data_18211 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; 1H, 15N and 13C resonance assignments for the LOTUS2 and LOTUS3 RNA binding domains of mouse TDRD7 ; _BMRB_accession_number 18211 _BMRB_flat_file_name bmr18211.str _Entry_type original _Submission_date 2012-01-23 _Accession_date 2012-01-23 _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 Cui Gaofeng . . 2 Botuyan 'Maria Victoria' . . 3 Mer Georges . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 1140 "13C chemical shifts" 834 "15N chemical shifts" 179 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2013-03-25 update BMRB 'update entry citation' 2012-03-20 original author 'original release' stop_ save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title '(1)H, (15)N and (13)C resonance assignments for the three LOTUS RNA binding domains of Tudor domain-containing protein TDRD7.' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 22481467 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Cui Gaofeng . . 2 Botuyan 'Maria Victoria' . . 3 Mer Georges . . stop_ _Journal_abbreviation 'Biomol. NMR Assignments' _Journal_name_full 'Biomolecular NMR assignments' _Journal_volume 7 _Journal_issue 1 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 79 _Page_last 83 _Year 2013 _Details . loop_ _Keyword 'Lotus RNA binding domain' TDRD7 'Tudor domain' stop_ save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'Lotus domains 2 and 3' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'Lotus domains 2 and 3' $TDRD7 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_TDRD7 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common TDRD7 _Molecular_mass . _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 180 _Mol_residue_sequence ; GHMDEVQNRIKEILDKHNNG IWISKLPHFYKEFYKEDLNQ GVLQQFEHWPHICTVEKPCG GGQDSLLYPARREQPLKSDQ DPEKELPPPPPAPKQEVPSQ GSPAVMPDVKEKVAELLGKY SSGLWASALPKAFEDMYKVK FPEDALKNLASLSDVCTINY ISGNTQKAILYAKLPLPTDK ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 -2 GLY 2 -1 HIS 3 256 MET 4 257 ASP 5 258 GLU 6 259 VAL 7 260 GLN 8 261 ASN 9 262 ARG 10 263 ILE 11 264 LYS 12 265 GLU 13 266 ILE 14 267 LEU 15 268 ASP 16 269 LYS 17 270 HIS 18 271 ASN 19 272 ASN 20 273 GLY 21 274 ILE 22 275 TRP 23 276 ILE 24 277 SER 25 278 LYS 26 279 LEU 27 280 PRO 28 281 HIS 29 282 PHE 30 283 TYR 31 284 LYS 32 285 GLU 33 286 PHE 34 287 TYR 35 288 LYS 36 289 GLU 37 290 ASP 38 291 LEU 39 292 ASN 40 293 GLN 41 294 GLY 42 295 VAL 43 296 LEU 44 297 GLN 45 298 GLN 46 299 PHE 47 300 GLU 48 301 HIS 49 302 TRP 50 303 PRO 51 304 HIS 52 305 ILE 53 306 CYS 54 307 THR 55 308 VAL 56 309 GLU 57 310 LYS 58 311 PRO 59 312 CYS 60 313 GLY 61 314 GLY 62 315 GLY 63 316 GLN 64 317 ASP 65 318 SER 66 319 LEU 67 320 LEU 68 321 TYR 69 322 PRO 70 323 ALA 71 324 ARG 72 325 ARG 73 326 GLU 74 327 GLN 75 328 PRO 76 329 LEU 77 330 LYS 78 331 SER 79 332 ASP 80 333 GLN 81 334 ASP 82 335 PRO 83 336 GLU 84 337 LYS 85 338 GLU 86 339 LEU 87 340 PRO 88 341 PRO 89 342 PRO 90 343 PRO 91 344 PRO 92 345 ALA 93 346 PRO 94 347 LYS 95 348 GLN 96 349 GLU 97 350 VAL 98 351 PRO 99 352 SER 100 353 GLN 101 354 GLY 102 355 SER 103 356 PRO 104 357 ALA 105 358 VAL 106 359 MET 107 360 PRO 108 361 ASP 109 362 VAL 110 363 LYS 111 364 GLU 112 365 LYS 113 366 VAL 114 367 ALA 115 368 GLU 116 369 LEU 117 370 LEU 118 371 GLY 119 372 LYS 120 373 TYR 121 374 SER 122 375 SER 123 376 GLY 124 377 LEU 125 378 TRP 126 379 ALA 127 380 SER 128 381 ALA 129 382 LEU 130 383 PRO 131 384 LYS 132 385 ALA 133 386 PHE 134 387 GLU 135 388 ASP 136 389 MET 137 390 TYR 138 391 LYS 139 392 VAL 140 393 LYS 141 394 PHE 142 395 PRO 143 396 GLU 144 397 ASP 145 398 ALA 146 399 LEU 147 400 LYS 148 401 ASN 149 402 LEU 150 403 ALA 151 404 SER 152 405 LEU 153 406 SER 154 407 ASP 155 408 VAL 156 409 CYS 157 410 THR 158 411 ILE 159 412 ASN 160 413 TYR 161 414 ILE 162 415 SER 163 416 GLY 164 417 ASN 165 418 THR 166 419 GLN 167 420 LYS 168 421 ALA 169 422 ILE 