_003114359 "MULTISPECIES: phosphomannomutase [Pseudomonas]" 100.00 868 99.57 99.57 0.00e+00 REF WP_003117161 "phosphomannomutase [Pseudomonas aeruginosa]" 100.00 868 99.57 99.57 0.00e+00 REF WP_003121305 "phosphomannomutase/phosphoglucomutase [Pseudomonas aeruginosa]" 100.00 463 99.57 99.57 0.00e+00 SP P26276 "RecName: Full=Phosphomannomutase/phosphoglucomutase; Short=PMM / PGM [Pseudomonas aeruginosa PAO1]" 100.00 463 99.57 99.57 0.00e+00 SP Q02E40 "RecName: Full=Phosphomannomutase/phosphoglucomutase; Short=PMM / PGM" 100.00 463 99.57 99.57 0.00e+00 stop_ save_ ############# # Ligands # ############# save_MG _Saveframe_category ligand _Mol_type non-polymer _Name_common "MG (MAGNESIUM ION)" _BMRB_code . _PDB_code MG _Molecular_mass 24.305 _Mol_charge 2 _Mol_paramagnetic . _Mol_aromatic no _Details ; Information obtained from PDB's Chemical Component Dictionary at http://wwpdb-remediation.rutgers.edu/downloads.html Downloaded on Fri Jan 27 15:40:02 2012 ; loop_ _Atom_name _PDB_atom_name _Atom_type _Atom_chirality _Atom_charge _Atom_oxidation_number _Atom_unpaired_electrons MG MG MG . 2 . ? stop_ _Mol_thiol_state . _Sequence_homology_query_date . save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $PMM_PGM(S108C) 'Pseudomonas aeruginosa' 287 Bacteria . Pseudomonas aeruginosa 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 $PMM_PGM(S108C) 'recombinant technology' . Escherichia coli BL21DE3 pET14b_PMM/PGM(S108C) stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_PMM_PGM(S108C)_sample _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $PMM_PGM(S108C) 0.75 mM '[U-100% 13C; U-100% 15N; U-80% 2H]' D2O 5 % '[U-99.9% 2H]' H2O 95 % 'natural abundance' 'Magnesium Chloride' 1 mM 'natural abundance' MOPS 50 mM 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Saveframe_category software _Name TOPSPIN _Version 2.1.3 loop_ _Vendor _Address _Electronic_address 'Bruker Biospin' . . stop_ loop_ _Task collection 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' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 800 _Details . save_ ############################# # NMR applied experiments # ############################# save_2D_1H-15N_TROSY_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N TROSY' _Sample_label $PMM_PGM(S108C)_sample save_ save_3D_TROSY-HNCO_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D TROSY-HNCO' _Sample_label $PMM_PGM(S108C)_sample save_ save_3D_TROSY-HNCA_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D TROSY-HNCA' _Sample_label $PMM_PGM(S108C)_sample save_ save_3D_TROSY-HN(CO)CA_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D TROSY-HN(CO)CA' _Sample_label $PMM_PGM(S108C)_sample save_ save_3D_TROSY-HNCACB_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D TROSY-HNCACB' _Sample_label $PMM_PGM(S108C)_sample save_ save_3D_TROSY-HNCACO_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D TROSY-HNCACO' _Sample_label $PMM_PGM(S108C)_sample save_ ####################### # Sample conditions # ####################### save_PMM(S108C)_sample_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 0.003 . M pH 7.4 . pH pressure 1 . atm temperature 310 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_PMM(S108C)_chemical_shift_reference _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 0.00 . indirect . . . 0.251449530 DSS H 1 'methyl protons' ppm 0.00 internal direct . . . 1.000000000 DSS N 15 'methyl protons' ppm 0.00 . 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_PMM(S108C)_assigned_chem_shift_list _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '2D 1H-15N TROSY' '3D TROSY-HNCO' '3D TROSY-HNCA' '3D TROSY-HN(CO)CA' '3D TROSY-HNCACB' '3D TROSY-HNCACO' stop_ loop_ _Sample_label $PMM_PGM(S108C)_sample stop_ _Sample_conditions_label $PMM(S108C)_sample_conditions_1 _Chem_shift_reference_set_label $PMM(S108C)_chemical_shift_reference _Mol_system_component_name Monomer _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 8 8 THR H H 7.96 0.00004 1 2 8 8 THR C C 174.43 0.0001 1 3 8 8 THR CA C 61.95 0.0001 1 4 8 8 THR CB C 68.66 0.0001 1 5 8 8 THR N N 115.17 0.01 1 6 9 9 LEU H H 8.64 0.00004 1 7 9 9 LEU CA C 51.94 0.0001 1 8 9 9 LEU CB C 40.97 0.0001 1 9 9 9 LEU N N 130.2 0.01 1 10 11 11 ALA H H 8.49 0.00004 1 11 11 11 ALA C C 180.92 0.0001 1 12 11 11 ALA CA C 54.52 0.0001 1 13 11 11 ALA CB C 17.55 0.0001 1 14 11 11 ALA N N 126.98 0.01 1 15 13 13 ILE H H 6.85 0.00004 1 16 13 13 ILE C C 175.35 0.0001 1 17 13 13 ILE CA C 62.09 0.0001 1 18 13 13 ILE CB C 36.6 0.0001 1 19 13 13 ILE N N 113.1 0.01 1 20 14 14 PHE H H 7.54 0.00004 1 21 14 14 PHE C C 174.17 0.0001 1 22 14 14 PHE CA C 58.14 0.0001 1 23 14 14 PHE CB C 37.07 0.0001 1 24 14 14 PHE N N 121.99 0.01 1 25 15 15 ARG H H 7.86 0.00004 1 26 15 15 ARG C C 175.83 0.0001 1 27 15 15 ARG CB C 29.69 0.0001 1 28 15 15 ARG N N 124.7 0.01 1 29 16 16 ALA H H 7.81 0.00004 1 30 16 16 ALA C C 178.35 0.0001 1 31 16 16 ALA CA C 55.54 0.0001 1 32 16 16 ALA CB C 17.65 0.0001 1 33 16 16 ALA N N 121.58 0.01 1 34 17 17 TYR H H 8.25 0.00004 1 35 17 17 TYR CA C 55.01 0.0001 1 36 17 17 TYR CB C 38.77 0.0001 1 37 17 17 TYR N N 110.32 0.01 1 38 18 18 ASP H H 7.71 0.00004 1 39 18 18 ASP C C 172.89 0.0001 1 40 18 18 ASP CA C 52.43 0.0001 1 41 18 18 ASP CB C 41.22 0.0001 1 42 18 18 ASP N N 119.55 0.01 1 43 19 19 ILE H H 7.87 0.00004 1 44 19 19 ILE C C 175.9 0.0001 1 45 19 19 ILE CA C 59.06 0.0001 1 46 19 19 ILE CB C 40.4 0.0001 1 47 19 19 ILE N N 116.65 0.01 1 48 20 20 ARG H H 9 0.00004 1 49 20 20 ARG C C 174.4 0.0001 1 50 20 20 ARG CA C 55.1 0.0001 1 51 20 20 ARG CB C 33.14 0.0001 1 52 20 20 ARG N N 126.81 0.01 1 53 21 21 GLY H H 8.47 0.00004 1 54 21 21 GLY C C 169.45 0.0001 1 55 21 21 GLY CA C 44.78 0.0001 1 56 21 21 GLY N N 109.29 0.01 1 57 22 22 VAL H H 7.3 0.00004 1 58 22 22 VAL C C 177.35 0.0001 1 59 22 22 VAL CA C 61.49 0.0001 1 60 22 22 VAL CB C 32.05 0.0001 1 61 22 22 VAL N N 119.78 0.01 1 62 23 23 VAL H H 9.29 0.00004 1 63 23 23 VAL C C 177.51 0.0001 1 64 23 23 VAL CA C 63.5 0.0001 1 65 23 23 VAL CB C 29.52 0.0001 1 66 23 23 VAL N N 134.14 0.01 1 67 24 24 GLY H H 8.35 0.00004 1 68 24 24 GLY C C 172.61 0.0001 1 69 24 24 GLY CA C 44.48 0.0001 1 70 24 24 GLY N N 116.5 0.01 1 71 25 25 ASP H H 7.79 0.00004 1 72 25 25 ASP C C 174.51 0.0001 1 73 25 25 ASP CA C 54.05 0.0001 1 74 25 25 ASP CB C 41.49 0.0001 1 75 25 25 ASP N N 120.72 0.01 1 76 26 26 THR H H 7.41 0.00004 1 77 26 26 THR C C 173.52 0.0001 1 78 26 26 THR CA C 60.73 0.0001 1 79 26 26 THR CB C 69.5 0.0001 1 80 26 26 THR N N 106.8 0.01 1 81 27 27 LEU H H 7.63 0.00004 1 82 27 27 LEU C C 173.97 0.0001 1 83 27 27 LEU CA C 53.39 0.0001 1 84 27 27 LEU CB C 43.36 0.0001 1 85 27 27 LEU N N 123.42 0.01 1 86 28 28 THR H H 8.05 0.00004 1 87 28 28 THR C C 174.67 0.0001 1 88 28 28 THR CA C 58.57 0.0001 1 89 28 28 THR CB C 72.13 0.0001 1 90 28 28 THR N N 115.9 0.01 1 91 29 29 ALA H H 8.96 0.00004 1 92 29 29 ALA C C 178.77 0.0001 1 93 29 29 ALA CA C 55.51 0.0001 1 94 29 29 ALA CB C 17.1 0.0001 1 95 29 29 ALA N N 124.1 0.01 1 96 30 30 GLU H H 8.11 0.00004 1 97 30 30 GLU C C 178.39 0.0001 1 98 30 30 GLU CA C 59.03 0.0001 1 99 30 30 GLU CB C 28.85 0.0001 1 100 30 30 GLU N N 117.46 0.01 1 101 31 31 THR H H 7.76 0.00004 1 102 31 31 THR C C 176.22 0.0001 1 103 31 31 THR CA C 66.77 0.0001 1 104 31 31 THR CB C 67.73 0.0001 1 105 31 31 THR N N 117.35 0.01 1 106 32 32 ALA H H 7.95 0.00004 1 107 32 32 ALA C C 177.92 0.0001 1 108 32 32 ALA CA C 55.11 0.0001 1 109 32 32 ALA CB C 18.13 0.0001 1 110 32 32 ALA N N 121.59 0.01 1 111 33 33 TYR H H 7.57 0.00004 1 112 33 33 TYR C C 177.39 0.0001 1 113 33 33 TYR CA C 60.98 0.0001 1 114 33 33 TYR CB C 36.54 0.0001 1 115 33 33 TYR N N 119.01 0.01 1 116 34 34 TRP H H 7.65 0.00004 1 117 34 34 TRP C C 178.74 0.0001 1 118 34 34 TRP CA C 59.78 0.0001 1 119 34 34 TRP CB C 28.35 0.0001 1 120 34 34 TRP N N 120.74 0.01 1 121 35 35 ILE H H 8.54 0.00004 1 122 35 35 ILE C C 178.06 0.0001 1 123 35 35 ILE CA C 64.6 0.0001 1 124 35 35 ILE CB C 35.29 0.0001 1 125 35 35 ILE N N 121.44 0.01 1 126 36 36 GLY H H 8.18 0.00004 1 127 36 36 GLY C C 174.8 0.0001 1 128 36 36 GLY CA C 47.9 0.0001 1 129 36 36 GLY N N 110.06 0.01 1 130 37 37 ARG H H 8.03 0.00004 1 131 37 37 ARG C C 179.65 0.0001 1 132 37 37 ARG CA C 55.8 0.0001 1 133 37 37 ARG CB C 27.26 0.0001 1 134 37 37 ARG N N 121.39 0.01 1 135 38 38 ALA H H 8.54 0.00004 1 136 38 38 ALA C C 178.59 0.0001 1 137 38 38 ALA CA C 55.38 0.0001 1 138 38 38 ALA CB C 17.87 0.0001 1 139 38 38 ALA N N 126.93 0.01 1 140 39 39 ILE H H 8.8 0.00004 1 141 39 39 ILE C C 178.03 0.0001 1 142 39 39 ILE CA C 65.24 0.0001 1 143 39 39 ILE CB C 37.71 0.0001 1 144 39 39 ILE N N 119 0.01 1 145 40 40 GLY H H 8.79 0.00004 1 146 40 40 GLY C C 175.13 0.0001 1 147 40 40 GLY CA C 48.8 0.0001 1 148 40 40 GLY N N 108.8 0.01 1 149 41 41 SER H H 7.68 0.00004 1 150 41 41 SER CA C 62.41 0.0001 1 151 41 41 SER N N 117.86 0.01 1 152 42 42 GLU H H 8.03 0.00004 1 153 42 42 GLU C C 177 0.0001 1 154 42 42 GLU CA C 57.87 0.0001 1 155 42 42 GLU CB C 28.23 0.0001 1 156 42 42 GLU N N 125.87 0.01 1 157 43 43 SER H H 8.61 0.00004 1 158 43 43 SER C C 174.74 0.0001 1 159 43 43 SER CA C 62.61 0.0001 1 160 43 43 SER CB C 63.36 0.0001 1 161 43 43 SER N N 113.65 0.01 1 162 44 44 LEU H H 8.38 0.00004 1 163 44 44 LEU C C 181.37 0.0001 1 164 44 44 LEU CA C 57.91 0.0001 1 165 44 44 LEU CB C 40.53 0.0001 1 166 44 44 LEU N N 120.76 0.01 1 167 45 45 ALA H H 7.85 0.00004 1 168 45 45 ALA C C 179.26 0.0001 1 169 45 45 ALA CA C 54.3 0.0001 1 170 45 45 ALA CB C 16.96 0.0001 1 171 45 45 ALA N N 125.04 0.01 1 172 46 46 ARG H H 7.31 0.00004 1 173 46 46 ARG C C 176.07 0.0001 1 174 46 46 ARG CA C 54.51 0.0001 1 175 46 46 ARG CB C 28.85 0.0001 1 176 46 46 ARG N N 116.48 0.01 1 177 47 47 GLY H H 7.85 0.00004 1 178 47 47 GLY C C 173.34 0.0001 1 179 47 47 GLY CA C 45.3 0.0001 1 180 47 47 GLY N N 108.63 0.01 1 181 48 48 GLU H H 8.33 0.00004 1 182 48 48 GLU C C 173.24 0.0001 1 183 48 48 GLU CA C 51.34 0.0001 1 184 48 48 GLU CB C 30.37 0.0001 1 185 48 48 GLU N N 121.9 0.01 1 186 50 50 CYS H H 8.9 0.00004 1 187 50 50 CYS C C 173.15 0.0001 1 188 50 50 CYS CA C 58.54 0.0001 1 189 50 50 CYS CB C 27.42 0.0001 1 190 50 50 CYS N N 121.36 0.01 1 191 51 51 VAL H H 7.7 0.00004 1 192 51 51 VAL C C 174.41 0.0001 1 193 51 51 VAL CA C 59.12 0.0001 1 194 51 51 VAL CB C 35.49 0.0001 1 195 51 51 VAL N N 121.58 0.01 1 196 52 52 ALA H H 8.16 0.00004 1 197 52 52 ALA C C 176.36 0.0001 1 198 52 52 ALA CA C 50.05 0.0001 1 199 52 52 ALA CB C 19.37 0.0001 1 200 52 52 ALA N N 130.77 0.01 1 201 53 53 VAL H H 8.69 0.00004 1 202 53 53 VAL C C 173.3 0.0001 1 203 53 53 VAL CA C 60.47 0.0001 1 204 53 53 VAL CB C 35.16 0.0001 1 205 53 53 VAL N N 120.83 0.01 1 206 54 54 GLY H H 8.3 0.00004 1 207 54 54 GLY C C 170.75 0.0001 1 208 54 54 GLY CA C 43.25 0.0001 1 209 54 54 GLY N N 112.44 0.01 1 210 55 55 ARG H H 8.14 0.00004 1 211 55 55 ARG CA C 53.33 0.0001 1 212 55 55 ARG CB C 33.2 0.0001 1 213 55 55 ARG N N 114.37 0.01 1 214 57 57 GLY H H 8.22 0.00004 1 215 57 57 GLY C C 175.63 0.0001 1 216 57 57 