170 423 LEU 171 424 TYR 172 425 ALA 173 426 LYS 174 427 LEU 175 428 PRO 176 429 LEU 177 430 PRO 178 431 THR 179 432 ASP 180 433 LYS stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-02-26 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 PDB 2LY1 "Nmr Structure Of The Second And Third Lotus Domains Of Tudor Domain- Containing Protein 7 (nmr Ensemble Overlay For Lotus #2)" 100.00 180 100.00 100.00 2.99e-128 PDB 2LY2 "Nmr Structure Of The Second And Third Lotus Domains Of Tudor Domain- Containing Protein 7 (nmr Ensemble Overlay For Lotus #3)" 100.00 180 100.00 100.00 2.99e-128 GB AAH29689 "Tudor domain containing 7 [Mus musculus]" 98.89 1086 100.00 100.00 1.28e-118 REF NP_001277404 "tudor domain-containing protein 7 isoform 1 [Mus musculus]" 98.89 1119 100.00 100.00 1.58e-118 REF NP_666254 "tudor domain-containing protein 7 isoform 2 [Mus musculus]" 98.89 1086 100.00 100.00 1.28e-118 REF XP_006537580 "PREDICTED: tudor domain-containing protein 7 isoform X1 [Mus musculus]" 98.89 1086 100.00 100.00 1.28e-118 REF XP_006537581 "PREDICTED: tudor domain-containing protein 7 isoform X2 [Mus musculus]" 98.89 1024 100.00 100.00 3.56e-119 SP Q8K1H1 "RecName: Full=Tudor domain-containing protein 7; AltName: Full=PCTAIRE2-binding protein; AltName: Full=Tudor repeat associator " 98.89 1086 100.00 100.00 1.28e-118 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $TDRD7 Mouse 10090 Eukaryota Metazoa Mus musculus 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 $TDRD7 'recombinant technology' . Escherichia coli . pTEV stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $TDRD7 1 mM '[U-100% 13C; U-100% 15N]' H2O 90 % 'natural abundance' D2O 10 % 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Saveframe_category software _Name NMRPipe _Version . loop_ _Vendor _Address _Electronic_address 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . stop_ loop_ _Task processing stop_ _Details . save_ save_NMRView _Saveframe_category software _Name NMRView _Version . loop_ _Vendor _Address _Electronic_address 'Johnson, One Moon Scientific' . . stop_ loop_ _Task 'data analysis' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 700 _Details . save_ ############################# # NMR applied experiments # ############################# save_2D_1H-15N_HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $sample_1 save_ save_2D_1H-13C_HSQC_2 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-13C HSQC' _Sample_label $sample_1 save_ save_2D_1H-13C_HSQC_aromatic_3 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-13C HSQC aromatic' _Sample_label $sample_1 save_ save_3D_CBCA(CO)NH_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _Sample_label $sample_1 save_ save_3D_CBCA(CO)NH_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _Sample_label $sample_1 save_ save_3D_HNCO_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $sample_1 save_ save_3D_HN(CA)CO_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CA)CO' _Sample_label $sample_1 save_ save_3D_H(CCO)NH_8 _Saveframe_category NMR_applied_experiment _Experiment_name '3D H(CCO)NH' _Sample_label $sample_1 save_ save_3D_C(CO)NH_9 _Saveframe_category NMR_applied_experiment _Experiment_name '3D C(CO)NH' _Sample_label $sample_1 save_ save_3D_(H)CCH-TOCSY_10 _Saveframe_category NMR_applied_experiment _Experiment_name '3D (H)CCH-TOCSY' _Sample_label $sample_1 save_ save_3D_1H-15N_NOESY_11 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N NOESY' _Sample_label $sample_1 save_ save_3D_1H-13C_NOESY_aliphatic_12 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-13C NOESY aliphatic' _Sample_label $sample_1 save_ save_3D_1H-13C_NOESY_aromatic_13 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-13C NOESY aromatic' _Sample_label $sample_1 save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 0.26 . M pH 7.0 . pH pressure 1 . atm temperature 298 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Saveframe_category chemical_shift_reference _Details 'DSS was used as internal reference.' 