GLY CA C 45.54 0.0001 1 217 57 57 GLY N N 104.39 0.01 1 218 58 58 ARG H H 7.53 0.00004 1 219 58 58 ARG CA C 57.13 0.0001 1 220 58 58 ARG CB C 29.63 0.0001 1 221 58 58 ARG N N 121.19 0.01 1 222 59 59 LEU H H 9.61 0.00004 1 223 59 59 LEU C C 178.46 0.0001 1 224 59 59 LEU CA C 57.1 0.0001 1 225 59 59 LEU CB C 40.58 0.0001 1 226 59 59 LEU N N 123.65 0.01 1 227 60 60 SER H H 7.13 0.00004 1 228 60 60 SER CA C 57.36 0.0001 1 229 60 60 SER CB C 63.56 0.0001 1 230 60 60 SER N N 108.41 0.01 1 231 61 61 GLY H H 7.46 0.00004 1 232 61 61 GLY C C 172.63 0.0001 1 233 61 61 GLY CA C 48.24 0.0001 1 234 61 61 GLY N N 109.08 0.01 1 235 63 63 GLU H H 7.79 0.00004 1 236 63 63 GLU C C 179.11 0.0001 1 237 63 63 GLU CA C 58.33 0.0001 1 238 63 63 GLU CB C 29.09 0.0001 1 239 63 63 GLU N N 116.7 0.01 1 240 64 64 LEU H H 7.89 0.00004 1 241 64 64 LEU C C 179.7 0.0001 1 242 64 64 LEU CA C 57.37 0.0001 1 243 64 64 LEU CB C 41.35 0.0001 1 244 64 64 LEU N N 117.64 0.01 1 245 65 65 VAL H H 9.23 0.00004 1 246 65 65 VAL C C 176.52 0.0001 1 247 65 65 VAL CA C 65.05 0.0001 1 248 65 65 VAL CB C 29.37 0.0001 1 249 65 65 VAL N N 121.6 0.01 1 250 66 66 LYS H H 6.91 0.00004 1 251 66 66 LYS C C 179.54 0.0001 1 252 66 66 LYS CA C 58.85 0.0001 1 253 66 66 LYS CB C 31.61 0.0001 1 254 66 66 LYS N N 121.65 0.01 1 255 67 67 GLN H H 6.77 0.00004 1 256 67 67 GLN C C 177.57 0.0001 1 257 67 67 GLN CA C 56.81 0.0001 1 258 67 67 GLN CB C 28.82 0.0001 1 259 67 67 GLN N N 117.24 0.01 1 260 68 68 LEU H H 8.27 0.00004 1 261 68 68 LEU C C 176.9 0.0001 1 262 68 68 LEU CA C 56.8 0.0001 1 263 68 68 LEU N N 122.39 0.01 1 264 70 70 GLN H H 7.8 0.00004 1 265 70 70 GLN C C 177.67 0.0001 1 266 70 70 GLN CA C 57.96 0.0001 1 267 70 70 GLN CB C 27.47 0.0001 1 268 70 70 GLN N N 120.28 0.01 1 269 71 71 GLY H H 8.49 0.00004 1 270 71 71 GLY C C 174.74 0.0001 1 271 71 71 GLY CA C 46.84 0.0001 1 272 71 71 GLY N N 108.35 0.01 1 273 72 72 LEU H H 7.54 0.00004 1 274 72 72 LEU C C 180.72 0.0001 1 275 72 72 LEU CA C 57.95 0.0001 1 276 72 72 LEU CB C 42.13 0.0001 1 277 72 72 LEU N N 122.01 0.01 1 278 73 73 VAL H H 9 0.00004 1 279 73 73 VAL C C 180.26 0.0001 1 280 73 73 VAL CA C 66.55 0.0001 1 281 73 73 VAL CB C 30.62 0.0001 1 282 73 73 VAL N N 124.69 0.01 1 283 74 74 ASP H H 8.65 0.00004 1 284 74 74 ASP C C 177.69 0.0001 1 285 74 74 ASP CA C 55.54 0.0001 1 286 74 74 ASP CB C 39.07 0.0001 1 287 74 74 ASP N N 122.33 0.01 1 288 75 75 CYS H H 7.32 0.00004 1 289 75 75 CYS C C 174.24 0.0001 1 290 75 75 CYS CA C 59.75 0.0001 1 291 75 75 CYS N N 116.46 0.01 1 292 76 76 GLY H H 8.07 0.00004 1 293 76 76 GLY CA C 43.01 0.0001 1 294 76 76 GLY N N 103.42 0.01 1 295 77 77 CYS H H 7.07 0.00004 1 296 77 77 CYS C C 172.67 0.0001 1 297 77 77 CYS CA C 60.53 0.0001 1 298 77 77 CYS CB C 27.94 0.0001 1 299 77 77 CYS N N 117.86 0.01 1 300 78 78 GLN H H 8.53 0.00004 1 301 78 78 GLN C C 175.89 0.0001 1 302 78 78 GLN CA C 54 0.0001 1 303 78 78 GLN CB C 27.99 0.0001 1 304 78 78 GLN N N 121.67 0.01 1 305 79 79 VAL H H 9.28 0.00004 1 306 79 79 VAL C C 176.67 0.0001 1 307 79 79 VAL CA C 61.17 0.0001 1 308 79 79 VAL CB C 32.35 0.0001 1 309 79 79 VAL N N 129.74 0.01 1 310 80 80 SER H H 8.86 0.00004 1 311 80 80 SER C C 172.06 0.0001 1 312 80 80 SER CA C 57.05 0.0001 1 313 80 80 SER CB C 63.28 0.0001 1 314 80 80 SER N N 126.87 0.01 1 315 81 81 ASP H H 9.11 0.00004 1 316 81 81 ASP C C 177.28 0.0001 1 317 81 81 ASP CA C 52.49 0.0001 1 318 81 81 ASP CB C 40.43 0.0001 1 319 81 81 ASP N N 127.43 0.01 1 320 82 82 VAL H H 9.08 0.00004 1 321 82 82 VAL C C 176.13 0.0001 1 322 82 82 VAL CA C 59.35 0.0001 1 323 82 82 VAL CB C 29.79 0.0001 1 324 82 82 VAL N N 122.18 0.01 1 325 83 83 GLY H H 8.59 0.00004 1 326 83 83 GLY C C 173.36 0.0001 1 327 83 83 GLY CA C 45.58 0.0001 1 328 83 83 GLY N N 110.96 0.01 1 329 84 84 MET H H 8.23 0.00004 1 330 84 84 MET C C 174.62 0.0001 1 331 84 84 MET CA C 53.83 0.0001 1 332 84 84 MET CB C 32.39 0.0001 1 333 84 84 MET N N 126.37 0.01 1 334 85 85 VAL H H 8.45 0.00004 1 335 85 85 VAL C C 171.1 0.0001 1 336 85 85 VAL CA C 56.85 0.0001 1 337 85 85 VAL CB C 34.57 0.0001 1 338 85 85 VAL N N 119.05 0.01 1 339 87 87 THR H H 8.65 0.00004 1 340 87 87 THR C C 170.15 0.0001 1 341 87 87 THR CA C 66.56 0.0001 1 342 87 87 THR CB C 65.17 0.0001 1 343 87 87 THR N N 124.83 0.01 1 344 89 89 VAL H H 7.05 0.00004 1 345 89 89 VAL CA C 64.25 0.0001 1 346 89 89 VAL CB C 29.04 0.0001 1 347 89 89 VAL N N 118 0.01 1 348 90 90 LEU H H 6.99 0.00004 1 349 90 90 LEU C C 180 0.0001 1 350 90 90 LEU CA C 55.48 0.0001 1 351 90 90 LEU CB C 39.01 0.0001 1 352 90 90 LEU N N 126.02 0.01 1 353 91 91 TYR H H 7.76 0.00004 1 354 91 91 TYR C C 178.98 0.0001 1 355 91 91 TYR CA C 57.09 0.0001 1 356 91 91 TYR N N 119.16 0.01 1 357 92 92 TYR H H 8.29 0.00004 1 358 92 92 TYR C C 177.49 0.0001 1 359 92 92 TYR CA C 61.57 0.0001 1 360 92 92 TYR CB C 37.62 0.0001 1 361 92 92 TYR N N 122.93 0.01 1 362 93 93 ALA H H 8.45 0.00004 1 363 93 93 ALA C C 177.32 0.0001 1 364 93 93 ALA CA C 55.04 0.0001 1 365 93 93 ALA CB C 16.93 0.0001 1 366 93 93 ALA N N 125.64 0.01 1 367 94 94 ALA H H 7.47 0.00004 1 368 94 94 ALA C C 175.53 0.0001 1 369 94 94 ALA CA C 52.16 0.0001 1 370 94 94 ALA CB C 15.26 0.0001 1 371 94 94 ALA N N 116.24 0.01 1 372 95 95 ASN H H 7.61 0.00004 1 373 95 95 ASN C C 176.03 0.0001 1 374 95 95 ASN CA C 54.93 0.0001 1 375 95 95 ASN CB C 41.82 0.0001 1 376 95 95 ASN N N 115.97 0.01 1 377 96 96 VAL H H 7.23 0.00004 1 378 96 96 VAL C C 176.96 0.0001 1 379 96 96 VAL CA C 61.35 0.0001 1 380 96 96 VAL CB C 31.83 0.0001 1 381 96 96 VAL N N 111.67 0.01 1 382 97 97 LEU H H 7.72 0.00004 1 383 97 97 LEU C C 175.88 0.0001 1 384 97 97 LEU CA C 53.75 0.0001 1 385 97 97 LEU CB C 39.27 0.0001 1 386 97 97 LEU N N 122.45 0.01 1 387 98 98 GLU H H 8.27 0.00004 1 388 98 98 GLU C C 178.15 0.0001 1 389 98 98 GLU CA C 59.14 0.0001 1 390 98 98 GLU CB C 28.96 0.0001 1 391 98 98 GLU N N 120.17 0.01 1 392 99 99 GLY H H 8.04 0.00004 1 393 99 99 GLY C C 175.47 0.0001 1 394 99 99 GLY CA C 44.43 0.0001 1 395 99 99 GLY N N 105.41 0.01 1 396 100 100 LYS H H 8.54 0.00004 1 397 100 100 LYS C C 177.67 0.0001 1 398 100 100 LYS CA C 53.46 0.0001 1 399 100 100 LYS CB C 30.6 0.0001 1 400 100 100 LYS N N 120.59 0.01 1 401 101 101 SER H H 6.99 0.00004 1 402 101 101 SER C C 173.28 0.0001 1 403 101 101 SER CA C 55.91 0.0001 1 404 101 101 SER CB C 65.51 0.0001 1 405 101 101 SER N N 115.93 0.01 1 406 102 102 GLY H H 10.2 0.00004 1 407 102 102 GLY C C 169.55 0.0001 1 408 102 102 GLY CA C 45.33 0.0001 1 409 102 102 GLY N N 113.8 0.01 1 410 103 103 VAL H H 9.18 0.00004 1 411 103 103 VAL C C 171.98 0.0001 1 412 103 103 VAL CA C 59.91 0.0001 1 413 103 103 VAL CB C 34.11 0.0001 1 414 103 103 VAL N N 122.78 0.01 1 415 104 104 MET H H 8.98 0.00004 1 416 104 104 MET CA C 51.88 0.0001 1 417 104 104 MET CB C 33.13 0.0001 1 418 104 104 MET N N 127.51 0.01 1 419 105 105 LEU H H 8.99 0.00004 1 420 105 105 LEU C C 175.12 0.0001 1 421 105 105 LEU CA C 53.28 0.0001 1 422 105 105 LEU CB C 40.96 0.0001 1 423 105 105 LEU N N 133.76 0.01 1 424 106 106 THR H H 8.16 0.00004 1 425 106 106 THR C C 171.51 0.0001 1 426 106 106 THR CA C 60.54 0.0001 1 427 106 106 THR CB C 68.4 0.0001 1 428 106 106 THR N N 123.76 0.01 1 429 113 113 ASP H H 9.07 0.00004 1 430 113 113 ASP C C 174.23 0.0001 1 431 113 113 ASP CA C 53.96 0.0001 1 432 113 113 ASP CB C 38.34 0.0001 1 433 113 113 ASP N N 113.79 0.01 1 434 114 114 TYR H H 8.1 0.00004 1 435 114 114 TYR C C 176.99 0.0001 1 436 114 114 TYR CA C 57.17 0.0001 1 437 114 114 TYR CB C 39.74 0.0001 1 438 114 114 TYR N N 119.3 0.01 1 439 115 115 ASN H H 8.7 0.00004 1 440 115 115 ASN C C 172.73 0.0001 1 441 115 115 ASN CA C 51.46 0.0001 1 442 115 115 ASN CB C 41.13 0.0001 1 443 115 115 ASN N N 118.91 0.01 1 444 116 116 GLY H H 8.62 0.00004 1 445 116 116 GLY C C 170.48 0.0001 1 446 116 116 GLY CA C 46.63 0.0001 1 447 116 116 GLY N N 109.78 0.01 1 448 117 117 PHE H H 9.14 0.00004 1 449 117 117 PHE C C 175.37 0.0001 1 450 117 117 PHE CA C 55.44 0.0001 1 451 117 117 PHE CB C 41.77 0.0001 1 452 117 117 PHE N N 114.3 0.01 1 453 118 118 LYS H H 9.3 0.00004 1 454 118 118 LYS C C 176.42 0.0001 1 455 118 118 LYS CA C 55.88 0.0001 1 456 118 118 LYS CB C 33.53 0.0001 1 457 118 118 LYS N N 123.01 0.01 1 458 119 119 ILE H H 8.4 0.00004 1 459 119 119 ILE C C 173.45 0.0001 1 460 119 119 ILE CA C 62.13 0.0001 1 461 119 119 ILE CB C 41.55 0.0001 1 462 119 119 ILE N N 122.34 0.01 1 463 120 120 VAL H H 9.32 0.00004 1 464 120 120 VAL C C 175.87 0.0001 1 465 120 120 VAL CA C 59.95 0.0001 1 466 120 120 VAL CB C 32.88 0.0001 1 467 120 120 VAL N N 130.22 0.01 1 468 121 121 VAL H H 9.01 0.00004 1 469 121 121 VAL C C 175.71 0.0001 1 470 121 121 VAL CA C 59.52 0.0001 1 471 121 121 VAL CB C 32.89 0.0001 1 472 121 121 VAL N N 125.48 0.01 1 473 122 122 ALA H H 9.05 0.00004 1 474 122 122 ALA C C 176.44 0.0001 1 475 122 122 ALA CA C 52.49 0.0001 1 476 122 122 ALA CB C 17.04 0.0001 1 477 122 122 ALA N N 131.82 0.01 1 478 123 123 GLY H H 7.72 0.00004 1 479 123 123 GLY C C 173.43 0.0001 1 480 123 123 GLY CA C 44.6 0.0001 1 481 123 123 GLY N N 103.15 0.01 1 482 124 124 GLU H H 7.95 0.00004 1 483 124 124 GLU C C 175.8 0.0001 1 484 124 124 GLU CA C 54.32 0.0001 1 485 124 124 GLU CB C 28.81 0.0001 1 486 124 124 GLU N N 123.97 0.01 1 487 126 126 LEU H H 8.44 0.00004 1 488 126 126 LEU C C 176.29 0.0001 1 489 126 126 LEU CA C 55.18 0.0001 1 490 126 126 LEU CB C 41.29 0.0001 1 491 126 126 LEU N N 128.26 0.01 1 492 127 127 ALA H H 8.29 0.00004 1 493 127 127 ALA C C 177.5 0.0001 1 494 127 127 ALA CA C 50.55 0.0001 1 495 127 127 ALA CB C 23.22 0.0001 1 496 127 127 ALA N N 122.53 0.01 1 497 128 128 ASN H H 10.3 0.00004 1 498 128 128 ASN C C 177.9 0.0001 1 499 128 128 ASN CA C 55.19 0.0001 1 500 128 128 ASN CB C 37.49 0.0001 1 501 128 128 ASN N N 119.39 0.01 1 502 130 130 GLN H H 8.29 0.00004 1 503 130 130 GLN C C 178.74 0.0001 1 504 130 130 GLN CA C 57.55 0.0001 1 505 130 130 GLN CB C 28.8 0.0001 1 506 130 130 GLN N N 119.56 0.01 1 507 131 131 ILE H H 6.96 0.00004 1 508 131 131 ILE CA C 63.76 0.0001 1 509 131 131 ILE CB C 36.58 0.0001 1 510 131 131 ILE N N 119.8 0.01 1 511 132 132 GLN H H 7.15 0.00004 1 512 132 132 GLN C C 178.19 0.0001 1 513 132 132 GLN CB C 26.49 0.0001 1 514 132 132 GLN N N 118.85 0.01 1 515 133 133 ALA H H 7.85 0.00004 1 516 133 133 ALA C C 180.48 0.0001 1 517 133 133 ALA CB C 17.11 0.0001 1 518 133 133 ALA N N 120.78 0.01 1 519 134 134 LEU H H 7.17 0.00004 1 520 134 134 LEU C C 177.54 0.0001 1 521 134 134 LEU CA C 57.33 0.0001 1 522 134 134 LEU CB C 40.22 0.0001 1 523 134 134 LEU N N 118.46 0.01 1 524 135 135 ARG H H 6.32 0.00004 1 525 135 135 ARG C C 178.53 0.0001 1 526 135 135 ARG CA C 59.13 0.0001 1 527 135 135 ARG CB C 26.72 0.0001 1 528 135 135 ARG N N 119.45 0.01 1 529 136 136 GLU H H 7.83 0.00004 1 530 136 136 GLU C C 178.02 0.0001 1 531 136 136 GLU CA C 59.01 0.0001 1 532 136 136 GLU CB C 28.58 0.0001 1 533 136 136 GLU N N 119.34 0.01 1 534 137 137 ARG H H 7.82 0.00004 1 535 137 137 ARG C C 178.89 0.0001 1 536 137 137 ARG CA C 60.31 0.0001 1 537 137 137 ARG CB C 29.79 0.0001 1 538 137 137 ARG N N 118.28 0.01 1 539 138 138 ILE H H 7.08 0.00004 1 540 138 138 ILE C C 178.29 0.0001 1 541 138 138 ILE CA C 65.05 0.0001 1 542 138 138 ILE CB C 37.37 0.0001 1 543 138 138 ILE N N 118.14 0.01 1 544 139 139 GLU H H 7.96 0.00004 1 545 139 139 GLU C C 178.55 0.0001 1 546 139 139 GLU CA C 58.84 0.0001 1 547 139 139 GLU CB C 29.02 0.0001 1 548 139 139 GLU N N 120.08 0.01 1 549 140 140 LYS H H 7.97 0.00004 1 550 140 140 LYS C C 176.14 0.0001 1 551 140 140 LYS CA C 55.49 0.0001 1 552 140 140 LYS CB C 31.58 0.0001 1 553 140 140 LYS N N 115.57 0.01 1 554 142 142 ASP H H 8.76 0.00004 1 555 142 142 ASP C C 174.7 0.0001 1 556 142 142 ASP CA C 52.05 0.0001 1 557 142 142 ASP CB C 39.16 0.0001 1 558 142 142 ASP N N 122.89 0.01 1 559 143 143 LEU H H 6.96 0.00004 1 560 143 143 LEU C C 176.01 0.0001 1 561 143 143 LEU CA C 51.46 0.0001 1 562 143 143 LEU CB C 45.05 0.0001 1 563 143 143 LEU N N 119.43 0.01 1 564 144 144 ALA H H 8.86 0.00004 1 565 144 144 ALA C C 176.87 0.0001 1 566 144 144 ALA CA C 50.96 0.0001 1 567 144 144 ALA CB C 19.99 0.0001 1 568 144 144 ALA N N 126.2 0.01 1 569 145 145 SER H H 8.31 0.00004 1 570 145 145 SER C C 173.08 0.0001 1 571 145 145 SER CA C 56.45 0.0001 1 572 145 145 SER CB C 65.06 0.0001 1 573 145 145 SER N N 116.06 0.01 1 574 146 146 GLY H H 7.8 0.00004 1 575 146 146 GLY C C 170.29 0.0001 1 576 146 146 GLY CA C 44.28 0.0001 1 577 146 146 GLY N N 112.51 0.01 1 578 147 147 VAL H H 8.41 0.00004 1 579 147 147 VAL C C 175.65 0.0001 1 580 147 147 VAL CA C 61.63 0.0001 1 581 147 147 VAL CB C 31.13 0.0001 1 582 147 147 VAL N N 120.85 0.01 1 583 148 148 GLY H H 7.79 0.00004 1 584 148 148 GLY C C 172.5 0.0001 1 585 148 148 GLY CA C 43.19 0.0001 1 586 148 148 GLY N N 116.44 0.01 1 587 149 149 SER H H 8.42 0.00004 1 588 149 149 SER C C 171.44 0.0001 1 589 149 149 SER CA C 57.09 0.0001 1 590 149 149 SER CB C 65.44 0.0001 1 591 149 149 SER N N 114.49 0.01 1 592 150 150 VAL H H 8.37 0.00004 1 593 150 150 VAL C C 173.53 0.0001 1 594 150 150 VAL CA C 59.59 0.0001 1 595 150 150 VAL CB C 33.66 0.0001 1 596 150 150 VAL N N 120 0.01 1 597 151 151 GLU H H 8.49 0.00004 1 598 151 151 GLU C C 174.8 0.0001 1 599 151 151 GLU CA C 53.64 0.0001 1 600 151 151 GLU CB C 32.39 0.0001 1 601 151 151 GLU N N 127.46 0.01 1 602 152 152 GLN H H 8.69 0.00004 1 603 152 152 GLN C C 175.61 0.0001 1 604 152 152 GLN CA C 55.43 0.0001 1 605 152 152 GLN CB C 28.36 0.0001 1 606 152 152 GLN N N 124.63 0.01 1 607 153 153 VAL H H 8.18 0.00004 1 608 153 153 VAL C C 173.78 0.0001 1 609 153 153 VAL CA C 60.56 0.0001 1 610 153 153 VAL CB C 34.58 0.0001 1 611 153 153 VAL N N 125.56 0.01 1 612 154 154 ASP H H 8.54 0.00004 1 613 154 154 ASP C C 175.64 0.0001 1 614 154 154 ASP CA C 52.05 0.0001 1 615 154 154 ASP CB C 39.5 0.0001 1 616 154 154 ASP N N 127.31 0.01 1 617 155 155 ILE H H 8.67 0.00004 1 618 155 155 ILE C C 175.84 0.0001 1 619 155 155 ILE CA C 58.13 0.0001 1 620 155 155 ILE CB C 41.1 0.0001 1 621 155 155 ILE N N 126.88 0.01 1 622 156 156 LEU H H 8.38 0.00004 1 623 156 156 LEU C C 175.24 0.0001 1 624 156 156 LEU CA C 59.34 0.0001 1 625 156 156 LEU CB C 38.4 0.0001 1 626 156 156 LEU N N 126.93 0.01 1 627 158 158 ARG H H 7.24 0.00004 1 628 158 158 ARG C C 177.94 0.0001 1 629 158 158 ARG CA C 58.78 0.0001 1 630 158 158 ARG CB C 29.81 0.0001 1 631 158 158 ARG N N 118.96 0.01 1 632 159 159 TYR H H 7.67 0.00004 1 633 159 159 TYR C C 175.2 0.0001 1 634 159 159 TYR CA C 61.26 0.0001 1 635 159 159 TYR CB C 38.08 0.0001 1 636 159 159 TYR N N 124 0.01 1 637 160 160 PHE H H 8.62 0.00004 1 638 160 160 PHE C C 176.72 0.0001 1 639 160 160 PHE CA C 59.99 0.0001 1 640 160 160 PHE CB C 39.42 0.0001 1 641 160 160 PHE N N 118.57 0.01 1 642 161 161 LYS H H 7.84 0.00004 1 643 161 161 LYS CA C 59 0.0001 1 644 161 161 LYS CB C 31.82 0.0001 1 645 161 161 LYS N N 118.85 0.01 1 646 162 162 GLN H H 8.02 0.00004 1 647 162 162 GLN C C 179.23 0.0001 1 648 162 162 GLN CA C 58.42 0.0001 1 649 162 162 GLN CB C 26.91 0.0001 1 650 162 162 GLN N N 118.91 0.01 1 651 163 163 ILE H H 7.41 0.00004 1 652 163 163 ILE C C 177.22 0.0001 1 653 163 163 ILE CA C 65.89 0.0001 1 654 163 163 ILE CB C 36.16 0.0001 1 655 163 163 ILE N N 117.31 0.01 1 656 164 164 ARG H H 8.24 0.00004 1 657 164 164 ARG C C 178.31 0.0001 1 658 164 164 ARG CA C 58.94 0.0001 1 659 164 164 ARG CB C 28.59 0.0001 1 660 164 164 ARG N N 120.36 0.01 1 661 165 165 ASP H H 8.35 0.00004 1 662 165 165 ASP C C 176.67 0.0001 1 663 165 165 ASP CA C 55.52 0.0001 1 664 165 165 ASP CB C 39.58 0.0001 1 665 165 165 ASP N N 115.83 0.01 1 666 166 166 ASP H H 7.45 0.00004 1 667 166 166 ASP C C 174.71 0.0001 1 668 166 166 ASP CA C 54.78 0.0001 1 669 166 166 ASP CB C 44.93 0.0001 1 670 166 166 ASP N N 120.06 0.01 1 671 167 167 ILE H H 7.07 0.00004 1 672 167 167 ILE CA C 57.56 0.0001 1 673 167 167 ILE CB C 35.81 0.0001 1 674 167 167 ILE N N 119.89 0.01 1 675 168 168 ALA H H 8.8 0.00004 1 676 168 168 ALA C C 176.13 0.0001 1 677 168 168 ALA CA C 49.79 0.0001 1 678 168 168 ALA CB C 19.15 0.0001 1 679 168 168 ALA N N 132.6 0.01 1 680 169 169 MET H H 8.42 0.00004 1 681 169 169 MET C C 177.64 0.0001 1 682 169 169 MET CA C 54.15 0.0001 1 683 169 169 MET CB C 32.44 0.0001 1 684 169 169 MET N N 121.72 0.01 1 685 170 170 ALA H H 8.29 0.00004 1 686 170 170 ALA C C 176.18 0.0001 1 687 170 170 ALA CA C 52.14 0.0001 1 688 170 170 ALA CB C 18.59 0.0001 1 689 170 170 ALA N N 124.62 0.01 1 690 171 171 LYS H H 7.31 0.00004 1 691 171 171 LYS C C 172.33 0.0001 1 692 171 171 LYS CA C 53.66 0.0001 1 693 171 171 LYS CB C 31.29 0.0001 1 694 171 171 LYS N N 116.88 0.01 1 695 173 173 MET H H 6.78 0.00004 1 696 173 173 MET C C 173.51 0.0001 1 697 173 173 MET CA C 54.16 0.0001 1 698 173 173 MET CB C 37.45 0.0001 1 699 173 173 MET N N 118.14 0.01 1 700 174 174 LYS H H 9.79 0.00004 1 701 174 174 LYS C C 175.82 0.0001 1 702 174 174 LYS CA C 54.74 0.0001 1 703 174 174 LYS CB C 33 0.0001 1 704 174 174 LYS N N 126.82 0.01 1 705 175 175 VAL H H 9.02 0.00004 1 706 175 175 VAL C C 174.7 0.0001 1 707 175 175 VAL CA C 59.45 0.0001 1 708 175 175 VAL CB C 35.44 0.0001 1 709 175 175 VAL N N 126.99 0.01 1 710 176 176 VAL H H 7.9 0.00004 1 711 176 176 VAL CA C 59.94 0.0001 1 712 176 176 VAL CB C 30.69 0.0001 1 713 176 176 VAL N N 126.48 0.01 1 714 177 177 VAL H H 8.23 0.00004 1 715 177 177 VAL C C 172.38 0.0001 1 716 177 177 VAL CA C 60.12 0.0001 1 717 177 177 VAL CB C 33.35 0.0001 1 718 177 177 VAL N N 128.32 0.01 1 719 178 178 ASP H H 9.38 0.00004 1 720 178 178 ASP C C 178.77 0.0001 1 721 178 178 ASP CA C 51.12 0.0001 1 722 178 178 ASP CB C 42.83 0.0001 1 723 178 178 ASP N N 127.23 0.01 1 724 179 179 CYS H H 7.19 0.00004 1 725 179 179 CYS C C 176.73 0.0001 1 726 179 179 CYS CA C 59.84 0.0001 1 727 179 179 CYS CB C 28.28 0.0001 1 728 179 179 CYS N N 120.38 0.01 1 729 180 180 GLY H H 10.04 0.00004 1 730 180 180 GLY C C 171.02 0.0001 1 731 180 180 GLY CA C 47.81 0.0001 1 732 180 180 GLY N N 117.06 0.01 1 733 181 181 ASN H H 9.17 0.00004 1 734 181 181 ASN C C 174.85 0.0001 1 735 181 181 ASN CA C 56.28 0.0001 1 736 181 181 ASN CB C 38.64 0.0001 1 737 181 181 ASN N N 106.49 0.01 1 738 182 182 GLY H H 8.5 0.00004 1 739 182 182 GLY C C 174.63 0.0001 1 740 182 182 GLY CA C 44.02 0.0001 1 741 182 182 GLY N N 106.02 0.01 1 742 183 183 VAL H H 7.89 0.00004 1 743 183 183 VAL C C 176.11 0.0001 1 744 183 183 VAL CA C 62.82 0.0001 1 745 183 183 VAL CB C 32.05 0.0001 1 746 183 183 VAL N N 117.13 0.01 1 747 184 184 ALA H H 8.62 0.00004 1 748 184 184 ALA C C 178.55 0.0001 1 749 184 184 ALA CA C 54.82 0.0001 1 750 184 184 ALA CB C 16.35 0.0001 1 751 184 184 ALA N N 124.2 0.01 1 752 185 185 GLY H H 8.28 0.00004 1 753 185 185 GLY C C 173.51 0.0001 1 754 185 185 GLY CA C 46.5 0.0001 1 755 185 185 GLY N N 106.67 0.01 1 756 186 186 VAL H H 7.41 0.00004 1 757 186 186 VAL C C 174.9 0.0001 1 758 186 186 VAL CA C 62.03 0.0001 1 759 186 186 VAL CB C 31.41 0.0001 1 760 186 186 VAL N N 113.24 0.01 1 761 187 187 ILE H H 7.42 0.00004 1 762 187 187 ILE C C 171.9 0.0001 1 763 187 187 ILE CA C 59.61 0.0001 1 764 187 187 ILE CB C 40.43 0.0001 1 765 187 187 ILE N N 114.6 0.01 1 766 188 188 ALA H H 8.51 0.00004 1 767 188 188 ALA C C 174.52 0.0001 1 768 188 188 ALA CA C 56.69 0.0001 1 769 188 188 ALA CB C 15.45 0.0001 1 770 188 188 ALA N N 123.95 0.01 1 771 190 190 GLN H H 8.8 0.00004 1 772 190 190 GLN C C 179.59 0.0001 1 773 190 190 GLN CA C 58.96 0.0001 1 774 190 190 GLN CB C 27.04 0.0001 1 775 190 190 GLN N N 118.92 0.01 1 776 191 191 LEU H H 8.61 0.00004 1 777 191 191 LEU C C 177.24 0.0001 1 778 191 191 LEU CA C 57.26 0.0001 1 779 191 191 LEU CB C 41.04 0.0001 1 780 191 191 LEU N N 123.81 0.01 1 781 192 192 ILE H H 8.05 0.00004 1 782 192 192 ILE C C 178.17 0.0001 1 783 192 192 ILE CA C 65.19 0.0001 1 784 192 192 ILE CB C 36.4 0.0001 1 785 192 192 ILE N N 118.93 0.01 1 786 193 193 GLU H H 7.86 0.00004 1 787 193 193 GLU C C 180.46 0.0001 1 788 193 193 GLU CA C 58.45 0.0001 1 789 193 193 GLU CB C 29.2 0.0001 1 790 193 193 GLU N N 121.53 0.01 1 791 194 194 ALA H H 7.91 0.00004 1 792 194 194 ALA C C 179.14 0.0001 1 793 194 194 ALA CA C 53.97 0.0001 1 794 194 194 ALA CB C 17.87 0.0001 1 795 194 194 ALA N N 124.72 0.01 1 796 195 195 LEU H H 7.65 0.00004 1 797 195 195 LEU C C 176.75 0.0001 1 798 195 195 LEU CA C 55.35 0.0001 1 799 195 195 LEU CB C 40.75 0.0001 1 800 195 195 LEU N N 117.29 0.01 1 801 196 196 GLY H H 7.92 0.00004 1 802 196 196 GLY C C 174.67 0.0001 1 803 196 196 GLY CA C 44.19 0.0001 1 804 196 196 GLY N N 104.57 0.01 1 805 197 197 CYS H H 7.12 0.00004 1 806 197 197 CYS C C 174.39 0.0001 1 807 197 197 CYS CA C 58.59 0.0001 1 808 197 197 CYS CB C 29.37 0.0001 1 809 197 197 CYS N N 116.93 0.01 1 810 198 198 SER H H 8.53 0.00004 1 811 198 198 SER CA C 57.17 0.0001 1 812 198 198 SER CB C 63.28 0.0001 1 813 198 198 SER N N 118.49 0.01 1 814 199 199 VAL H H 8.8 0.00004 1 815 199 199 VAL C C 175.49 0.0001 1 816 199 199 VAL CA C 60.64 0.0001 1 817 199 199 VAL CB C 33.46 0.0001 1 818 199 199 VAL N N 127.01 0.01 1 819 200 200 ILE H H 8.63 0.00004 1 820 200 200 ILE C C 173.49 0.0001 1 821 200 200 ILE CA C 56.5 0.0001 1 822 200 200 ILE CB C 37.67 0.0001 1 823 200 200 ILE N N 131.09 0.01 1 824 202 202 LEU H H 9.02 0.00004 1 825 202 202 LEU C C 174.25 0.0001 1 826 202 202 LEU CA C 53.06 0.0001 1 827 202 202 LEU CB C 44.22 0.0001 1 828 202 202 LEU N N 127.49 0.01 1 829 203 203 TYR H H 8.97 0.00004 1 830 203 203 TYR C C 176.89 0.0001 1 831 203 203 TYR CA C 55.68 0.0001 1 832 203 203 TYR CB C 33.19 0.0001 1 833 203 203 TYR N N 124.18 0.01 1 834 204 204 CYS H H 8.62 0.00004 1 835 204 204 CYS C C 174.19 0.0001 1 836 204 204 CYS CB C 27.32 0.0001 1 837 204 204 CYS N N 114.91 0.01 1 838 205 205 GLU H H 8.07 0.00004 1 839 205 205 GLU C C 176.41 0.0001 1 840 205 205 GLU CA C 56.05 0.0001 1 841 205 205 GLU CB C 28.24 0.0001 1 842 205 205 GLU N N 121.57 0.01 1 843 206 206 VAL H H 8.6 0.00004 1 844 206 206 VAL CA C 63.53 0.0001 1 845 206 206 VAL CB C 29.8 0.0001 1 846 206 206 VAL N N 127.89 0.01 1 847 207 207 ASP H H 8.39 0.00004 1 848 207 207 ASP CA C 53.09 0.0001 1 849 