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 na indirect . . . 0.251449530 DSS H 1 'methyl protons' ppm 0.00 internal direct . . . 1.000000000 DSS N 15 'methyl protons' ppm 0.00 na indirect . . . 0.101329118 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '2D 1H-15N HSQC' '2D 1H-13C HSQC' '2D 1H-13C HSQC aromatic' '3D CBCA(CO)NH' '3D H(CCO)NH' '3D C(CO)NH' '3D (H)CCH-TOCSY' '3D 1H-15N NOESY' '3D 1H-13C NOESY aliphatic' '3D 1H-13C NOESY aromatic' stop_ loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name 'Lotus domains 2 and 3' _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 -2 1 GLY HA2 H 3.865 0.03 2 2 -2 1 GLY HA3 H 3.865 0.03 2 3 -2 1 GLY CA C 43.519 0.30 1 4 -1 2 HIS HA H 4.534 0.03 1 5 -1 2 HIS HB2 H 3.144 0.03 2 6 -1 2 HIS HB3 H 3.144 0.03 2 7 -1 2 HIS HD2 H 7.039 0.03 1 8 -1 2 HIS HE1 H 7.872 0.03 1 9 -1 2 HIS C C 176.531 0.30 1 10 -1 2 HIS CA C 58.272 0.30 1 11 -1 2 HIS CB C 30.499 0.30 1 12 -1 2 HIS CD2 C 120.023 0.30 1 13 -1 2 HIS CE1 C 138.262 0.30 1 14 256 3 MET H H 8.703 0.03 1 15 256 3 MET HA H 4.405 0.03 1 16 256 3 MET HB2 H 2.004 0.03 2 17 256 3 MET HB3 H 2.004 0.03 2 18 256 3 MET HG2 H 2.390 0.03 2 19 256 3 MET HG3 H 2.565 0.03 2 20 256 3 MET HE H 2.094 0.03 1 21 256 3 MET C C 176.883 0.30 1 22 256 3 MET CA C 56.149 0.30 1 23 256 3 MET CB C 31.601 0.30 1 24 256 3 MET CG C 32.122 0.30 1 25 256 3 MET CE C 16.929 0.30 1 26 256 3 MET N N 119.242 0.30 1 27 257 4 ASP H H 7.931 0.03 1 28 257 4 ASP HA H 4.175 0.03 1 29 257 4 ASP HB2 H 2.642 0.03 2 30 257 4 ASP HB3 H 2.642 0.03 2 31 257 4 ASP C C 177.442 0.30 1 32 257 4 ASP CA C 56.415 0.30 1 33 257 4 ASP CB C 40.504 0.30 1 34 257 4 ASP N N 119.654 0.30 1 35 258 5 GLU H H 7.994 0.03 1 36 258 5 GLU HA H 4.070 0.03 1 37 258 5 GLU HB2 H 1.970 0.03 2 38 258 5 GLU HB3 H 2.052 0.03 2 39 258 5 GLU HG2 H 2.188 0.03 2 40 258 5 GLU HG3 H 2.120 0.03 2 41 258 5 GLU C C 178.711 0.30 1 42 258 5 GLU CA C 59.182 0.30 1 43 258 5 GLU CB C 29.382 0.30 1 44 258 5 GLU CG C 36.138 0.30 1 45 258 5 GLU N N 119.661 0.30 1 46 259 6 VAL H H 7.915 0.03 1 47 259 6 VAL HA H 3.686 0.03 1 48 259 6 VAL HB H 2.179 0.03 1 49 259 6 VAL HG1 H 1.023 0.03 2 50 259 6 VAL HG2 H 1.062 0.03 2 51 259 6 VAL C C 177.869 0.30 1 52 259 6 VAL CA C 66.712 0.30 1 53 259 6 VAL CB C 31.688 0.30 1 54 259 6 VAL CG1 C 22.794 0.30 1 55 259 6 VAL CG2 C 21.699 0.30 1 56 259 6 VAL N N 119.654 0.30 1 57 260 7 GLN H H 8.062 0.03 1 58 260 7 GLN HA H 3.424 0.03 1 59 260 7 GLN HB2 H 1.799 0.03 2 60 260 7 GLN HB3 H 1.425 0.03 2 61 260 7 GLN HG2 H 1.647 0.03 2 62 260 7 GLN HG3 H 0.325 0.03 2 63 260 7 GLN HE21 H 6.800 0.03 2 64 260 7 GLN HE22 H 4.360 0.03 2 65 260 7 GLN C C 177.715 0.30 1 66 260 7 GLN CA C 60.150 0.30 1 67 260 7 GLN CB C 27.764 0.30 1 68 260 7 GLN CG C 33.353 0.30 1 69 260 7 GLN N N 118.232 0.30 1 70 260 7 GLN NE2 N 107.636 0.30 1 71 261 8 ASN H H 7.877 0.03 1 72 261 8 ASN HA H 4.315 0.03 1 73 261 8 ASN HB2 H 2.766 0.03 2 74 261 8 ASN HB3 H 2.819 0.03 2 75 261 8 ASN HD21 H 7.543 0.03 2 76 261 8 ASN HD22 H 6.840 0.03 2 77 261 8 ASN C C 177.994 0.30 1 78 261 8 ASN CA C 56.185 0.30 1 79 261 8 ASN CB C 38.073 0.30 1 80 261 8 ASN N N 116.356 0.30 1 81 261 8 ASN ND2 N 112.540 0.30 1 82 262 9 ARG H H 8.051 0.03 1 83 262 9 ARG HA H 4.115 0.03 1 84 262 9 ARG HB2 H 2.024 0.03 2 85 262 9 ARG HB3 H 1.494 0.03 2 86 262 9 ARG HG2 H 1.586 0.03 2 87 262 9 ARG HG3 H 1.586 0.03 2 88 262 9 ARG HD2 H 2.562 0.03 2 89 262 9 ARG HD3 H 1.448 0.03 2 90 262 9 ARG HE H 7.152 0.03 1 91 262 9 ARG C C 178.762 0.30 1 92 262 9 ARG CA C 59.636 0.30 1 93 262 9 ARG CB C 31.067 0.30 1 94 262 9 ARG CG C 29.084 0.30 1 95 262 9 ARG CD C 43.641 0.30 1 96 262 9 ARG N N 121.329 0.30 1 97 262 9 ARG NE N 85.862 0.30 1 98 263 10 ILE H H 8.462 0.03 1 99 263 10 ILE HA H 3.798 0.03 1 100 263 10 ILE HB H 2.276 0.03 1 101 263 10 ILE HG12 H 1.983 0.03 1 102 263 10 ILE HG13 H 1.785 0.03 1 103 263 10 ILE HG2 H 0.759 0.03 2 104 263 10 ILE HD1 H 0.974 0.03 1 105 263 10 ILE C C 177.462 0.30 1 106 263 10 ILE CA C 63.758 0.30 1 107 263 10 ILE CB C 35.566 0.30 1 108 263 10 ILE CG1 C 28.389 0.30 2 109 263 10 ILE CG2 C 17.330 0.30 1 110 263 10 ILE CD1 C 11.151 0.30 1 111 263 10 ILE N N 119.563 0.30 1 112 264 11 LYS H H 8.145 0.03 1 113 264 11 LYS HA H 3.760 0.03 1 114 264 11 LYS HB2 H 1.698 0.03 2 115 264 11 LYS HB3 H 1.698 0.03 2 116 264 11 LYS HG2 H 1.923 0.03 2 117 264 11 LYS HG3 H 2.126 0.03 2 118 264 11 LYS HD2 H 1.492 0.03 2 119 264 11 LYS HD3 H 1.630 0.03 2 120 264 11 LYS HE2 H 3.001 0.03 2 121 264 11 LYS HE3 H 3.001 0.03 2 122 264 11 LYS C C 178.462 0.30 1 123 264 11 LYS CA C 60.894 0.30 1 124 264 11 LYS CB C 29.124 0.30 1 125 264 11 LYS CG C 32.401 0.30 1 126 264 11 LYS CD C 25.220 0.30 1 127 264 11 LYS CE C 42.146 0.30 1 128 264 11 LYS N N 120.021 0.30 1 129 265 12 GLU H H 7.920 0.03 1 130 265 12 GLU HA H 4.060 0.03 1 131 265 12 GLU HB2 H 2.276 0.03 2 132 265 12 GLU HB3 H 2.276 0.03 2 133 265 12 GLU HG2 H 2.470 0.03 2 134 265 12 GLU HG3 H 2.470 0.03 2 135 265 12 GLU C C 179.679 0.30 1 136 265 12 GLU CA C 59.982 0.30 1 137 265 12 GLU CB C 29.124 0.30 1 138 265 12 GLU CG C 36.651 0.30 1 139 265 12 GLU N N 118.911 0.30 1 140 266 13 ILE H H 8.194 0.03 1 141 266 13 ILE HA H 3.478 0.03 1 142 266 13 ILE HB H 1.983 0.03 1 143 266 13 ILE HG12 H 2.060 0.03 1 144 266 13 ILE HG13 H 0.544 0.03 1 145 266 13 ILE HG2 H 0.646 0.03 2 146 266 13 ILE HD1 H 1.018 0.03 1 147 266 13 ILE C C 178.365 0.30 1 148 266 13 ILE CA C 65.916 0.30 1 149 266 13 ILE CB C 38.066 0.30 1 150 266 13 ILE CG1 C 28.644 0.30 2 151 266 13 ILE CG2 C 16.966 0.30 1 152 266 13 ILE CD1 C 14.548 0.30 1 153 266 13 ILE N N 120.215 0.30 1 154 267 14 LEU H H 8.120 0.03 1 155 267 14 LEU HA H 4.064 0.03 1 156 267 14 LEU HB2 H 1.914 0.03 2 157 267 14 LEU HB3 H 1.118 0.03 2 158 267 14 LEU HG H 1.673 0.03 1 159 267 14 LEU HD1 H 0.624 0.03 2 160 267 14 LEU HD2 H 0.507 0.03 2 161 267 14 LEU C C 177.242 0.30 1 162 267 14 LEU CA C 56.612 0.30 1 163 267 14 LEU CB C 41.899 0.30 1 164 267 14 LEU CG C 26.759 0.30 1 165 267 14 LEU CD1 C 26.850 0.30 1 166 267 14 LEU CD2 C 22.718 0.30 1 167 267 14 LEU N N 119.928 0.30 1 168 268 15 ASP H H 7.892 0.03 1 169 268 15 ASP HA H 4.452 0.03 1 170 268 15 ASP HB2 H 2.783 0.03 2 171 268 15 ASP HB3 H 2.619 0.03 2 172 268 15 ASP C C 178.184 0.30 1 173 268 15 ASP CA C 56.560 0.30 1 174 268 15 ASP CB C 40.993 0.30 1 175 268 15 ASP N N 117.633 0.30 1 176 269 16 LYS H H 7.164 0.03 1 177 269 16 LYS HA H 4.125 0.03 1 178 269 16 LYS HB2 H 1.745 0.03 2 179 269 16 LYS HB3 H 1.663 0.03 2 180 269 16 LYS HG2 H 1.558 0.03 2 181 269 16 LYS HG3 H 1.484 0.03 2 182 269 16 LYS HD2 H 1.195 0.03 2 183 269 16 LYS HD3 H 1.295 0.03 2 184 269 16 LYS HE2 H 2.853 0.03 2 185 269 16 LYS HE3 H 2.853 0.03 2 186 269 16 LYS C C 176.404 0.30 1 187 269 16 LYS CA C 56.902 0.30 1 188 269 16 LYS CB C 33.261 0.30 1 189 269 16 LYS CG C 28.884 0.30 1 190 269 16 LYS CD C 25.000 0.30 1 191 269 16 LYS CE C 42.146 0.30 1 192 269 16 LYS N N 117.210 0.30 1 193 270 17 HIS H H 8.240 0.03 1 194 270 17 HIS HA H 4.627 0.03 1 195 270 17 HIS HB2 H 2.759 0.03 2 196 270 17 HIS HB3 H 2.759 0.03 2 197 270 17 HIS HD2 H 6.727 0.03 1 198 270 17 HIS HE1 H 7.538 0.03 1 199 270 17 HIS C C 174.383 0.30 1 200 270 17 HIS CA C 55.081 0.30 1 201 270 17 HIS CB C 28.847 0.30 1 202 270 17 HIS CD2 C 121.752 0.30 1 203 270 17 HIS CE1 C 138.089 0.30 1 204 270 17 HIS N N 121.336 0.30 1 205 271 18 ASN H H 7.765 0.03 1 206 271 18 ASN HA H 4.665 0.03 1 207 271 18 ASN HB2 H 3.037 0.03 2 208 271 18 ASN HB3 H 2.905 0.03 2 209 271 18 ASN HD21 H 7.485 0.03 2 210 271 18 ASN HD22 H 6.778 0.03 2 211 271 18 ASN C C 175.598 0.30 1 212 271 18 ASN CA C 54.778 0.30 1 213 271 18 ASN CB C 38.762 0.30 1 214 271 18 ASN N N 116.667 0.30 1 215 271 18 ASN ND2 N 111.958 0.30 1 216 272 19 ASN H H 8.490 0.03 