207 207 ASP CB C 41.66 0.0001 1 850 207 207 ASP N N 129.08 0.01 1 851 208 208 GLY H H 8.88 0.00004 1 852 208 208 GLY C C 173.1 0.0001 1 853 208 208 GLY CA C 45.8 0.0001 1 854 208 208 GLY N N 112.76 0.01 1 855 209 209 ASN H H 8.59 0.00004 1 856 209 209 ASN C C 174.89 0.0001 1 857 209 209 ASN CB C 38.56 0.0001 1 858 209 209 ASN N N 117.53 0.01 1 859 210 210 PHE H H 8.12 0.00004 1 860 210 210 PHE C C 172.91 0.0001 1 861 210 210 PHE CB C 36.52 0.0001 1 862 210 210 PHE N N 117.53 0.01 1 863 212 212 ASN H H 7.75 0.00004 1 864 212 212 ASN C C 174.18 0.0001 1 865 212 212 ASN CB C 39.04 0.0001 1 866 212 212 ASN N N 117.53 0.01 1 867 213 213 HIS H H 7.49 0.00004 1 868 213 213 HIS C C 173.52 0.0001 1 869 213 213 HIS CB C 29.02 0.0001 1 870 213 213 HIS N N 117.53 0.01 1 871 216 216 ASP H H 6.84 0.00004 1 872 216 216 ASP C C 178.81 0.0001 1 873 216 216 ASP CA C 56.84 0.0001 1 874 216 216 ASP CB C 39.37 0.0001 1 875 216 216 ASP N N 123.55 0.01 1 876 218 218 GLY H H 7.79 0.00004 1 877 218 218 GLY C C 173.76 0.0001 1 878 218 218 GLY CA C 45.03 0.0001 1 879 218 218 GLY N N 105.96 0.01 1 880 219 219 LYS H H 6.75 0.00004 1 881 219 219 LYS C C 175.14 0.0001 1 882 219 219 LYS CA C 51.62 0.0001 1 883 219 219 LYS CB C 32.13 0.0001 1 884 219 219 LYS N N 120.96 0.01 1 885 222 222 ASN H H 7.72 0.00004 1 886 222 222 ASN C C 175.47 0.0001 1 887 222 222 ASN CA C 53.34 0.0001 1 888 222 222 ASN CB C 37.14 0.0001 1 889 222 222 ASN N N 117.29 0.01 1 890 223 223 LEU H H 7.52 0.00004 1 891 223 223 LEU CA C 53.39 0.0001 1 892 223 223 LEU CB C 41.04 0.0001 1 893 223 223 LEU N N 119.73 0.01 1 894 224 224 LYS H H 6.74 0.00004 1 895 224 224 LYS C C 178.69 0.0001 1 896 224 224 LYS CA C 59.99 0.0001 1 897 224 224 LYS CB C 31.58 0.0001 1 898 224 224 LYS N N 121.58 0.01 1 899 225 225 ASP H H 8.59 0.00004 1 900 225 225 ASP C C 178.42 0.0001 1 901 225 225 ASP CA C 56.95 0.0001 1 902 225 225 ASP CB C 39.11 0.0001 1 903 225 225 ASP N N 122.6 0.01 1 904 226 226 LEU H H 8.53 0.00004 1 905 226 226 LEU C C 177.26 0.0001 1 906 226 226 LEU CA C 57.59 0.0001 1 907 226 226 LEU CB C 40.66 0.0001 1 908 226 226 LEU N N 125.57 0.01 1 909 227 227 ILE H H 8.37 0.00004 1 910 227 227 ILE CA C 66.05 0.0001 1 911 227 227 ILE CB C 38.04 0.0001 1 912 227 227 ILE N N 120.26 0.01 1 913 228 228 ALA H H 7.68 0.00004 1 914 228 228 ALA C C 180.61 0.0001 1 915 228 228 ALA CA C 54.39 0.0001 1 916 228 228 ALA CB C 17.17 0.0001 1 917 228 228 ALA N N 119.77 0.01 1 918 229 229 LYS H H 8.13 0.00004 1 919 229 229 LYS C C 177.98 0.0001 1 920 229 229 LYS CA C 56.88 0.0001 1 921 229 229 LYS CB C 31.11 0.0001 1 922 229 229 LYS N N 121.5 0.01 1 923 230 230 VAL H H 8.59 0.00004 1 924 230 230 VAL CA C 66.11 0.0001 1 925 230 230 VAL CB C 30.94 0.0001 1 926 230 230 VAL N N 120.87 0.01 1 927 231 231 LYS H H 7.44 0.00004 1 928 231 231 LYS C C 180 0.0001 1 929 231 231 LYS CA C 58.82 0.0001 1 930 231 231 LYS CB C 31.08 0.0001 1 931 231 231 LYS N N 116.62 0.01 1 932 232 232 ALA H H 8.24 0.00004 1 933 232 232 ALA C C 179.76 0.0001 1 934 232 232 ALA CA C 54.49 0.0001 1 935 232 232 ALA CB C 18.2 0.0001 1 936 232 232 ALA N N 122.61 0.01 1 937 233 233 GLU H H 7.81 0.00004 1 938 233 233 GLU C C 175.59 0.0001 1 939 233 233 GLU CA C 54.33 0.0001 1 940 233 233 GLU CB C 28.27 0.0001 1 941 233 233 GLU N N 113.25 0.01 1 942 234 234 ASN H H 7.73 0.00004 1 943 234 234 ASN C C 175.31 0.0001 1 944 234 234 ASN CA C 53.82 0.0001 1 945 234 234 ASN CB C 36.79 0.0001 1 946 234 234 ASN N N 118.89 0.01 1 947 235 235 ALA H H 8.35 0.00004 1 948 235 235 ALA C C 175.5 0.0001 1 949 235 235 ALA CA C 51.19 0.0001 1 950 235 235 ALA CB C 19.48 0.0001 1 951 235 235 ALA N N 118.81 0.01 1 952 236 236 ASP H H 8.92 0.00004 1 953 236 236 ASP C C 176.54 0.0001 1 954 236 236 ASP CA C 56.54 0.0001 1 955 236 236 ASP CB C 42.11 0.0001 1 956 236 236 ASP N N 116.81 0.01 1 957 237 237 LEU H H 7.66 0.00004 1 958 237 237 LEU C C 173.51 0.0001 1 959 237 237 LEU CA C 54.09 0.0001 1 960 237 237 LEU CB C 45.46 0.0001 1 961 237 237 LEU N N 117.55 0.01 1 962 238 238 GLY H H 9 0.00004 1 963 238 238 GLY C C 170.34 0.0001 1 964 238 238 GLY CA C 44.1 0.0001 1 965 238 238 GLY N N 111.14 0.01 1 966 239 239 LEU H H 8.74 0.00004 1 967 239 239 LEU C C 173.8 0.0001 1 968 239 239 LEU CA C 52.08 0.0001 1 969 239 239 LEU CB C 45.53 0.0001 1 970 239 239 LEU N N 124.01 0.01 1 971 240 240 ALA H H 8.57 0.00004 1 972 240 240 ALA C C 175.39 0.0001 1 973 240 240 ALA CA C 48.34 0.0001 1 974 240 240 ALA CB C 21.53 0.0001 1 975 240 240 ALA N N 124.42 0.01 1 976 241 241 PHE H H 7.98 0.00004 1 977 241 241 PHE C C 175.77 0.0001 1 978 241 241 PHE CA C 57.1 0.0001 1 979 241 241 PHE CB C 42.49 0.0001 1 980 241 241 PHE N N 119.72 0.01 1 981 244 244 ASP H H 8.14 0.00004 1 982 244 244 ASP C C 176.43 0.0001 1 983 244 244 ASP CA C 51.55 0.0001 1 984 244 244 ASP CB C 38.64 0.0001 1 985 244 244 ASP N N 112.19 0.01 1 986 245 245 GLY H H 8.1 0.00004 1 987 245 245 GLY C C 172.76 0.0001 1 988 245 245 GLY CA C 46.09 0.0001 1 989 245 245 GLY N N 109.76 0.01 1 990 246 246 ASP H H 8.68 0.00004 1 991 246 246 ASP C C 173.6 0.0001 1 992 246 246 ASP CA C 53.52 0.0001 1 993 246 246 ASP CB C 38.68 0.0001 1 994 246 246 ASP N N 117.59 0.01 1 995 247 247 ARG H H 7.73 0.00004 1 996 247 247 ARG C C 173.71 0.0001 1 997 247 247 ARG CA C 54.64 0.0001 1 998 247 247 ARG CB C 34.41 0.0001 1 999 247 247 ARG N N 118.11 0.01 1 1000 248 248 VAL H H 7.97 0.00004 1 1001 248 248 VAL C C 172.75 0.0001 1 1002 248 248 VAL CA C 57.98 0.0001 1 1003 248 248 VAL CB C 35.24 0.0001 1 1004 248 248 VAL N N 120.75 0.01 1 1005 249 249 GLY H H 9.09 0.00004 1 1006 249 249 GLY C C 171.67 0.0001 1 1007 249 249 GLY CA C 43.02 0.0001 1 1008 249 249 GLY N N 114.86 0.01 1 1009 250 250 VAL H H 8.02 0.00004 1 1010 250 250 VAL C C 173.79 0.0001 1 1011 250 250 VAL CA C 60.77 0.0001 1 1012 250 250 VAL CB C 34.59 0.0001 1 1013 250 250 VAL N N 122.68 0.01 1 1014 251 251 VAL H H 8.44 0.00004 1 1015 251 251 VAL C C 175.82 0.0001 1 1016 251 251 VAL CA C 57.79 0.0001 1 1017 251 251 VAL CB C 34.31 0.0001 1 1018 251 251 VAL N N 121.81 0.01 1 1019 252 252 THR H H 8.49 0.00004 1 1020 252 252 THR C C 174.72 0.0001 1 1021 252 252 THR CA C 60.41 0.0001 1 1022 252 252 THR CB C 70.44 0.0001 1 1023 252 252 THR N N 113.42 0.01 1 1024 253 253 ASN H H 8.6 0.00004 1 1025 253 253 ASN C C 175.41 0.0001 1 1026 253 253 ASN CA C 55.95 0.0001 1 1027 253 253 ASN CB C 36.54 0.0001 1 1028 253 253 ASN N N 113.73 0.01 1 1029 254 254 THR H H 7.41 0.00004 1 1030 254 254 THR CA C 60.86 0.0001 1 1031 254 254 THR CB C 67.67 0.0001 1 1032 254 254 THR N N 107.91 0.01 1 1033 255 255 GLY H H 7.93 0.00004 1 1034 255 255 GLY C C 172.21 0.0001 1 1035 255 255 GLY CA C 44.87 0.0001 1 1036 255 255 GLY N N 111.56 0.01 1 1037 256 256 THR H H 7.2 0.00004 1 1038 256 256 THR C C 174.13 0.0001 1 1039 256 256 THR CA C 62.66 0.0001 1 1040 256 256 THR CB C 66.92 0.0001 1 1041 256 256 THR N N 119.65 0.01 1 1042 257 257 ILE H H 8.28 0.00004 1 1043 257 257 ILE C C 174.54 0.0001 1 1044 257 257 ILE CA C 62.01 0.0001 1 1045 257 257 ILE CB C 37.72 0.0001 1 1046 257 257 ILE N N 128.66 0.01 1 1047 258 258 ILE H H 7.97 0.00004 1 1048 258 258 ILE C C 175.68 0.0001 1 1049 258 258 ILE CA C 56.07 0.0001 1 1050 258 258 ILE CB C 33.92 0.0001 1 1051 258 258 ILE N N 130.2 0.01 1 1052 259 259 TYR H H 8.49 0.00004 1 1053 259 259 TYR C C 174.05 0.0001 1 1054 259 259 TYR CA C 57.35 0.0001 1 1055 259 259 TYR CB C 36.03 0.0001 1 1056 259 259 TYR N N 129.52 0.01 1 1057 261 261 ASP H H 8.53 0.00004 1 1058 261 261 ASP C C 176.53 0.0001 1 1059 261 261 ASP CA C 55.81 0.0001 1 1060 261 261 ASP CB C 38.08 0.0001 1 1061 261 261 ASP N N 114.74 0.01 1 1062 262 262 ARG H H 7.35 0.00004 1 1063 262 262 ARG C C 178.51 0.0001 1 1064 262 262 ARG CA C 57.87 0.0001 1 1065 262 262 ARG CB C 29.01 0.0001 1 1066 262 262 ARG N N 123.99 0.01 1 1067 263 263 LEU H H 7.57 0.00004 1 1068 263 263 LEU C C 178.27 0.0001 1 1069 263 263 LEU CA C 57.61 0.0001 1 1070 263 263 LEU CB C 39.94 0.0001 1 1071 263 263 LEU N N 120.79 0.01 1 1072 264 264 LEU H H 8.1 0.00004 1 1073 264 264 LEU C C 178.16 0.0001 1 1074 264 264 LEU CA C 57.05 0.0001 1 1075 264 264 LEU CB C 40.48 0.0001 1 1076 264 264 LEU N N 117.79 0.01 1 1077 265 265 MET H H 7.28 0.00004 1 1078 265 265 MET C C 176.19 0.0001 1 1079 265 265 MET CA C 59.74 0.0001 1 1080 265 265 MET CB C 31.05 0.0001 1 1081 265 265 MET N N 118.54 0.01 1 1082 266 266 LEU H H 6.66 0.00004 1 1083 266 266 LEU C C 179.41 0.0001 1 1084 266 266 LEU CA C 57.53 0.0001 1 1085 266 266 LEU CB C 41.03 0.0001 1 1086 266 266 LEU N N 119.42 0.01 1 1087 267 267 PHE H H 7.82 0.00004 1 1088 267 267 PHE C C 177.53 0.0001 1 1089 267 267 PHE CA C 57.62 0.0001 1 1090 267 267 PHE CB C 38.38 0.0001 1 1091 267 267 PHE N N 117.23 0.01 1 1092 268 268 ALA H H 9.37 0.00004 1 1093 268 268 ALA C C 178.15 0.0001 1 1094 268 268 ALA CA C 54.81 0.0001 1 1095 268 268 ALA CB C 17.21 0.0001 1 1096 268 268 ALA N N 122.1 0.01 1 1097 269 269 LYS H H 7.76 0.00004 1 1098 269 269 LYS CA C 59.58 0.0001 1 1099 269 269 LYS CB C 31.37 0.0001 1 1100 269 269 LYS N N 118.99 0.01 1 1101 270 270 ASP H H 7.2 0.00004 1 1102 270 270 ASP C C 177.47 0.0001 1 1103 270 270 ASP CA C 57.89 0.0001 1 1104 270 270 ASP CB C 43.15 0.0001 1 1105 270 270 ASP N N 119.11 0.01 1 1106 271 271 VAL H H 8.68 0.00004 1 1107 271 271 VAL C C 179.61 0.0001 1 1108 271 271 VAL CA C 66.38 0.0001 1 1109 271 271 VAL CB C 31.47 0.0001 1 1110 271 271 VAL N N 118.58 0.01 1 1111 272 272 VAL H H 8.93 0.00004 1 1112 272 272 VAL C C 177.63 0.0001 1 1113 272 272 VAL CA C 64.77 0.0001 1 1114 272 272 VAL CB C 29.89 0.0001 1 1115 272 272 VAL N N 119.18 0.01 1 1116 273 273 SER H H 7.4 0.00004 1 1117 273 273 SER CA C 61.82 0.0001 1 1118 273 273 SER CB C 62.57 0.0001 1 1119 273 273 SER N N 115.92 0.01 1 1120 274 274 ARG H H 6.65 0.00004 1 1121 274 274 ARG C C 175.31 0.0001 1 1122 274 274 ARG CA C 56.31 0.0001 1 1123 274 274 ARG CB C 32.02 0.0001 1 1124 274 274 ARG N N 118.25 0.01 1 1125 275 275 ASN H H 7.43 0.00004 1 1126 275 275 ASN C C 169.18 0.0001 1 1127 275 275 ASN CA C 50.3 0.0001 1 1128 275 275 ASN CB C 40.67 0.0001 1 1129 275 275 ASN N N 119.04 0.01 1 1130 277 277 GLY H H 8.15 0.00004 1 1131 277 277 GLY CA C 44.72 0.0001 1 1132 277 277 GLY N N 112.16 0.01 1 1133 278 278 ALA H H 7.47 0.00004 1 1134 278 278 ALA C C 176.07 0.0001 1 1135 278 278 ALA CA C 52.5 0.0001 1 1136 278 278 ALA CB C 19.15 0.0001 1 1137 278 278 ALA N N 122.16 0.01 1 1138 279 279 ASP H H 8.2 0.00004 1 1139 279 279 ASP C C 175.75 0.0001 1 1140 279 279 ASP CA C 53.74 0.0001 1 1141 279 279 ASP CB C 41.06 0.0001 1 1142 279 279 ASP N N 121.6 0.01 1 1143 280 280 ILE H H 8.03 0.00004 1 1144 280 280 ILE C C 174.65 0.0001 1 1145 280 280 ILE CA C 57.72 0.0001 1 1146 280 280 ILE CB C 38.37 0.0001 1 1147 280 280 ILE N N 121.85 0.01 1 1148 281 281 ILE H H 7.9 0.00004 1 1149 281 281 ILE C C 174.05 0.0001 1 1150 281 281 ILE CA C 58.63 0.0001 1 1151 281 281 ILE CB C 38.53 0.0001 1 1152 281 281 ILE N N 121.85 0.01 1 1153 282 282 PHE H H 7.81 0.00004 1 1154 282 282 PHE C C 173.86 0.0001 1 1155 282 282 PHE CA C 54.51 0.0001 1 1156 282 282 PHE CB C 39.41 0.0001 1 1157 282 282 PHE N N 123.49 0.01 1 1158 283 283 ASP H H 7.52 0.00004 1 1159 283 283 ASP C C 177.66 0.0001 1 1160 283 283 ASP CA C 52.73 0.0001 1 1161 283 283 ASP CB C 43.56 0.0001 1 1162 283 283 ASP N N 118.14 0.01 1 1163 289 289 ARG H H 8.62 0.00004 1 1164 289 289 ARG CA C 56.72 0.0001 1 1165 289 289 ARG N N 121.88 0.01 1 1166 290 290 LEU H H 7.23 0.00004 1 1167 290 290 LEU C C 177.11 0.0001 1 1168 290 290 LEU CA C 57.85 0.0001 1 1169 290 290 LEU CB C 40.71 0.0001 1 1170 290 290 LEU N N 120.45 0.01 1 1171 291 291 ILE H H 6.82 0.00004 1 1172 291 291 ILE C C 177.65 0.0001 1 1173 291 291 ILE CA C 65.36 0.0001 1 1174 291 291 ILE CB C 37.21 0.0001 1 1175 291 291 ILE N N 118.98 0.01 1 1176 292 292 ALA H H 7.08 0.00004 1 1177 292 292 ALA C C 180.61 0.0001 1 1178 292 292 ALA CA C 53.92 0.0001 1 1179 292 292 ALA CB C 17.72 0.0001 1 1180 292 292 ALA N N 120.27 0.01 1 1181 293 293 LEU H H 7.56 0.00004 1 1182 293 293 LEU C C 178.25 0.0001 1 1183 293 293 LEU CA C 57.55 0.0001 1 1184 293 293 LEU CB C 41.59 0.0001 1 1185 293 293 LEU N N 120.46 0.01 1 1186 294 294 ILE H H 7.93 0.00004 1 1187 294 294 ILE C C 178.42 0.0001 1 1188 294 294 ILE CA C 65.61 0.0001 1 1189 294 294 ILE CB C 37.23 0.0001 1 1190 294 294 ILE N N 118.16 0.01 1 1191 295 295 SER H H 7.97 0.00004 1 1192 295 295 SER CA C 61.25 0.0001 1 1193 295 295 SER N N 114.87 0.01 1 1194 296 296 GLY H H 8.24 0.00004 1 1195 296 296 GLY C C 175.56 0.0001 1 1196 296 296 GLY CA C 46.3 0.0001 1 1197 296 296 GLY N N 112.94 0.01 1 1198 297 297 TYR H H 7.39 0.00004 1 1199 297 297 TYR CA C 57.77 0.0001 1 1200 297 297 TYR CB C 37.99 0.0001 1 1201 297 297 TYR N N 117.94 0.01 1 1202 298 298 GLY H H 7.84 0.00004 1 1203 298 298 GLY CA C 45.09 0.0001 1 1204 298 298 GLY N N 107.01 0.01 1 1205 299 299 GLY H H 8.24 0.00004 1 1206 299 299 GLY C C 171.31 0.0001 1 1207 299 299 GLY CA C 43.14 0.0001 1 1208 299 299 GLY N N 110.29 0.01 1 1209 300 300 ARG H H 8.64 0.00004 1 1210 300 300 ARG C C 173.05 0.0001 1 1211 300 300 ARG CA C 52.4 0.0001 1 1212 300 300 ARG CB C 30.82 0.0001 1 1213 300 300 ARG N N 121.89 0.01 1 1214 302 302 VAL H H 8.82 0.00004 1 1215 302 302 VAL C C 172.18 0.0001 1 1216 302 302 VAL CA C 61.06 0.0001 1 1217 302 302 VAL CB C 32.17 0.0001 1 1218 302 302 VAL N N 129.44 0.01 1 1219 303 303 MET H H 7.8 0.00004 1 1220 303 303 MET C C 175.55 0.0001 1 1221 303 303 MET CA C 54.45 0.0001 1 1222 303 303 MET CB C 33.21 0.0001 1 1223 303 303 MET N N 127.7 0.01 1 1224 304 304 TRP H H 8.97 0.00004 1 1225 304 304 TRP C C 173.02 0.0001 1 1226 304 304 TRP CA C 53.18 0.0001 1 1227 304 304 TRP N N 127.38 0.01 1 1228 307 307 GLY H H 8.42 0.00004 1 1229 307 307 GLY CA C 44.1 0.0001 1 1230 307 307 GLY N N 110.51 0.01 1 1231 310 310 LEU H H 6.84 0.00004 1 1232 310 310 LEU C C 178.81 0.0001 1 1233 310 310 LEU CA C 56.84 0.0001 1 1234 310 310 LEU CB C 39.31 0.0001 1 1235 310 310 LEU N N 121.59 0.01 1 1236 311 311 ILE H H 7.93 0.00004 1 1237 311 311 ILE C C 177.14 0.0001 1 1238 311 311 ILE CA C 62.83 0.0001 1 1239 311 311 ILE CB C 34.85 0.0001 1 1240 311 311 ILE N N 124.28 0.01 1 1241 312 312 LYS H H 7.75 0.00004 1 1242 312 312 LYS C C 178.74 0.0001 1 1243 312 312 LYS CA C 59.6 0.0001 1 1244 312 312 LYS CB C 30.98 0.0001 1 1245 312 312 LYS N N 120.31 0.01 1 1246 313 313 LYS H H 7.43 0.00004 1 1247 313 313 LYS C C 178.13 0.0001 1 1248 313 313 LYS CA C 59.05 0.0001 1 1249 313 313 LYS CB C 31.63 0.0001 1 1250 313 313 LYS N N 119.64 0.01 1 1251 314 314 LYS H H 7.53 0.00004 1 1252 314 314 LYS C C 179.58 0.0001 1 1253 314 314 LYS CA C 56 0.0001 1 1254 314 314 LYS CB C 30.73 0.0001 1 1255 314 314 LYS N N 121.36 0.01 1 1256 315 315 MET H H 8.37 0.00004 1 1257 315 315 MET C C 178.02 0.0001 1 1258 315 315 MET CA C 58.89 0.0001 1 1259 315 315 MET N N 121.96 0.01 1 1260 317 317 GLU H H 7.89 0.00004 1 1261 317 317 GLU CA C 58.46 0.0001 1 1262 317 317 GLU CB C 29.83 0.0001 1 1263 317 317 GLU N N 118.48 0.01 1 1264 318 318 THR H H 7.44 0.00004 1 1265 318 318 THR C C 176.26 0.0001 1 1266 318 318 THR CA C 61.68 0.0001 1 1267 318 318 THR CB C 71.37 0.0001 1 1268 318 318 THR N N 105.4 0.01 1 1269 319 319 GLY H H 7.8 0.00004 1 1270 319 319 GLY C C 174.68 0.0001 1 1271 319 319 GLY CA C 45.41 0.0001 1 1272 319 319 GLY N N 111.25 0.01 1 1273 320 320 ALA H H 7.37 0.00004 1 1274 320 320 ALA C C 177.15 0.0001 1 1275 320 320 ALA CA C 52.24 0.0001 1 1276 320 320 ALA CB C 18.85 0.0001 1 1277 320 320 ALA N N 122.03 0.01 1 1278 321 321 LEU H H 7.72 0.00004 1 1279 321 321 LEU C C 176.79 0.0001 1 1280 321 321 LEU CA C 55.9 0.0001 1 1281 321 321 LEU CB C 43.05 0.0001 1 1282 321 321 LEU N N 116.8 0.01 1 1283 322 322 LEU H H 7.28 0.00004 1 1284 322 322 LEU C C 172.48 0.0001 1 1285 322 322 LEU CA C 53.09 0.0001 1 1286 322 322 LEU CB C 45.02 0.0001 1 1287 322 322 LEU N N 121.27 0.01 1 1288 323 323 ALA H H 8.68 0.00004 1 1289 323 323 ALA C C 175.84 0.0001 1 1290 323 323 ALA CA C 49.29 0.0001 1 1291 323 323 ALA CB C 23.93 0.0001 1 1292 323 323 ALA N N 126.72 0.01 1 1293 324 324 GLY H H 8.46 0.00004 1 1294 324 324 GLY C C 169.32 0.0001 1 1295 324 324 GLY CA C 45.58 0.0001 1 1296 324 324 GLY N N 106.83 0.01 1 1297 325 325 GLU H H 7.99 0.00004 1 1298 325 325 GLU C C 178.01 0.0001 1 1299 325 325 GLU CA C 53.81 0.0001 1 1300 325 325 GLU CB C 32.07 0.0001 1 1301 325 325 GLU N N 114.33 0.01 1 1302 328 328 GLY H H 8.27 0.00004 1 1303 328 328 GLY C C 173.43 0.0001 1 1304 328 328 GLY CA C 44.86 0.0001 1 1305 328 328 GLY N N 108.03 0.01 1 1306 329 329 HIS H H 8.09 0.00004 1 1307 329 329 HIS C C 173.49 0.0001 1 1308 329 329 HIS CA C 57.14 0.0001 1 1309 329 329 HIS CB C 28.86 0.0001 1 1310 329 329 HIS N N 122.86 0.01 1 1311 330 330 VAL H H 8.75 0.00004 1 1312 330 330 VAL C C 174.67 0.0001 1 1313 330 330 VAL CA C 62.03 0.0001 1 1314 330 330 VAL CB C 32.64 0.0001 1 1315 330 330 VAL N N 125.55 0.01 1 1316 331 331 PHE H H 9.29 0.00004 1 1317 331 331 PHE C C 174.15 0.0001 1 1318 331 331 PHE CA C 55.12 0.0001 1 1319 331 331 PHE CB C 40.17 0.0001 1 1320 331 331 PHE N N 127.44 0.01 1 1321 332 332 PHE H H 9.33 0.00004 1 1322 332 332 PHE CA C 58.8 0.0001 1 1323 332 332 PHE CB C 39.87 0.0001 1 1324 332 332 PHE N N 123.5 0.01 1 1325 333 333 LYS H H 8.13 0.00004 1 1326 333 333 LYS CA C 55.62 0.0001 1 1327 333 333 LYS CB C 33 0.0001 1 1328 333 333 LYS N N 123.78 0.01 1 1329 334 334 GLU H H 7.6 0.00004 1 1330 334 334 GLU C C 176.12 0.0001 1 1331 334 334 GLU CA C 57.77 0.0001 1 1332 334 334 GLU CB C 28.2 0.0001 1 1333 334 334 GLU N N 122.68 0.01 1 1334 335 335 ARG H H 8.86 0.00004 1 1335 335 335 ARG C C 174.02 0.0001 1 1336 335 335 ARG CA C 58.5 0.0001 1 1337 335 335 ARG CB C 27.89 0.0001 1 1338 335 335 ARG N N 122.9 0.01 1 1339 336 336 TRP H H 7.77 0.00004 1 1340 336 336 TRP C C 176.46 0.0001 1 1341 336 336 TRP CB C 31.62 0.0001 1 1342 336 336 TRP N N 122.17 0.01 1 1343 337 337 PHE H H 6.36 0.00004 1 1344 337 337 PHE C C 177.06 0.0001 1 1345 337 337 PHE CA C 57.77 0.0001 1 1346 337 337 PHE CB C 43.1 0.0001 1 1347 337 337 PHE N N 119.67 0.01 1 1348 338 338 GLY H H 8.51 0.00004 1 1349 338 338 GLY C C 171.98 0.0001 1 1350 338 338 GLY CA C 45.28 0.0001 1 1351 338 338 GLY N N 107.84 0.01 1 1352 339 339 PHE H H 6.13 0.00004 1 1353 339 339 PHE C C 172.79 0.0001 1 1354 339 339 PHE CA C 53.81 0.0001 1 1355 339 339 PHE CB C 39.79 0.0001 1 1356 339 339 PHE N N 111.12 0.01 1 1357 342 342 GLY H H 8.54 0.00004 1 1358 342 342 GLY C C 174.05 0.0001 1 1359 342 342 GLY CA C 46.75 0.0001 1 1360 342 342 GLY N N 116.36 0.01 1 1361 343 343 ILE H H 8.56 0.00004 1 1362 343 343 ILE C C 177.54 0.0001 1 1363 343 343 ILE CA C 65.3 0.0001 1 1364 343 343 ILE CB C 35 0.0001 1 1365 343 343 ILE N N 126.64 0.01 1 1366 344 344 TYR H H 8.82 0.00004 1 1367 344 344 TYR C C 177.61 0.0001 1 1368 344 344 TYR CA C 61.24 0.0001 1 1369 344 344 TYR CB C 37.31 0.0001 1 1370 344 344 TYR N N 123.21 0.01 1 1371 345 345 SER H H 7.82 0.00004 1 1372 345 345 SER C C 179.03 0.0001 1 1373 345 345 SER CA C 62.6 0.0001 1 1374 345 345 SER N N 112.75 0.01 1 1375 347 347 ALA H H 7.74 0.00004 1 1376 347 347 ALA C C 178.59 0.0001 1 1377 347 347 ALA CA C 54.8 0.0001 1 1378 347 347 ALA CB C 16.5 0.0001 1 1379 347 347 ALA N N 121.25 0.01 1 1380 348 348 ARG H H 8 0.00004 1 1381 348 348 ARG C C 180.13 0.0001 1 1382 348 348 ARG CA C 55.07 0.0001 1 1383 348 348 ARG CB C 26.65 0.0001 1 1384 348 348 ARG N N 117.19 0.01 1 1385 349 349 LEU H H 8.51 0.00004 1 1386 349 349 LEU C C 177.49 0.0001 1 1387 349 349 LEU CA C 57.69 0.0001 1 1388 349 349 LEU CB C 40.14 0.0001 1 1389 349 349 LEU N N 123.21 0.01 1 1390 350 350 LEU H H 8.23 0.00004 1 1391 350 350 LEU C C 178.5 0.0001 1 1392 350 350 LEU CA C 57.76 0.0001 1 1393 350 350 LEU CB C 39.39 0.0001 1 1394 350 350 LEU N N 121.33 0.01 1 1395 351 351 GLU H H 8.02 0.00004 1 1396 351 351 GLU C C 179.5 0.0001 1 1397 351 351 GLU CA C 60.2 0.0001 1 1398 351 351 GLU CB C 29.71 0.0001 1 1399 351 351 GLU N N 120.75 0.01 1 1400 352 352 ILE H H 7.48 0.00004 1 1401 352 352 ILE C C 179.71 0.0001 1 1402 352 352 ILE CA C 65.02 0.0001 1 1403 352 352 ILE CB C 38.51 0.0001 1 1404 352 352 ILE N N 120.22 0.01 1 1405 353 353 LEU H H 8.79 0.00004 1 1406 353 353 LEU C C 180.43 0.0001 1 1407 353 353 LEU CA C 57.08 0.0001 1 1408 353 353 LEU CB C 40.29 0.0001 1 1409 353 353 LEU N N 120.09 0.01 1 1410 354 354 SER H H 8.59 0.00004 1 1411 354 354 SER C C 174.19 0.0001 1 1412 354 354 SER CA C 60.61 0.0001 1 1413 354 354 SER CB C 62.2 0.0001 1 1414 354 354 SER N N 114.84 0.01 1 1415 355 355 GLN H H 7.07 0.00004 1 1416 355 355 GLN C C 174.47 0.0001 1 1417 355 355 GLN CA C 55.25 0.0001 1 1418 355 355 GLN CB C 28.48 0.0001 1 1419 355 355 GLN N N 119.96 0.01 1 1420 356 356 ASP H H 7.56 0.00004 1 1421 356 356 ASP C C 175.06 0.0001 1 1422 356 356 ASP CA C 52.29 0.0001 1 1423 356 356 ASP CB C 44.38 0.0001 1 1424 356 356 ASP N N 124.33 0.01 1 1425 357 357 GLN H H 8.34 0.00004 1 1426 357 357 GLN C C 177.26 0.0001 1 1427 357 357 GLN CA C 56.52 0.0001 1 1428 357 357 GLN CB C 28.38 0.0001 1 1429 357 357 GLN N N 123.65 0.01 1 1430 358 358 ARG H H 9.04 0.00004 1 1431 358 358 ARG C C 175.31 0.0001 1 1432 358 358 ARG CA C 54.9 0.0001 1 1433 358 358 ARG CB C 30.93 0.0001 1 1434 358 358 ARG N N 122.16 0.01 1 1435 359 359 ASP H H 8.03 0.00004 1 1436 359 359 ASP C C 176.1 0.0001 1 1437 359 359 ASP CA C 52.28 0.0001 1 1438 359 359 ASP CB C 40 0.0001 1 1439 359 359 ASP N N 118.03 0.01 1 1440 360 360 SER H H 9.72 0.00004 1 1441 360 360 SER CA C 61.77 0.0001 1 1442 360 360 SER CB C 62.93 0.0001 1 1443 360 360 SER N N 117.25 0.01 1 1444 361 361 GLU H H 8.63 0.00004 1 1445 361 361 GLU C C 179.24 0.0001 1 1446 361 361 GLU CA C 58.51 0.0001 1 1447 361 361 GLU CB C 28.24 0.0001 1 1448 361 361 GLU N N 124.21 0.01 1 1449 362 362 HIS H H 8.38 0.00004 1 1450 362 362 HIS C C 177.79 0.0001 1 1451 362 362 HIS CA C 59.68 0.0001 1 1452 362 362 HIS CB C 28.13 0.0001 1 1453 362 362 HIS N N 119.3 0.01 1 1454 363 363 VAL H H 8.32 0.00004 1 1455 363 363 VAL C C 178.4 0.0001 1 1456 363 363 VAL CA C 66.49 0.0001 1 1457 363 363 VAL CB C 30.4 0.0001 1 1458 363 363 VAL N N 122.25 0.01 1 1459 