1 217 272 19 ASN HA H 5.027 0.03 1 218 272 19 ASN HB2 H 2.949 0.03 2 219 272 19 ASN HB3 H 2.763 0.03 2 220 272 19 ASN HD21 H 7.619 0.03 2 221 272 19 ASN HD22 H 6.884 0.03 2 222 272 19 ASN C C 174.496 0.30 1 223 272 19 ASN CA C 52.692 0.30 1 224 272 19 ASN CB C 38.835 0.30 1 225 272 19 ASN N N 116.487 0.30 1 226 272 19 ASN ND2 N 113.203 0.30 1 227 273 20 GLY H H 8.656 0.03 1 228 273 20 GLY HA2 H 3.421 0.03 2 229 273 20 GLY HA3 H 2.500 0.03 2 230 273 20 GLY C C 173.012 0.30 1 231 273 20 GLY CA C 44.706 0.30 1 232 273 20 GLY N N 112.053 0.30 1 233 274 21 ILE H H 7.906 0.03 1 234 274 21 ILE HA H 4.223 0.03 1 235 274 21 ILE HB H 1.329 0.03 1 236 274 21 ILE HG12 H 1.294 0.03 1 237 274 21 ILE HG13 H 0.708 0.03 1 238 274 21 ILE HG2 H 0.666 0.03 2 239 274 21 ILE HD1 H 0.330 0.03 1 240 274 21 ILE C C 175.006 0.30 1 241 274 21 ILE CA C 58.949 0.30 1 242 274 21 ILE CB C 41.834 0.30 1 243 274 21 ILE CG1 C 26.392 0.30 2 244 274 21 ILE CG2 C 16.793 0.30 1 245 274 21 ILE CD1 C 14.082 0.30 1 246 274 21 ILE N N 123.373 0.30 1 247 275 22 TRP H H 8.350 0.03 1 248 275 22 TRP HA H 4.757 0.03 1 249 275 22 TRP HB2 H 3.727 0.03 2 250 275 22 TRP HB3 H 2.737 0.03 2 251 275 22 TRP HD1 H 7.292 0.03 1 252 275 22 TRP HE1 H 10.045 0.03 1 253 275 22 TRP HE3 H 7.424 0.03 1 254 275 22 TRP HZ2 H 7.445 0.03 1 255 275 22 TRP HZ3 H 6.780 0.03 1 256 275 22 TRP HH2 H 7.141 0.03 1 257 275 22 TRP C C 178.780 0.30 1 258 275 22 TRP CA C 57.588 0.30 1 259 275 22 TRP CB C 28.908 0.30 1 260 275 22 TRP CD1 C 127.086 0.30 1 261 275 22 TRP CE3 C 121.091 0.30 1 262 275 22 TRP CZ2 C 114.611 0.30 1 263 275 22 TRP CZ3 C 121.047 0.30 1 264 275 22 TRP CH2 C 124.365 0.30 1 265 275 22 TRP N N 128.365 0.30 1 266 275 22 TRP NE1 N 128.344 0.30 1 267 276 23 ILE H H 9.423 0.03 1 268 276 23 ILE HA H 3.658 0.03 1 269 276 23 ILE HB H 2.162 0.03 1 270 276 23 ILE HG12 H 1.814 0.03 1 271 276 23 ILE HG13 H 1.078 0.03 1 272 276 23 ILE HG2 H 1.173 0.03 2 273 276 23 ILE HD1 H 1.017 0.03 1 274 276 23 ILE C C 178.307 0.30 1 275 276 23 ILE CA C 66.928 0.30 1 276 276 23 ILE CB C 37.638 0.30 1 277 276 23 ILE CG1 C 31.302 0.30 2 278 276 23 ILE CG2 C 18.185 0.30 1 279 276 23 ILE CD1 C 14.082 0.30 1 280 276 23 ILE N N 126.997 0.30 1 281 277 24 SER H H 9.217 0.03 1 282 277 24 SER HA H 4.157 0.03 1 283 277 24 SER HB2 H 3.957 0.03 2 284 277 24 SER HB3 H 3.816 0.03 2 285 277 24 SER C C 176.614 0.30 1 286 277 24 SER CA C 60.846 0.30 1 287 277 24 SER CB C 61.854 0.30 1 288 277 24 SER N N 113.464 0.30 1 289 278 25 LYS H H 7.925 0.03 1 290 278 25 LYS HA H 4.584 0.03 1 291 278 25 LYS HB2 H 2.118 0.03 2 292 278 25 LYS HB3 H 2.118 0.03 2 293 278 25 LYS HG2 H 1.697 0.03 2 294 278 25 LYS HG3 H 1.697 0.03 2 295 278 25 LYS HD2 H 1.517 0.03 2 296 278 25 LYS HD3 H 1.517 0.03 2 297 278 25 LYS HE2 H 2.869 0.03 2 298 278 25 LYS HE3 H 2.869 0.03 2 299 278 25 LYS C C 177.311 0.30 1 300 278 25 LYS CA C 55.518 0.30 1 301 278 25 LYS CB C 33.029 0.30 1 302 278 25 LYS CG C 28.444 0.30 1 303 278 25 LYS CD C 25.220 0.30 1 304 278 25 LYS CE C 42.146 0.30 1 305 278 25 LYS N N 120.613 0.30 1 306 279 26 LEU H H 8.000 0.03 1 307 279 26 LEU HA H 4.395 0.03 1 308 279 26 LEU HB2 H 2.103 0.03 2 309 279 26 LEU HB3 H 1.802 0.03 2 310 279 26 LEU HG H 1.802 0.03 1 311 279 26 LEU HD1 H 0.949 0.03 2 312 279 26 LEU HD2 H 0.992 0.03 2 313 279 26 LEU C C 175.011 0.30 1 314 279 26 LEU CA C 59.219 0.30 1 315 279 26 LEU CB C 39.474 0.30 1 316 279 26 LEU CG C 27.755 0.30 1 317 279 26 LEU CD1 C 25.842 0.30 1 318 279 26 LEU CD2 C 24.726 0.30 1 319 279 26 LEU N N 122.392 0.30 1 320 280 27 PRO HA H 4.196 0.03 1 321 280 27 PRO HB2 H 2.613 0.03 2 322 280 27 PRO HB3 H 1.932 0.03 2 323 280 27 PRO HG2 H 1.791 0.03 2 324 280 27 PRO HG3 H 2.282 0.03 2 325 280 27 PRO HD2 H 3.654 0.03 2 326 280 27 PRO HD3 H 4.048 0.03 2 327 280 27 PRO C C 178.826 0.30 1 328 280 27 PRO CA C 67.282 0.30 1 329 280 27 PRO CB C 30.972 0.30 1 330 280 27 PRO CG C 29.103 0.30 1 331 280 27 PRO CD C 50.500 