364 364 PHE H H 7.69 0.00004 1 1460 364 364 PHE C C 178.51 0.0001 1 1461 364 364 PHE CA C 62.37 0.0001 1 1462 364 364 PHE CB C 38.66 0.0001 1 1463 364 364 PHE N N 113.8 0.01 1 1464 365 365 SER H H 8.35 0.00004 1 1465 365 365 SER CA C 60.01 0.0001 1 1466 365 365 SER CB C 62.02 0.0001 1 1467 365 365 SER N N 116.47 0.01 1 1468 366 366 ALA H H 6.8 0.00004 1 1469 366 366 ALA C C 178.29 0.0001 1 1470 366 366 ALA CA C 52.42 0.0001 1 1471 366 366 ALA CB C 17.91 0.0001 1 1472 366 366 ALA N N 122.65 0.01 1 1473 367 367 PHE H H 7.03 0.00004 1 1474 367 367 PHE C C 173.35 0.0001 1 1475 367 367 PHE CA C 54.97 0.0001 1 1476 367 367 PHE CB C 37.53 0.0001 1 1477 367 367 PHE N N 118.24 0.01 1 1478 369 369 SER H H 8.33 0.00004 1 1479 369 369 SER C C 173.27 0.0001 1 1480 369 369 SER CA C 57.04 0.0001 1 1481 369 369 SER CB C 64.72 0.0001 1 1482 369 369 SER N N 116.86 0.01 1 1483 370 370 ASP H H 8.17 0.00004 1 1484 370 370 ASP C C 175.37 0.0001 1 1485 370 370 ASP CA C 53.47 0.0001 1 1486 370 370 ASP CB C 42.49 0.0001 1 1487 370 370 ASP N N 124.47 0.01 1 1488 371 371 ILE H H 8.54 0.00004 1 1489 371 371 ILE C C 174.66 0.0001 1 1490 371 371 ILE CA C 60.52 0.0001 1 1491 371 371 ILE CB C 37.21 0.0001 1 1492 371 371 ILE N N 122.17 0.01 1 1493 372 372 SER H H 8.22 0.00004 1 1494 372 372 SER CA C 55.95 0.0001 1 1495 372 372 SER CB C 65.76 0.0001 1 1496 372 372 SER N N 119.2 0.01 1 1497 373 373 THR H H 8.16 0.00004 1 1498 373 373 THR C C 173.31 0.0001 1 1499 373 373 THR CB C 68.89 0.0001 1 1500 373 373 THR N N 114.24 0.01 1 1501 375 375 GLU H H 8.2 0.00004 1 1502 375 375 GLU CA C 57.37 0.0001 1 1503 375 375 GLU CB C 28.94 0.0001 1 1504 375 375 GLU N N 119.98 0.01 1 1505 376 376 ILE H H 8.93 0.00004 1 1506 376 376 ILE C C 174.53 0.0001 1 1507 376 376 ILE CA C 60.09 0.0001 1 1508 376 376 ILE CB C 40.22 0.0001 1 1509 376 376 ILE N N 129.03 0.01 1 1510 377 377 ASN H H 8.58 0.00004 1 1511 377 377 ASN C C 174.94 0.0001 1 1512 377 377 ASN CA C 51.48 0.0001 1 1513 377 377 ASN CB C 40.76 0.0001 1 1514 377 377 ASN N N 125.74 0.01 1 1515 378 378 ILE H H 9.16 0.00004 1 1516 378 378 ILE C C 175.38 0.0001 1 1517 378 378 ILE CA C 60.1 0.0001 1 1518 378 378 ILE CB C 40.11 0.0001 1 1519 378 378 ILE N N 123.11 0.01 1 1520 379 379 THR H H 8.74 0.00004 1 1521 379 379 THR C C 173.79 0.0001 1 1522 379 379 THR CA C 64.39 0.0001 1 1523 379 379 THR CB C 68.38 0.0001 1 1524 379 379 THR N N 126.53 0.01 1 1525 380 380 VAL H H 8.31 0.00004 1 1526 380 380 VAL C C 174.13 0.0001 1 1527 380 380 VAL CA C 58.7 0.0001 1 1528 380 380 VAL CB C 32.17 0.0001 1 1529 380 380 VAL N N 123.21 0.01 1 1530 381 381 THR H H 7.48 0.00004 1 1531 381 381 THR C C 175.67 0.0001 1 1532 381 381 THR CA C 59.94 0.0001 1 1533 381 381 THR CB C 70.93 0.0001 1 1534 381 381 THR N N 111.16 0.01 1 1535 383 383 ASP H H 8.17 0.00004 1 1536 383 383 ASP C C 177.92 0.0001 1 1537 383 383 ASP CA C 55.51 0.0001 1 1538 383 383 ASP CB C 40.19 0.0001 1 1539 383 383 ASP N N 114.51 0.01 1 1540 384 384 SER H H 7.75 0.00004 1 1541 384 384 SER C C 175.89 0.0001 1 1542 384 384 SER CA C 59.28 0.0001 1 1543 384 384 SER CB C 64.1 0.0001 1 1544 384 384 SER N N 115.44 0.01 1 1545 385 385 LYS H H 7.49 0.00004 1 1546 385 385 LYS C C 175.79 0.0001 1 1547 385 385 LYS CA C 60.25 0.0001 1 1548 385 385 LYS CB C 31.22 0.0001 1 1549 385 385 LYS N N 122.71 0.01 1 1550 386 386 PHE H H 7.57 0.00004 1 1551 386 386 PHE C C 178.32 0.0001 1 1552 386 386 PHE CA C 60.13 0.0001 1 1553 386 386 PHE CB C 37.27 0.0001 1 1554 386 386 PHE N N 115.61 0.01 1 1555 387 387 ALA H H 7.61 0.00004 1 1556 387 387 ALA C C 181.16 0.0001 1 1557 387 387 ALA CA C 54.54 0.0001 1 1558 387 387 ALA CB C 17.26 0.0001 1 1559 387 387 ALA N N 125.43 0.01 1 1560 388 388 ILE H H 8.45 0.00004 1 1561 388 388 ILE C C 177.37 0.0001 1 1562 388 388 ILE CA C 64.83 0.0001 1 1563 388 388 ILE CB C 37.12 0.0001 1 1564 388 388 ILE N N 120.74 0.01 1 1565 389 389 ILE H H 6.9 0.00004 1 1566 389 389 ILE C C 177.84 0.0001 1 1567 389 389 ILE CA C 62.06 0.0001 1 1568 389 389 ILE CB C 34.41 0.0001 1 1569 389 389 ILE N N 118.58 0.01 1 1570 390 390 GLU H H 8.14 0.00004 1 1571 390 390 GLU C C 178.89 0.0001 1 1572 390 390 GLU CA C 59.29 0.0001 1 1573 390 390 GLU CB C 28.65 0.0001 1 1574 390 390 GLU N N 120.41 0.01 1 1575 391 391 ALA H H 7.96 0.00004 1 1576 391 391 ALA C C 180.8 0.0001 1 1577 391 391 ALA CA C 54.81 0.0001 1 1578 391 391 ALA CB C 17.98 0.0001 1 1579 391 391 ALA N N 122.27 0.01 1 1580 392 392 LEU H H 8.32 0.00004 1 1581 392 392 LEU C C 178.4 0.0001 1 1582 392 392 LEU CA C 56.93 0.0001 1 1583 392 392 LEU CB C 41.8 0.0001 1 1584 392 392 LEU N N 119.56 0.01 1 1585 393 393 GLN H H 8.09 0.00004 1 1586 393 393 GLN C C 177.02 0.0001 1 1587 393 393 GLN CA C 57.75 0.0001 1 1588 393 393 GLN CB C 27.97 0.0001 1 1589 393 393 GLN N N 116.4 0.01 1 1590 394 394 ARG H H 7.83 0.00004 1 1591 394 394 ARG CB C 31.65 0.0001 1 1592 394 394 ARG N N 118.49 0.01 1 1593 395 395 ASP H H 8.45 0.00004 1 1594 395 395 ASP C C 176.7 0.0001 1 1595 395 395 ASP CA C 54.96 0.0001 1 1596 395 395 ASP CB C 42.42 0.0001 1 1597 395 395 ASP N N 118.24 0.01 1 1598 396 396 ALA H H 7.31 0.00004 1 1599 396 396 ALA C C 175.87 0.0001 1 1600 396 396 ALA CA C 52.09 0.0001 1 1601 396 396 ALA CB C 19.4 0.0001 1 1602 396 396 ALA N N 123.03 0.01 1 1603 397 397 GLN H H 7.26 0.00004 1 1604 397 397 GLN C C 175.38 0.0001 1 1605 397 397 GLN CA C 53.77 0.0001 1 1606 397 397 GLN CB C 29.13 0.0001 1 1607 397 397 GLN N N 119.44 0.01 1 1608 398 398 TRP H H 8.27 0.00004 1 1609 398 398 TRP C C 178.48 0.0001 1 1610 398 398 TRP CA C 55.67 0.0001 1 1611 398 398 TRP CB C 29.38 0.0001 1 1612 398 398 TRP N N 122.18 0.01 1 1613 399 399 GLY H H 8.66 0.00004 1 1614 399 399 GLY C C 174.78 0.0001 1 1615 399 399 GLY CA C 46.05 0.0001 1 1616 399 399 GLY N N 113.45 0.01 1 1617 401 401 GLY H H 7.73 0.00004 1 1618 401 401 GLY C C 171.5 0.0001 1 1619 401 401 GLY CA C 44.62 0.0001 1 1620 401 401 GLY N N 109.68 0.01 1 1621 402 402 ASN H H 8.51 0.00004 1 1622 402 402 ASN C C 175.13 0.0001 1 1623 402 402 ASN CA C 52.05 0.0001 1 1624 402 402 ASN CB C 39.65 0.0001 1 1625 402 402 ASN N N 121.21 0.01 1 1626 403 403 ILE H H 8.9 0.00004 1 1627 403 403 ILE C C 175.47 0.0001 1 1628 403 403 ILE CA C 60.75 0.0001 1 1629 403 403 ILE CB C 38.93 0.0001 1 1630 403 403 ILE N N 129.78 0.01 1 1631 404 404 THR H H 9.44 0.00004 1 1632 404 404 THR C C 175.61 0.0001 1 1633 404 404 THR CA C 62.05 0.0001 1 1634 404 404 THR CB C 69.9 0.0001 1 1635 404 404 THR N N 125.65 0.01 1 1636 406 406 LEU H H 6.48 0.00004 1 1637 406 406 LEU C C 176.31 0.0001 1 1638 406 406 LEU CA C 56.25 0.0001 1 1639 406 406 LEU CB C 42.54 0.0001 1 1640 406 406 LEU N N 121.32 0.01 1 1641 407 407 ASP H H 7.86 0.00004 1 1642 407 407 ASP C C 174.99 0.0001 1 1643 407 407 ASP CA C 53.31 0.0001 1 1644 407 407 ASP CB C 40.57 0.0001 1 1645 407 407 ASP N N 118.08 0.01 1 1646 408 408 GLY H H 8.37 0.00004 1 1647 408 408 GLY C C 173.41 0.0001 1 1648 408 408 GLY CA C 45 0.0001 1 1649 408 408 GLY N N 114.02 0.01 1 1650 409 409 VAL H H 9.04 0.00004 1 1651 409 409 VAL C C 173.19 0.0001 1 1652 409 409 VAL CA C 61.48 0.0001 1 1653 409 409 VAL CB C 33.34 0.0001 1 1654 409 409 VAL N N 123.28 0.01 1 1655 410 410 ARG H H 8.59 0.00004 1 1656 410 410 ARG C C 174.08 0.0001 1 1657 410 410 ARG CA C 53.08 0.0001 1 1658 410 410 ARG CB C 31.79 0.0001 1 1659 410 410 ARG N N 129.7 0.01 1 1660 411 411 VAL H H 9.11 0.00004 1 1661 411 411 VAL C C 174.25 0.0001 1 1662 411 411 VAL CA C 60.58 0.0001 1 1663 411 411 VAL CB C 32.4 0.0001 1 1664 411 411 VAL N N 127.67 0.01 1 1665 412 412 ASP H H 8.6 0.00004 1 1666 412 412 ASP C C 175.01 0.0001 1 1667 412 412 ASP CA C 53.85 0.0001 1 1668 412 412 ASP CB C 43.34 0.0001 1 1669 412 412 ASP N N 125.94 0.01 1 1670 413 413 TYR H H 9.62 0.00004 1 1671 413 413 TYR C C 174.41 0.0001 1 1672 413 413 TYR CA C 56.73 0.0001 1 1673 413 413 TYR CB C 37.22 0.0001 1 1674 413 413 TYR N N 125.42 0.01 1 1675 415 415 LYS H H 8.37 0.00004 1 1676 415 415 LYS C C 175.11 0.0001 1 1677 415 415 LYS CA C 54.55 0.0001 1 1678 415 415 LYS CB C 31.9 0.0001 1 1679 415 415 LYS N N 112.27 0.01 1 1680 416 416 GLY H H 7.38 0.00004 1 1681 416 416 GLY C C 170.11 0.0001 1 1682 416 416 GLY CA C 46.88 0.0001 1 1683 416 416 GLY N N 105.74 0.01 1 1684 417 417 TRP H H 9.67 0.00004 1 1685 417 417 TRP C C 173.48 0.0001 1 1686 417 417 TRP CA C 55.34 0.0001 1 1687 417 417 TRP CB C 31.61 0.0001 1 1688 417 417 TRP N N 118.31 0.01 1 1689 418 418 GLY H H 8.61 0.00004 1 1690 418 418 GLY C C 171.02 0.0001 1 1691 418 418 GLY CA C 44.85 0.0001 1 1692 418 418 GLY N N 102.98 0.01 1 1693 419 419 LEU H H 7.74 0.00004 1 1694 419 419 LEU C C 174.18 0.0001 1 1695 419 419 LEU CA C 53.07 0.0001 1 1696 419 419 LEU CB C 47.04 0.0001 1 1697 419 419 LEU N N 123.32 0.01 1 1698 420 420 VAL H H 8.96 0.00004 1 1699 420 420 VAL C C 172.55 0.0001 1 1700 420 420 VAL CA C 59.08 0.0001 1 1701 420 420 VAL CB C 33.33 0.0001 1 1702 420 420 VAL N N 123.54 0.01 1 1703 421 421 ARG H H 8.81 0.00004 1 1704 421 421 ARG C C 174.04 0.0001 1 1705 421 421 ARG CA C 53.88 0.0001 1 1706 421 421 ARG CB C 32.68 0.0001 1 1707 421 421 ARG N N 124.17 0.01 1 1708 422 422 ALA H H 9.08 0.00004 1 1709 422 422 ALA C C 177.11 0.0001 1 1710 422 422 ALA CA C 50.52 0.0001 1 1711 422 422 ALA CB C 18.46 0.0001 1 1712 422 422 ALA N N 125.36 0.01 1 1713 423 423 SER H H 8.16 0.00004 1 1714 423 423 SER CA C 56.96 0.0001 1 1715 423 423 SER CB C 63.28 0.0001 1 1716 423 423 SER N N 116.21 0.01 1 1717 428 428 VAL H H 7.84 0.00004 1 1718 428 428 VAL C C 175.44 0.0001 1 1719 428 428 VAL CA C 59.38 0.0001 1 1720 428 428 VAL CB C 36.08 0.0001 1 1721 428 428 VAL N N 118.92 0.01 1 1722 429 429 LEU H H 8.82 0.00004 1 1723 429 429 LEU C C 175.21 0.0001 1 1724 429 429 LEU CA C 52.56 0.0001 1 1725 429 429 LEU CB C 43.02 0.0001 1 1726 429 429 LEU N N 122.34 0.01 1 1727 430 430 VAL H H 9.12 0.00004 1 1728 430 430 VAL C C 176.12 0.0001 1 1729 430 430 VAL CA C 60.59 0.0001 1 1730 430 430 VAL CB C 32.74 0.0001 1 1731 430 430 VAL N N 122.84 0.01 1 1732 431 431 LEU H H 9.31 0.00004 1 1733 431 431 LEU C C 175.27 0.0001 1 1734 431 431 LEU CA C 54.18 0.0001 1 1735 431 431 LEU CB C 44.21 0.0001 1 1736 431 431 LEU N N 128.52 0.01 1 1737 432 432 ARG H H 7.25 0.00004 1 1738 432 432 ARG C C 171.52 0.0001 1 1739 432 432 ARG CA C 55.52 0.0001 1 1740 432 432 ARG CB C 33.53 0.0001 1 1741 432 432 ARG N N 118.3 0.01 1 1742 433 433 PHE H H 7.14 0.00004 1 1743 433 433 PHE C C 173.62 0.0001 1 1744 433 433 PHE CA C 55.19 0.0001 1 1745 433 433 PHE CB C 42.9 0.0001 1 1746 433 433 PHE N N 118.44 0.01 1 1747 434 434 GLU H H 7.85 0.00004 1 1748 434 434 GLU C C 173.7 0.0001 1 1749 434 434 GLU CA C 54.55 0.0001 1 1750 434 434 GLU CB C 32.69 0.0001 1 1751 434 434 GLU N N 120.64 0.01 1 1752 435 435 ALA H H 8.86 0.00004 1 1753 435 435 ALA C C 176.34 0.0001 1 1754 435 435 ALA CA C 51.2 0.0001 1 1755 435 435 ALA CB C 22.89 0.0001 1 1756 435 435 ALA N N 122.35 0.01 1 1757 436 436 ASP H H 8.57 0.00004 1 1758 436 436 ASP C C 176.75 0.0001 1 1759 436 436 ASP CA C 56.05 0.0001 1 1760 436 436 ASP CB C 40.59 0.0001 1 1761 436 436 ASP N N 117.85 0.01 1 1762 437 437 THR H H 7.31 0.00004 1 1763 437 437 THR C C 174.65 0.0001 1 1764 437 437 THR CA C 58.34 0.0001 1 1765 437 437 THR CB C 73.31 0.0001 1 1766 437 437 THR N N 106.47 0.01 1 1767 438 438 GLU H H 9.23 0.00004 1 1768 438 438 GLU C C 178.59 0.0001 1 1769 438 438 GLU CA C 59.48 0.0001 1 1770 438 438 GLU CB C 28.4 0.0001 1 1771 438 438 GLU N N 123.42 0.01 1 1772 439 439 GLU H H 8.69 0.00004 1 1773 439 439 GLU C C 179.27 0.0001 1 1774 439 439 GLU CA C 59.43 0.0001 1 1775 439 439 GLU CB C 28.31 0.0001 1 1776 439 439 GLU N N 120.3 0.01 1 1777 440 440 GLU H H 7.72 0.00004 1 1778 440 440 GLU CA C 57.28 0.0001 1 1779 440 440 GLU CB C 27.88 0.0001 1 1780 440 440 GLU N N 122.87 0.01 1 1781 441 441 LEU H H 8.04 0.00004 1 1782 441 441 LEU C C 178.51 0.0001 1 1783 441 441 LEU CA C 57.81 0.0001 1 1784 441 441 LEU CB C 40.86 0.0001 1 1785 441 441 LEU N N 123.05 0.01 1 1786 442 442 GLU H H 7.82 0.00004 1 1787 442 442 GLU C C 179.11 0.0001 1 1788 442 442 GLU CA C 57.97 0.0001 1 1789 442 442 GLU CB C 27.94 0.0001 1 1790 442 442 GLU N N 117.23 0.01 1 1791 443 443 ARG H H 7.67 0.00004 1 1792 443 443 ARG CA C 59.58 0.0001 1 1793 443 443 ARG CB C 29.25 0.0001 1 1794 443 443 ARG N N 123.78 0.01 1 1795 444 444 ILE H H 8.21 0.00004 1 1796 444 444 ILE C C 178.32 0.0001 1 1797 444 444 ILE CA C 65.52 0.0001 1 1798 444 444 ILE CB C 37.33 0.0001 1 1799 444 444 ILE N N 121.79 0.01 1 1800 445 445 LYS H H 8.24 0.00004 1 1801 445 445 LYS CA C 60.2 0.0001 1 1802 445 445 LYS CB C 31.4 0.0001 1 1803 445 445 LYS N N 120.32 0.01 1 1804 446 446 THR H H 7.95 0.00004 1 1805 446 446 THR C C 175.64 0.0001 1 1806 446 446 THR CA C 66.61 0.0001 1 1807 446 446 THR CB C 68.01 0.0001 1 1808 446 446 THR N N 117.03 0.01 1 1809 447 447 VAL H H 7.86 0.00004 1 1810 447 447 VAL C C 179.5 0.0001 1 1811 447 447 VAL CB C 31.04 0.0001 1 1812 447 447 VAL N N 123.15 0.01 1 1813 448 448 PHE H H 8.48 0.00004 1 1814 448 448 PHE C C 177.94 0.0001 1 1815 448 448 PHE CA C 62.8 0.0001 1 1816 448 448 PHE CB C 39.31 0.0001 1 1817 448 448 PHE N N 119.44 0.01 1 1818 449 449 ARG H H 9.4 0.00004 1 1819 449 449 ARG CA C 60.18 0.0001 1 1820 449 449 ARG CB C 29.48 0.0001 1 1821 449 449 ARG N N 122.33 0.01 1 1822 450 450 ASN H H 8.32 0.00004 1 1823 450 450 ASN CB C 36.81 0.0001 1 1824 450 450 ASN N N 116.63 0.01 1 1825 451 451 GLN H H 8.22 0.00004 1 1826 451 451 GLN CA C 57.15 0.0001 1 1827 451 451 GLN CB C 26.72 0.0001 1 1828 451 451 GLN N N 120.42 0.01 1 1829 452 452 LEU H H 8.37 0.00004 1 1830 452 452 LEU C C 178.09 0.0001 1 1831 452 452 LEU CA C 58.29 0.0001 1 1832 452 452 LEU CB C 40.53 0.0001 1 1833 452 452 LEU N N 120.76 0.01 1 1834 453 453 LYS H H 7.79 0.00004 1 1835 453 453 LYS C C 178.02 0.0001 1 1836 453 453 LYS CA C 57.02 0.0001 1 1837 453 453 LYS CB C 31.12 0.0001 1 1838 453 453 LYS N N 116.32 0.01 1 1839 454 454 ALA H H 7.28 0.00004 1 1840 454 454 ALA C C 179.67 0.0001 1 1841 454 454 ALA CA C 53.56 0.0001 1 1842 454 454 ALA CB C 17.25 0.0001 1 1843 454 454 ALA N N 119.92 0.01 1 1844 455 455 VAL H H 7.26 0.00004 1 1845 455 455 VAL C C 176.65 0.0001 1 1846 455 455 VAL CA C 63.65 0.0001 1 1847 455 455 VAL CB C 31 0.0001 1 1848 455 455 VAL N N 116.9 0.01 1 1849 456 456 ASP H H 7.72 0.00004 1 1850 456 456 ASP C C 175.69 0.0001 1 1851 456 456 ASP CA C 53.77 0.0001 1 1852 456 456 ASP CB C 40.77 0.0001 1 1853 456 456 ASP N N 119.63 0.01 1 1854 457 457 SER H H 8.59 0.00004 1 1855 457 457 SER CA C 60.3 0.0001 1 1856 457 457 SER CB C 62.56 0.0001 1 1857 457 457 SER N N 122.05 0.01 1 1858 458 458 SER H H 8.74 0.00004 1 1859 458 458 SER C C 174.88 0.0001 1 1860 458 458 SER CA C 58.45 0.0001 1 1861 458 458 SER CB C 63.93 0.0001 1 1862 458 458 SER N N 119.38 0.01 1 1863 459 459 LEU H H 7.27 0.00004 1 1864 459 459 LEU C C 175.5 0.0001 1 1865 459 459 LEU CA C 53.01 0.0001 1 1866 459 459 LEU CB C 41.98 0.0001 1 1867 459 459 LEU N N 127.33 0.01 1 stop_ save_ save_PMM(S108C)_assigned_chem_shift_list1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '2D 1H-15N TROSY' '3D TROSY-HNCO' '3D TROSY-HNCA' '3D TROSY-HN(CO)CA' '3D TROSY-HNCACB' '3D TROSY-HNCACO' stop_ loop_ _Sample_label $PMM_PGM(S108C)_sample stop_ _Sample_conditions_label $PMM(S108C)_sample_conditions_1 _Chem_shift_reference_set_label $PMM(S108C)_chemical_shift_reference _Mol_system_component_name Monomer _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 19 19 ILE H H 7.92 0.00004 1 2 19 19 ILE C C 172.96 0.0001 1 3 19 19 ILE CA C 59.08 0.0001 1 4 19 19 ILE CB C 40.43 0.0001 1 5 19 19 ILE N N 116.49 0.01 1 6 21 21 GLY H H 8.52 0.00004 1 7 21 21 GLY C C 169.46 0.0001 1 8 21 21 GLY CA C 44.76 0.0001 1 9 21 21 GLY N N 109.54 0.01 1 10 22 22 VAL H H 7.35 0.00004 1 11 22 22 VAL C C 177.16 0.0001 1 12 22 22 VAL CA C 61.58 0.0001 1 13 22 22 VAL CB C 28.15 0.0001 1 14 22 22 VAL N N 120.16 0.01 1 15 23 23 VAL H H 9.13 0.00004 1 16 23 23 VAL C C 177.55 0.0001 1 17 23 23 VAL CA C 63.55 0.0001 1 18 23 23 VAL CB C 29.54 0.0001 1 19 23 23 VAL N N 133.95 0.01 1 20 24 24 GLY H H 8.39 0.00004 1 21 24 24 GLY C C 172.55 0.0001 1 22 24 24 GLY CA C 44.52 0.0001 1 23 24 24 GLY N N 116.55 0.01 1 24 27 27 LEU H H 7.57 0.00004 1 25 27 27 LEU C C 173.97 0.0001 1 26 27 27 LEU CA C 53.47 0.0001 1 27 27 27 LEU CB C 43.38 0.0001 1 28 27 27 LEU N N 123.39 0.01 1 29 28 28 THR H H 8.12 0.00004 1 30 28 28 THR C C 174.71 0.0001 1 31 28 28 THR CA C 58.57 0.0001 1 32 28 28 THR CB C 72.22 0.0001 1 33 28 28 THR N N 116.42 0.01 1 34 37 37 ARG H H 7.98 0.00004 1 35 37 37 ARG C C 179.68 0.0001 1 36 37 37 ARG CA C 55.95 0.0001 1 37 37 37 ARG CB C 27.4 0.0001 1 38 37 37 ARG N N 121.63 0.01 1 39 50 50 CYS H H 8.97 0.00004 1 40 50 50 CYS C C 173.15 0.0001 1 41 50 50 CYS CA C 58.55 0.0001 1 42 50 50 CYS CB C 27.43 0.0001 1 43 50 50 CYS N N 121.53 0.01 1 44 51 51 VAL H H 7.65 0.00004 1 45 51 51 VAL C C 174.35 0.0001 1 46 51 51 VAL CA C 59.12 0.0001 1 47 51 51 VAL CB C 35.6 0.0001 1 48 51 51 VAL N N 121.41 0.01 1 49 52 52 ALA H H 8.1 0.00004 1 50 52 52 ALA C C 176.4 0.0001 1 51 52 52 ALA CA C 49.99 0.0001 1 52 52 52 ALA CB C 19.44 0.0001 1 53 52 52 ALA N N 130.79 0.01 1 54 53 53 VAL H H 8.63 0.00004 1 55 53 53 VAL C C 173.29 0.0001 1 56 53 53 VAL CA C 60.45 0.0001 1 57 53 53 VAL CB C 35.01 0.0001 1 58 53 53 VAL N N 121.03 0.01 1 59 54 54 GLY H H 8.39 0.00004 1 60 54 54 GLY CA C 43.42 0.0001 1 61 54 54 GLY N N 112.43 0.01 1 62 59 59 LEU H H 9.61 0.00004 1 63 59 59 LEU C C 178.38 0.0001 1 64 59 59 LEU CA C 57.08 0.0001 1 65 59 59 LEU CB C 40.58 0.0001 1 66 59 59 LEU N N 123.65 0.01 1 67 63 63 GLU H H 7.83 0.00004 1 68 63 63 GLU CA C 58.34 0.0001 1 69 63 63 GLU CB C 29.1 0.0001 1 70 63 63 GLU N N 116.53 0.01 1 71 65 65 VAL H H 9.17 0.00004 1 72 65 65 VAL C C 176.41 0.0001 1 73 65 65 VAL CA C 64.96 0.0001 1 74 65 65 VAL CB C 29.72 0.0001 1 75 65 65 VAL N N 121.85 0.01 1 76 66 66 LYS H H 6.85 0.00004 1 77 66 66 LYS C C 179.51 0.0001 1 78 66 66 LYS CA C 58.78 0.0001 1 79 66 66 LYS CB C 31.63 0.0001 1 80 66 66 LYS N N 121.69 0.01 1 81 71 71 GLY H H 8.53 0.00004 1 82 71 71 GLY C C 174.73 0.0001 1 83 71 71 GLY CA C 46.82 0.0001 1 84 71 71 GLY N N 108.3 0.01 1 85 73 73 VAL H H 9.06 0.00004 1 86 73 73 VAL C C 180.21 0.0001 1 87 73 73 VAL CA C 66.57 0.0001 1 88 73 73 VAL CB C 30.66 0.0001 1 89 73 73 VAL N N 124.76 0.01 1 90 81 81 ASP H H 9.16 0.00004 1 91 81 81 ASP C C 177.25 0.0001 1 92 81 81 ASP CA C 52.49 0.0001 1 93 81 81 ASP CB C 40.39 0.0001 1 94 81 81 ASP N N 127.39 0.01 1 95 84 84 MET H H 8.19 0.00004 1 96 84 84 MET C C 174.67 0.0001 1 97 84 84 MET CA C 53.82 0.0001 1 98 84 84 MET CB C 32.39 0.0001 1 99 84 84 MET N N 126.26 0.01 1 100 89 89 VAL H H 7.08 0.00004 1 101 89 89 VAL CA C 64.27 0.0001 1 102 89 89 VAL N N 118.08 0.01 1 103 90 90 LEU H H 6.93 0.00004 1 104 90 90 LEU C C 180.03 0.0001 1 105 90 90 LEU CA C 55.34 0.0001 1 106 90 90 LEU CB C 38.98 0.0001 1 107 90 90 LEU N N 125.87 0.01 1 108 92 92 TYR H H 8.36 0.00004 1 109 92 92 TYR CA C 61.56 0.0001 1 110 92 92 TYR CB C 37.63 0.0001 1 111 92 92 TYR N N 122.99 0.01 1 112 93 93 ALA H H 8.42 0.00004 1 113 93 93 ALA C C 177.3 0.0001 1 114 93 93 ALA CA C 55.04 0.0001 1 115 93 93 ALA CB C 16.91 0.0001 1 116 93 93 ALA N N 125.63 0.01 1 117 96 96 VAL H H 7.19 0.00004 1 118 96 96 VAL C C 176.97 0.0001 1 119 96 96 VAL CA C 61.36 0.0001 1 120 96 96 VAL CB C 31.8 0.0001 1 121 96 96 VAL N N 111.59 0.01 1 122 97 97 LEU H H 7.76 0.00004 1 123 97 97 LEU CA C 53.79 0.0001 1 124 97 97 LEU CB C 39.37 0.0001 1 125 97 97 LEU N N 122.62 0.01 1 126 99 99 GLY H H 7.99 0.00004 1 127 99 99 GLY C C 175.31 0.0001 1 128 99 99 GLY CA C 46.35 0.0001 1 129 99 99 GLY N N 105.45 0.01 1 130 101 101 SER H H 6.93 0.00004 1 131 101 101 SER C C 173.62 0.0001 1 132 101 101 SER CA C 55.7 0.0001 1 133 101 101 SER CB C 65.73 0.0001 1 134 101 101 SER N N 115.05 0.01 1 135 103 103 VAL H H 9.24 0.00004 1 136 103 103 VAL C C 171.93 0.0001 1 137 103 103 VAL CB C 34.07 0.0001 1 138 103 103 VAL N N 122.74 0.01 1 139 104 104 MET H H 8.95 0.00004 1 140 104 104 MET CA C 51.85 0.0001 1 141 104 104 MET N N 127.42 0.01 1 142 114 114 TYR H H 8.02 0.00004 1 143 114 114 TYR CA C 57.18 0.0001 1 144 114 114 TYR CB C 39.77 0.0001 1 145 114 114 TYR N N 119.17 0.01 1 146 115 115 ASN H H 8.74 0.00004 1 147 115 115 ASN C C 172.76 0.0001 1 148 115 115 ASN CA C 51.39 0.0001 1 149 115 115 ASN CB C 40.95 0.0001 1 150 115 115 ASN N N 118.91 0.01 1 151 119 119 ILE H H 8.41 0.00004 1 152 119 119 ILE N N 122.38 0.01 1 153 121 121 VAL H H 9.06 0.00004 1 154 121 121 VAL C C 175.63 0.0001 1 155 121 121 VAL CA C 59.53 0.0001 1 156 121 121 VAL N N 125.45 0.01 1 157 122 122 ALA H H 9.14 0.00004 1 158 122 122 ALA C C 176.53 0.0001 1 159 122 122 ALA CA C 52.43 0.0001 1 160 122 122 ALA CB C 17.18 0.0001 1 161 122 122 ALA N N 132.11 0.01 1 162 123 123 GLY H H 7.6 0.00004 1 163 123 123 GLY CA C 44.71 0.0001 1 164 123 123 GLY N N 102.81 0.01 1 165 126 126 LEU H H 8.38 0.00004 1 166 126 126 LEU C C 176.43 0.0001 1 167 126 126 LEU CA C 55.24 0.0001 1 168 126 126 LEU CB C 41.33 0.0001 1 169 126 126 LEU N N 128.01 0.01 1 170 127 127 ALA H H 8.23 0.00004 1 171 127 127 ALA C C 177.59 0.0001 1 172 127 127 ALA CA C 50.53 0.0001 1 173 127 127 ALA CB C 23.35 0.0001 1 174 127 127 ALA N N 122.34 0.01 1 175 128 128 ASN H H 10.24 0.00004 1 176 128 128 ASN C C 177.88 0.0001 1 177 128 128 ASN CA C 55.25 0.0001 1 178 128 128 ASN CB C 37.55 0.0001 1 179 128 128 ASN N N 119.33 0.01 1 180 132 132 GLN H H 7.18 0.00004 1 181 132 132 GLN C C 178 0.0001 1 182 132 132 GLN CB C 26.46 0.0001 1 183 132 132 GLN N N 118.86 0.01 1 184 135 135 ARG H H 6.4 0.00004 1 185 135 135 ARG CA C 59.12 0.0001 1 186 135 135 ARG CB C 26.88 0.0001 1 187 135 135 ARG N N 119.45 0.01 1 188 142 142 ASP H H 8.66 0.00004 1 189 142 142 ASP C C 174.79 0.0001 1 190 142 142 ASP CA C 51.95 0.0001 1 191 142 142 ASP N N 122.96 0.01 1 192 143 143 LEU H H 6.99 0.00004 1 193 143 143 LEU C C 176.15 0.0001 1 194 143 143 LEU CA C 51.51 0.0001 1 195 143 143 LEU N N 119.2 0.01 1 196 144 144 ALA H H 8.78 0.00004 1 197 144 144 ALA C C 176.86 0.0001 1 198 144 144 ALA CA C 50.88 0.0001 1 199 144 144 ALA CB C 20.03 