0.30 1 332 281 28 HIS H H 7.757 0.03 1 333 281 28 HIS HA H 4.431 0.03 1 334 281 28 HIS HB2 H 3.212 0.03 2 335 281 28 HIS HB3 H 3.212 0.03 2 336 281 28 HIS HD2 H 6.577 0.03 1 337 281 28 HIS HE1 H 7.965 0.03 1 338 281 28 HIS C C 177.878 0.30 1 339 281 28 HIS CA C 59.522 0.30 1 340 281 28 HIS CB C 30.048 0.30 1 341 281 28 HIS CD2 C 118.797 0.30 1 342 281 28 HIS CE1 C 138.166 0.30 1 343 281 28 HIS N N 117.848 0.30 1 344 282 29 PHE H H 7.819 0.03 1 345 282 29 PHE HA H 4.197 0.03 1 346 282 29 PHE HB2 H 3.132 0.03 2 347 282 29 PHE HB3 H 2.980 0.03 2 348 282 29 PHE HD1 H 7.156 0.03 3 349 282 29 PHE HD2 H 7.156 0.03 3 350 282 29 PHE HE1 H 7.149 0.03 3 351 282 29 PHE HE2 H 7.149 0.03 3 352 282 29 PHE HZ H 7.211 0.03 1 353 282 29 PHE C C 177.592 0.30 1 354 282 29 PHE CA C 61.531 0.30 1 355 282 29 PHE CB C 39.450 0.30 1 356 282 29 PHE CD1 C 131.150 0.30 3 357 282 29 PHE CD2 C 131.150 0.30 3 358 282 29 PHE CE1 C 130.103 0.30 3 359 282 29 PHE CE2 C 130.103 0.30 3 360 282 29 PHE CZ C 131.259 0.30 1 361 282 29 PHE N N 118.980 0.30 1 362 283 30 TYR H H 9.043 0.03 1 363 283 30 TYR HA H 4.150 0.03 1 364 283 30 TYR HB2 H 3.382 0.03 2 365 283 30 TYR HB3 H 2.861 0.03 2 366 283 30 TYR HD1 H 7.145 0.03 3 367 283 30 TYR HD2 H 7.145 0.03 3 368 283 30 TYR HE1 H 6.536 0.03 3 369 283 30 TYR HE2 H 6.536 0.03 3 370 283 30 TYR C C 176.778 0.30 1 371 283 30 TYR CA C 62.519 0.30 1 372 283 30 TYR CB C 39.964 0.30 1 373 283 30 TYR CD1 C 134.108 0.30 3 374 283 30 TYR CD2 C 134.108 0.30 3 375 283 30 TYR CE1 C 118.969 0.30 3 376 283 30 TYR CE2 C 118.969 0.30 3 377 283 30 TYR N N 119.644 0.30 1 378 284 31 LYS H H 8.254 0.03 1 379 284 31 LYS HA H 4.461 0.03 1 380 284 31 LYS HB2 H 2.073 0.03 2 381 284 31 LYS HB3 H 2.073 0.03 2 382 284 31 LYS HG2 H 1.603 0.03 2 383 284 31 LYS HG3 H 1.603 0.03 2 384 284 31 LYS HD2 H 1.452 0.03 2 385 284 31 LYS HD3 H 1.205 0.03 2 386 284 31 LYS HE2 H 2.845 0.03 2 387 284 31 LYS HE3 H 2.845 0.03 2 388 284 31 LYS C C 180.144 0.30 1 389 284 31 LYS CA C 59.123 0.30 1 390 284 31 LYS CB C 32.416 0.30 1 391 284 31 LYS CG C 29.177 0.30 1 392 284 31 LYS CD C 24.707 0.30 1 393 284 31 LYS CE C 42.146 0.30 1 394 284 31 LYS N N 119.831 0.30 1 395 285 32 GLU H H 8.045 0.03 1 396 285 32 GLU HA H 3.869 0.03 1 397 285 32 GLU HB2 H 1.967 0.03 2 398 285 32 GLU HB3 H 1.967 0.03 2 399 285 32 GLU HG2 H 1.974 0.03 2 400 285 32 GLU HG3 H 2.052 0.03 2 401 285 32 GLU C C 177.797 0.30 1 402 285 32 GLU CA C 59.217 0.30 1 403 285 32 GLU CB C 29.428 0.30 1 404 285 32 GLU CG C 36.211 0.30 1 405 285 32 GLU N N 120.434 0.30 1 406 286 33 PHE H H 8.108 0.03 1 407 286 33 PHE HA H 4.072 0.03 1 408 286 33 PHE HB2 H 2.507 0.03 2 409 286 33 PHE HB3 H 1.840 0.03 2 410 286 33 PHE HD1 H 6.775 0.03 3 411 286 33 PHE HD2 H 6.775 0.03 3 412 286 33 PHE HE1 H 7.217 0.03 3 413 286 33 PHE HE2 H 7.217 0.03 3 414 286 33 PHE HZ H 6.986 0.03 1 415 286 33 PHE C C 177.994 0.30 1 416 286 33 PHE CA C 60.148 0.30 1 417 286 33 PHE CB C 39.467 0.30 1 418 286 33 PHE CD1 C 131.327 0.30 3 419 286 33 PHE CD2 C 131.327 0.30 3 420 286 33 PHE CE1 C 129.394 0.30 3 421 286 33 PHE CE2 C 129.394 0.30 3 422 286 33 PHE CZ C 133.102 0.30 1 423 286 33 PHE N N 116.769 0.30 1 424 287 34 TYR H H 8.400 0.03 1 425 287 34 TYR HA H 4.541 0.03 1 426 287 34 TYR HB2 H 2.977 0.03 2 427 287 34 TYR HB3 H 2.135 0.03 2 428 287 34 TYR HD1 H 6.603 0.03 3 429 287 34 TYR HD2 H 6.603 0.03 3 430 287 34 TYR HE1 H 6.627 0.03 3 431 287 34 TYR HE2 H 6.627 0.03 3 432 287 34 TYR C C 175.516 0.30 1 433 287 34 TYR CA C 58.978 0.30 1 434 287 34 TYR CB C 38.474 0.30 1 435 287 34 TYR CD1 C 133.217 0.30 3 436 287 34 TYR CD2 C 133.217 0.30 3 437 287 34 TYR CE1 C 118.375 0.30 3 438 287 34 TYR CE2 C 118.375 0.30 3 439 287 34 TYR N N 114.004 0.30 1 440 288 35 LYS H H 8.203 0.03 1 441 288 35 LYS HA H 4.063 0.03 1 442 288 35 LYS HB2 H 2.153 0.03 2 443 288 35 LYS HB3 H 1.985 0.03 2 444 288 35 LYS HG2 H 1.630 0.03 2 445 288 35 LYS HG3 H 1.630 0.03 2 446 288 35 LYS HD2 H 1.208 0.03 2 447 288 35 LYS HD3 H 1.291 0.03 2 448 288 35 LYS HE2 H 2.908 0.03 2 449 288 35 LYS HE3 H 2.908 0.03 2 450 288 35 LYS C C 174.827 0.30 1 451 288 35 LYS CA C 57.368 0.30 1 452 288 35 LYS CB C 28.258 0.30 1 453 288 35 LYS CG C 28.590 0.30 1 454 288 35 LYS CD C 25.147 0.30 1 455 288 35 LYS CE C 42.513 0.30 1 456 288 35 LYS N N 114.506 0.30 1 457 289 36 GLU H H 7.147 0.03 1 458 289 36 GLU HA H 4.621 0.03 1 459 289 36 GLU HB2 H 2.135 0.03 2 460 289 36 GLU HB3 H 1.807 0.03 2 461 289 36 GLU HG2 H 2.330 0.03 2 462 289 36 GLU HG3 H 2.330 0.03 2 463 289 36 GLU C C 173.813 0.30 1 464 289 36 GLU CA C 54.439 0.30 1 465 289 36 GLU CB C 34.288 0.30 1 466 289 36 GLU CG C 35.991 0.30 1 467 289 36 GLU N N 115.316 0.30 1 468 290 37 ASP H H 8.418 0.03 1 469 290 37 ASP HA H 4.877 0.03 1 470 290 37 ASP HB2 H 2.478 0.03 2 471 290 37 ASP HB3 H 2.478 0.03 2 472 290 37 ASP C C 176.709 0.30 1 473 290 37 ASP CA C 54.246 0.30 1 474 290 37 ASP CB C 41.953 0.30 1 475 290 37 ASP N N 118.350 0.30 1 476 291 38 LEU H H 9.096 0.03 1 477 291 38 LEU HA H 3.780 0.03 1 478 291 38 LEU HB2 H 1.472 0.03 2 479 291 38 LEU HB3 H 0.623 0.03 2 480 291 38 LEU HG H 1.257 0.03 1 481 291 38 LEU HD1 H 0.463 0.03 2 482 291 38 LEU HD2 H 0.228 0.03 2 483 291 38 LEU C C 175.681 0.30 1 484 291 38 LEU CA C 53.924 0.30 1 485 291 38 LEU CB C 42.215 0.30 1 486 291 38 LEU CG C 25.220 0.30 1 487 291 38 LEU CD1 C 26.539 0.30 1 488 291 38 LEU CD2 C 22.462 0.30 1 489 291 38 LEU N N 125.890 0.30 1 490 292 39 ASN H H 8.572 0.03 1 491 292 39 ASN HA H 4.431 0.03 1 492 292 39 ASN HB2 H 2.814 0.03 2 493 292 39 ASN HB3 H 2.705 0.03 2 494 292 39 ASN HD21 H 7.867 0.03 2 495 292 39 ASN HD22 H 7.106 0.03 2 496 292 39 ASN C C 176.043 0.30 1 497 292 39 ASN CA C 54.236 0.30 1 498 292 39 ASN CB C 39.265 0.30 1 499 292 39 ASN N N 126.255 0.30 1 500 292 39 ASN ND2 N 114.357 0.30 1 501 293 40 GLN H H 8.923 0.03 1 502 293 40 GLN HA H 3.789 0.03 1 503 293 40 GLN HB2 H 2.081 0.03 2 504 293 40 GLN HB3 H 2.034 0.03 2 505 293 40 GLN HG2 H 2.448 0.03 2 506 293 40 GLN HG3 H 2.360 0.03 2 507 293 40 GLN HE21 H 7.640 0.03 2 508 293 40 GLN HE22 H 6.805 0.03 2 509 293 40 GLN C C 178.088 0.30 1 510 293 40 GLN CA C 58.796 0.30 1 511 293 40 GLN CB C 28.162 0.30 1 512 293 40 GLN CG C 33.940 0.30 1 513 293 40 GLN N N 124.576 0.30 1 514 293 40 GLN NE2 N 111.990 0.30 1 515 294 41 GLY H H 8.743 0.03 1 516 294 41 GLY HA2 H 3.814 0.03 2 517 294 41 GLY HA3 H 3.814 0.03 2 518 294 41 GLY C C 176.454 0.30 1 519 294 41 GLY CA C 46.487 0.30 1 520 294 41 GLY N N 108.122 0.30 1 521 295 42 VAL H H 7.599 0.03 1 522 295 42 VAL HA H 3.478 0.03 1 523 295 42 VAL HB H 1.947 0.03 1 524 295 42 VAL HG1 H 0.876 0.03 2 525 295 42 VAL HG2 H 1.025 0.03 2 526 295 42 VAL C C 176.441 0.30 1 527 295 42 VAL CA C 64.966 0.30 1 528 295 42 VAL CB C 31.560 0.30 1 529 295 42 VAL CG1 C 21.703 0.30 1 530 295 42 VAL CG2 C 22.948 0.30 1 531 295 42 VAL N N 119.846 0.30 1 532 296 43 LEU H H 7.007 0.03 1 533 296 43 LEU HA H 3.099 0.03 1 534 296 43 LEU HB2 H 1.624 0.03 2 535 296 43 LEU HB3 H 1.385 0.03 2 536 296 43 LEU HG H 1.658 0.03 1 537 296 43 LEU HD1 H 0.879 0.03 2 538 296 43 LEU HD2 H 0.832 0.03 2 539 296 43 LEU C C 178.343 0.30 1 540 296 43 LEU CA C 56.807 0.30 1 541 296 43 LEU CB C 40.166 0.30 1 542 296 43 LEU CG C 27.669 0.30 1 543 296 43 LEU CD1 C 24.927 0.30 1 544 296 43 LEU CD2 C 23.735 0.30 1 545 296 43 LEU N N 115.675 0.30 1 546 297 44 GLN H H 7.048 0.03 1 547 297 44 GLN HA H 4.119 0.03 1 548 297 44 GLN HB2 H 2.126 0.03 2 549 297 44 GLN HB3 H 1.879 0.03 2 550 297 44 GLN HG2 H 2.277 0.03 2 551 297 44 GLN HG3 H 2.326 0.03 2 552 297 44 GLN HE21 H 7.513 0.03 2 553 297 44 GLN HE22 H 6.802 0.03 2 554 297 44 GLN C C 176.759 0.30 1 555 297 44 GLN CA C 56.202 0.30 1 556 297 44 GLN CB C 28.713 0.30 1 557 297 44 GLN CG C 34.013 0.30 1 558 297 44 GLN N N 113.053 0.30 1 559 297 44 GLN NE2 N 112.216 0.30 1 560 298 45 GLN H H 7.363 0.03 1 561 298 45 GLN HA H 3.937 