0.0001 1 200 144 144 ALA N N 126.03 0.01 1 201 153 153 VAL H H 8.15 0.00004 1 202 153 153 VAL C C 173.76 0.0001 1 203 153 153 VAL CA C 60.54 0.0001 1 204 153 153 VAL CB C 34.61 0.0001 1 205 153 153 VAL N N 125.43 0.01 1 206 155 155 ILE H H 8.79 0.00004 1 207 155 155 ILE CA C 58.04 0.0001 1 208 155 155 ILE CB C 39.94 0.0001 1 209 155 155 ILE N N 126.62 0.01 1 210 156 156 LEU H H 8.28 0.00004 1 211 156 156 LEU C C 175.16 0.0001 1 212 156 156 LEU CA C 59.34 0.0001 1 213 156 156 LEU CB C 38.54 0.0001 1 214 156 156 LEU N N 126.97 0.01 1 215 163 163 ILE H H 7.48 0.00004 1 216 163 163 ILE CA C 65.85 0.0001 1 217 163 163 ILE N N 117.3 0.01 1 218 165 165 ASP H H 8.31 0.00004 1 219 165 165 ASP CA C 55.53 0.0001 1 220 165 165 ASP CB C 39.57 0.0001 1 221 165 165 ASP N N 115.71 0.01 1 222 177 177 VAL H H 8.28 0.00004 1 223 177 177 VAL C C 172.41 0.0001 1 224 177 177 VAL CA C 60.04 0.0001 1 225 177 177 VAL CB C 33.36 0.0001 1 226 177 177 VAL N N 128.21 0.01 1 227 180 180 GLY H H 10.02 0.00004 1 228 180 180 GLY CA C 47.79 0.0001 1 229 180 180 GLY N N 117.03 0.01 1 230 181 181 ASN H H 9.34 0.00004 1 231 181 181 ASN C C 175.12 0.0001 1 232 181 181 ASN CA C 56.27 0.0001 1 233 181 181 ASN CB C 38.69 0.0001 1 234 181 181 ASN N N 107.5 0.01 1 235 182 182 GLY H H 8.45 0.00004 1 236 182 182 GLY CA C 43.99 0.0001 1 237 182 182 GLY N N 105.57 0.01 1 238 183 183 VAL H H 7.92 0.00004 1 239 183 183 VAL C C 176.11 0.0001 1 240 183 183 VAL CA C 62.79 0.0001 1 241 183 183 VAL CB C 32.13 0.0001 1 242 183 183 VAL N N 117.19 0.01 1 243 185 185 GLY H H 8.32 0.00004 1 244 185 185 GLY C C 173.5 0.0001 1 245 185 185 GLY CA C 46.52 0.0001 1 246 185 185 GLY N N 106.84 0.01 1 247 192 192 ILE H H 8.11 0.00004 1 248 192 192 ILE C C 178.21 0.0001 1 249 192 192 ILE CA C 65.12 0.0001 1 250 192 192 ILE CB C 36.45 0.0001 1 251 192 192 ILE N N 118.86 0.01 1 252 200 200 ILE H H 8.6 0.00004 1 253 200 200 ILE C C 173.49 0.0001 1 254 200 200 ILE CA C 56.52 0.0001 1 255 200 200 ILE CB C 37.69 0.0001 1 256 200 200 ILE N N 131 0.01 1 257 202 202 LEU H H 8.92 0.00004 1 258 202 202 LEU C C 174.25 0.0001 1 259 202 202 LEU CA C 53.09 0.0001 1 260 202 202 LEU CB C 44.21 0.0001 1 261 202 202 LEU N N 112.5 0.01 1 262 205 205 GLU H H 7.97 0.00004 1 263 205 205 GLU C C 176.29 0.0001 1 264 205 205 GLU CA C 55.94 0.0001 1 265 205 205 GLU CB C 28.49 0.0001 1 266 205 205 GLU N N 121.33 0.01 1 267 207 207 ASP H H 8.45 0.00004 1 268 207 207 ASP CA C 53.14 0.0001 1 269 207 207 ASP N N 128.97 0.01 1 270 208 208 GLY H H 8.97 0.00004 1 271 208 208 GLY C C 173.08 0.0001 1 272 208 208 GLY CA C 45.8 0.0001 1 273 208 208 GLY N N 112.67 0.01 1 274 209 209 ASN H H 8.5 0.00004 1 275 209 209 ASN C C 174.85 0.0001 1 276 209 209 ASN CB C 38.57 0.0001 1 277 209 209 ASN N N 117.69 0.01 1 278 212 212 ASN H H 7.66 0.00004 1 279 212 212 ASN CA C 55.31 0.0001 1 280 212 212 ASN N N 119.69 0.01 1 281 218 218 GLY H H 7.76 0.00004 1 282 218 218 GLY C C 173.79 0.0001 1 283 218 218 GLY CA C 45.01 0.0001 1 284 218 218 GLY N N 105.93 0.01 1 285 219 219 LYS H H 6.9 0.00004 1 286 219 219 LYS C C 175.12 0.0001 1 287 219 219 LYS CA C 51.62 0.0001 1 288 219 219 LYS CB C 32.05 0.0001 1 289 219 219 LYS N N 121.06 0.01 1 290 225 225 ASP H H 8.56 0.00004 1 291 225 225 ASP C C 178.42 0.0001 1 292 225 225 ASP CA C 56.95 0.0001 1 293 225 225 ASP CB C 39.12 0.0001 1 294 225 225 ASP N N 122.62 0.01 1 295 238 238 GLY H H 9.03 0.00004 1 296 238 238 GLY C C 170.33 0.0001 1 297 238 238 GLY CA C 44.11 0.0001 1 298 238 238 GLY N N 111.18 0.01 1 299 241 241 PHE H H 7.95 0.00004 1 300 241 241 PHE C C 175.8 0.0001 1 301 241 241 PHE CA C 57.08 0.0001 1 302 241 241 PHE CB C 42.58 0.0001 1 303 241 241 PHE N N 119.7 0.01 1 304 244 244 ASP H H 8.1 0.00004 1 305 244 244 ASP C C 176.4 0.0001 1 306 244 244 ASP CA C 51.5 0.0001 1 307 244 244 ASP CB C 38.55 0.0001 1 308 244 244 ASP N N 112.08 0.01 1 309 245 245 GLY H H 8.05 0.00004 1 310 245 245 GLY C C 172.79 0.0001 1 311 245 245 GLY CA C 46.07 0.0001 1 312 245 245 GLY N N 109.57 0.01 1 313 247 247 ARG H H 7.73 0.00004 1 314 247 247 ARG C C 173.71 0.0001 1 315 247 247 ARG CA C 54.63 0.0001 1 316 247 247 ARG CB C 34.41 0.0001 1 317 247 247 ARG N N 117.89 0.01 1 318 250 250 VAL H H 7.99 0.00004 1 319 250 250 VAL C C 173.77 0.0001 1 320 250 250 VAL CA C 60.78 0.0001 1 321 250 250 VAL CB C 34.65 0.0001 1 322 250 250 VAL N N 122.68 0.01 1 323 252 252 THR H H 8.53 0.00004 1 324 252 252 THR C C 174.72 0.0001 1 325 252 252 THR CA C 60.44 0.0001 1 326 252 252 THR CB C 70.47 0.0001 1 327 252 252 THR N N 113.5 0.01 1 328 258 258 ILE H H 7.95 0.00004 1 329 258 258 ILE C C 175.74 0.0001 1 330 258 258 ILE CA C 56.09 0.0001 1 331 258 258 ILE CB C 33.91 0.0001 1 332 258 258 ILE N N 130.12 0.01 1 333 261 261 ASP H H 8.58 0.00004 1 334 261 261 ASP CB C 38.12 0.0001 1 335 261 261 ASP N N 114.56 0.01 1 336 262 262 ARG H H 7.42 0.00004 1 337 262 262 ARG C C 178.66 0.0001 1 338 262 262 ARG CA C 57.97 0.0001 1 339 262 262 ARG CB C 28.99 0.0001 1 340 262 262 ARG N N 124.33 0.01 1 341 265 265 MET H H 7.34 0.00004 1 342 265 265 MET C C 176.18 0.0001 1 343 265 265 MET CA C 59.63 0.0001 1 344 265 265 MET CB C 31.05 0.0001 1 345 265 265 MET N N 117.43 0.01 1 346 266 266 LEU H H 6.6 0.00004 1 347 266 266 LEU C C 179.36 0.0001 1 348 266 266 LEU CA C 57.37 0.0001 1 349 266 266 LEU CB C 41.13 0.0001 1 350 266 266 LEU N N 119.2 0.01 1 351 268 268 ALA H H 9.31 0.00004 1 352 268 268 ALA C C 178.14 0.0001 1 353 268 268 ALA CA C 54.81 0.0001 1 354 268 268 ALA CB C 17.18 0.0001 1 355 268 268 ALA N N 122.05 0.01 1 356 271 271 VAL H H 8.72 0.00004 1 357 271 271 VAL C C 179.62 0.0001 1 358 271 271 VAL CA C 66.34 0.0001 1 359 271 271 VAL CB C 31.46 0.0001 1 360 271 271 VAL N N 118.63 0.01 1 361 273 273 SER H H 7.47 0.00004 1 362 273 273 SER CA C 61.78 0.0001 1 363 273 273 SER N N 115.94 0.01 1 364 280 280 ILE H H 8.05 0.00004 1 365 280 280 ILE C C 174.66 0.0001 1 366 280 280 ILE CA C 57.66 0.0001 1 367 280 280 ILE CB C 38.33 0.0001 1 368 280 280 ILE N N 121.9 0.01 1 369 281 281 ILE H H 7.9 0.00004 1 370 281 281 ILE C C 174.05 0.0001 1 371 281 281 ILE CA C 58.58 0.0001 1 372 281 281 ILE CB C 38.33 0.0001 1 373 281 281 ILE N N 126.24 0.01 1 374 283 283 ASP H H 7.45 0.00004 1 375 283 283 ASP C C 177.82 0.0001 1 376 283 283 ASP CA C 52.78 0.0001 1 377 283 283 ASP CB C 44.15 0.0001 1 378 283 283 ASP N N 117.93 0.01 1 379 291 291 ILE H H 6.87 0.00004 1 380 291 291 ILE C C 177.66 0.0001 1 381 291 291 ILE CA C 65.37 0.0001 1 382 291 291 ILE CB C 37.19 0.0001 1 383 291 291 ILE N N 118.98 0.01 1 384 292 292 ALA H H 7.08 0.00004 1 385 292 292 ALA C C 180.56 0.0001 1 386 292 292 ALA CA C 53.92 0.0001 1 387 292 292 ALA CB C 17.74 0.0001 1 388 292 292 ALA N N 120.18 0.01 1 389 294 294 ILE H H 7.97 0.00004 1 390 294 294 ILE CA C 65.66 0.0001 1 391 294 294 ILE CB C 37.23 0.0001 1 392 294 294 ILE N N 118.17 0.01 1 393 295 295 SER H H 8.03 0.00004 1 394 295 295 SER CA C 61.25 0.0001 1 395 295 295 SER CB C 62.32 0.0001 1 396 295 295 SER N N 114.99 0.01 1 397 314 314 LYS H H 7.46 0.00004 1 398 314 314 LYS C C 179.76 0.0001 1 399 314 314 LYS CA C 55.88 0.0001 1 400 314 314 LYS CB C 30.79 0.0001 1 401 314 314 LYS N N 121.36 0.01 1 402 319 319 GLY H H 7.75 0.00004 1 403 319 319 GLY C C 174.62 0.0001 1 404 319 319 GLY CA C 45.46 0.0001 1 405 319 319 GLY N N 111.27 0.01 1 406 320 320 ALA H H 7.42 0.00004 1 407 320 320 ALA C C 177.26 0.0001 1 408 320 320 ALA CA C 52.31 0.0001 1 409 320 320 ALA CB C 18.87 0.0001 1 410 320 320 ALA N N 122.02 0.01 1 411 321 321 LEU H H 7.66 0.00004 1 412 321 321 LEU CB C 43.11 0.0001 1 413 321 321 LEU N N 116.98 0.01 1 414 323 323 ALA H H 8.62 0.00004 1 415 323 323 ALA C C 175.83 0.0001 1 416 323 323 ALA CA C 49.27 0.0001 1 417 323 323 ALA CB C 23.99 0.0001 1 418 323 323 ALA N N 126.76 0.01 1 419 331 331 PHE H H 9.27 0.00004 1 420 331 331 PHE CA C 55.14 0.0001 1 421 331 331 PHE CB C 40.1 0.0001 1 422 331 331 PHE N N 127.49 0.01 1 423 335 335 ARG H H 8.8 0.00004 1 424 335 335 ARG C C 174.06 0.0001 1 425 335 335 ARG CA C 58.54 0.0001 1 426 335 335 ARG CB C 27.92 0.0001 1 427 335 335 ARG N N 122.79 0.01 1 428 336 336 TRP H H 7.9 0.00004 1 429 336 336 TRP C C 176.51 0.0001 1 430 336 336 TRP CA C 53.63 0.0001 1 431 336 336 TRP CB C 31.38 0.0001 1 432 336 336 TRP N N 122.66 0.01 1 433 337 337 PHE H H 6.42 0.00004 1 434 337 337 PHE C C 176.9 0.0001 1 435 337 337 PHE CA C 57.77 0.0001 1 436 337 337 PHE CB C 43.11 0.0001 1 437 337 337 PHE N N 119.94 0.01 1 438 338 338 GLY H H 8.46 0.00004 1 439 338 338 GLY C C 171.99 0.0001 1 440 338 338 GLY CA C 45.28 0.0001 1 441 338 338 GLY N N 107.76 0.01 1 442 342 342 GLY H H 8.59 0.00004 1 443 342 342 GLY C C 174.11 0.0001 1 444 342 342 GLY CA C 46.62 0.0001 1 445 342 342 GLY N N 116.39 0.01 1 446 347 347 ALA H H 7.78 0.00004 1 447 347 347 ALA C C 178.56 0.0001 1 448 347 347 ALA CA C 54.79 0.0001 1 449 347 347 ALA CB C 16.59 0.0001 1 450 347 347 ALA N N 121.24 0.01 1 451 348 348 ARG H H 7.97 0.00004 1 452 348 348 ARG CA C 55.05 0.0001 1 453 348 348 ARG CB C 26.6 0.0001 1 454 348 348 ARG N N 117.18 0.01 1 455 350 350 LEU H H 8.18 0.00004 1 456 350 350 LEU CA C 57.77 0.0001 1 457 350 350 LEU CB C 39.35 0.0001 1 458 350 350 LEU N N 121.25 0.01 1 459 352 352 ILE H H 7.53 0.00004 1 460 352 352 ILE C C 179.65 0.0001 1 461 352 352 ILE CA C 65.03 0.0001 1 462 352 352 ILE CB C 38.42 0.0001 1 463 352 352 ILE N N 120.28 0.01 1 464 367 367 PHE H H 7.09 0.00004 1 465 367 367 PHE C C 173.34 0.0001 1 466 367 367 PHE CA C 54.96 0.0001 1 467 367 367 PHE N N 118.32 0.01 1 468 370 370 ASP H H 8.23 0.00004 1 469 370 370 ASP C C 175.4 0.0001 1 470 370 370 ASP CA C 53.52 0.0001 1 471 370 370 ASP CB C 42.45 0.0001 1 472 370 370 ASP N N 124.42 0.01 1 473 376 376 ILE H H 9 0.00004 1 474 376 376 ILE C C 174.48 0.0001 1 475 376 376 ILE CA C 60.11 0.0001 1 476 376 376 ILE CB C 40.24 0.0001 1 477 376 376 ILE N N 128.92 0.01 1 478 393 393 GLN H H 8.02 0.00004 1 479 393 393 GLN C C 176.98 0.0001 1 480 393 393 GLN CA C 57.67 0.0001 1 481 393 393 GLN CB C 28.04 0.0001 1 482 393 393 GLN N N 116.16 0.01 1 483 415 415 LYS H H 8.41 0.00004 1 484 415 415 LYS C C 175.1 0.0001 1 485 415 415 LYS CA C 54.55 0.0001 1 486 415 415 LYS CB C 31.93 0.0001 1 487 415 415 LYS N N 112.33 0.01 1 488 421 421 ARG H H 8.76 0.00004 1 489 421 421 ARG C C 174.12 0.0001 1 490 421 421 ARG CA C 53.83 0.0001 1 491 421 421 ARG CB C 32.75 0.0001 1 492 421 421 ARG N N 124.26 0.01 1 493 422 422 ALA H H 9.12 0.00004 1 494 422 422 ALA C C 177.21 0.0001 1 495 422 422 ALA CA C 50.53 0.0001 1 496 422 422 ALA CB C 18.44 0.0001 1 497 422 422 ALA N N 125.42 0.01 1 498 431 431 LEU H H 9.35 0.00004 1 499 431 431 LEU C C 175.23 0.0001 1 500 431 431 LEU CA C 54.2 0.0001 1 501 431 431 LEU N N 128.83 0.01 1 502 432 432 ARG H H 7.31 0.00004 1 503 432 432 ARG C C 171.53 0.0001 1 504 432 432 ARG CA C 55.46 0.0001 1 505 432 432 ARG N N 118.3 0.01 1 506 434 434 GLU H H 7.91 0.00004 1 507 434 434 GLU C C 173.67 0.0001 1 508 434 434 GLU CA C 54.49 0.0001 1 509 434 434 GLU CB C 32.57 0.0001 1 510 434 434 GLU N N 120.85 0.01 1 stop_ save_