0.03 1 562 298 45 GLN HB2 H 1.428 0.03 2 563 298 45 GLN HB3 H 1.057 0.03 2 564 298 45 GLN HG2 H 2.107 0.03 2 565 298 45 GLN HG3 H 2.139 0.03 2 566 298 45 GLN HE21 H 7.136 0.03 2 567 298 45 GLN HE22 H 6.721 0.03 2 568 298 45 GLN C C 176.641 0.30 1 569 298 45 GLN CA C 55.678 0.30 1 570 298 45 GLN CB C 28.406 0.30 1 571 298 45 GLN CG C 33.353 0.30 1 572 298 45 GLN N N 115.857 0.30 1 573 298 45 GLN NE2 N 111.827 0.30 1 574 299 46 PHE H H 6.350 0.03 1 575 299 46 PHE HA H 3.584 0.03 1 576 299 46 PHE HB2 H 3.063 0.03 2 577 299 46 PHE HB3 H 2.788 0.03 2 578 299 46 PHE HD1 H 6.930 0.03 3 579 299 46 PHE HD2 H 6.930 0.03 3 580 299 46 PHE HE1 H 7.090 0.03 3 581 299 46 PHE HE2 H 7.090 0.03 3 582 299 46 PHE HZ H 6.851 0.03 1 583 299 46 PHE C C 178.524 0.30 1 584 299 46 PHE CA C 59.363 0.30 1 585 299 46 PHE CB C 37.252 0.30 1 586 299 46 PHE CD1 C 130.920 0.30 3 587 299 46 PHE CD2 C 130.920 0.30 3 588 299 46 PHE CE1 C 130.866 0.30 3 589 299 46 PHE CE2 C 130.866 0.30 3 590 299 46 PHE CZ C 128.134 0.30 1 591 299 46 PHE N N 115.509 0.30 1 592 300 47 GLU H H 8.538 0.03 1 593 300 47 GLU HA H 3.867 0.03 1 594 300 47 GLU HB2 H 1.767 0.03 2 595 300 47 GLU HB3 H 1.717 0.03 2 596 300 47 GLU HG2 H 1.885 0.03 2 597 300 47 GLU HG3 H 1.637 0.03 2 598 300 47 GLU C C 175.371 0.30 1 599 300 47 GLU CA C 58.352 0.30 1 600 300 47 GLU CB C 29.751 0.30 1 601 300 47 GLU CG C 35.918 0.30 1 602 300 47 GLU N N 116.729 0.30 1 603 301 48 HIS H H 7.649 0.03 1 604 301 48 HIS HA H 4.904 0.03 1 605 301 48 HIS HB2 H 3.528 0.03 2 606 301 48 HIS HB3 H 3.050 0.03 2 607 301 48 HIS HD2 H 6.936 0.03 1 608 301 48 HIS HE1 H 7.561 0.03 1 609 301 48 HIS C C 174.482 0.30 1 610 301 48 HIS CA C 54.801 0.30 1 611 301 48 HIS CB C 29.751 0.30 1 612 301 48 HIS CD2 C 119.354 0.30 1 613 301 48 HIS CE1 C 138.522 0.30 1 614 301 48 HIS N N 116.003 0.30 1 615 302 49 TRP H H 7.561 0.03 1 616 302 49 TRP HA H 5.783 0.03 1 617 302 49 TRP HB2 H 3.510 0.03 2 618 302 49 TRP HB3 H 3.110 0.03 2 619 302 49 TRP HD1 H 7.211 0.03 1 620 302 49 TRP HE1 H 10.302 0.03 1 621 302 49 TRP HE3 H 7.415 0.03 1 622 302 49 TRP HZ2 H 7.464 0.03 1 623 302 49 TRP HZ3 H 6.889 0.03 1 624 302 49 TRP HH2 H 6.995 0.03 1 625 302 49 TRP C C 173.762 0.30 1 626 302 49 TRP CA C 52.070 0.30 1 627 302 49 TRP CB C 30.023 0.30 1 628 302 49 TRP CD1 C 123.911 0.30 1 629 302 49 TRP CE3 C 119.909 0.30 1 630 302 49 TRP CZ2 C 115.131 0.30 1 631 302 49 TRP CZ3 C 119.658 0.30 1 632 302 49 TRP CH2 C 123.965 0.30 1 633 302 49 TRP N N 118.844 0.30 1 634 302 49 TRP NE1 N 128.066 0.30 1 635 303 50 PRO HA H 5.068 0.03 1 636 303 50 PRO HB2 H 2.427 0.03 2 637 303 50 PRO HB3 H 2.126 0.03 2 638 303 50 PRO HG2 H 2.217 0.03 2 639 303 50 PRO HG3 H 2.118 0.03 2 640 303 50 PRO HD2 H 3.541 0.03 2 641 303 50 PRO HD3 H 4.173 0.03 2 642 303 50 PRO C C 176.905 0.30 1 643 303 50 PRO CA C 65.269 0.30 1 644 303 50 PRO CB C 31.008 0.30 1 645 303 50 PRO CG C 27.711 0.30 1 646 303 50 PRO CD C 51.379 0.30 1 647 304 51 HIS H H 9.300 0.03 1 648 304 51 HIS HA H 4.572 0.03 1 649 304 51 HIS HB2 H 3.156 0.03 2 650 304 51 HIS HB3 H 2.970 0.03 2 651 304 51 HIS HD2 H 6.914 0.03 1 652 304 51 HIS HE1 H 7.767 0.03 1 653 304 51 HIS C C 175.333 0.30 1 654 304 51 HIS CA C 57.110 0.30 1 655 304 51 HIS CB C 29.453 0.30 1 656 304 51 HIS CD2 C 118.631 0.30 1 657 304 51 HIS CE1 C 138.780 0.30 1 658 304 51 HIS N N 116.325 0.30 1 659 305 52 ILE H H 7.754 0.03 1 660 305 52 ILE HA H 4.084 0.03 1 661 305 52 ILE HB H 2.112 0.03 1 662 305 52 ILE HG12 H 0.544 0.03 1 663 305 52 ILE HG13 H 0.098 0.03 1 664 305 52 ILE HG2 H 0.757 0.03 2 665 305 52 ILE HD1 H 0.389 0.03 1 666 305 52 ILE C C 174.939 0.30 1 667 305 52 ILE CA C 60.544 0.30 1 668 305 52 ILE CB C 39.077 0.30 1 669 305 52 ILE CG1 C 26.247 0.30 2 670 305 52 ILE CG2 C 17.325 0.30 1 671 305 52 ILE CD1 C 11.497 0.30 1 672 305 52 ILE N N 118.869 0.30 1 673 306 53 CYS H H 8.398 0.03 1 674 306 53 CYS HA H 5.384 0.03 1 675 306 53 CYS HB2 H 2.653 0.03 2 676 306 53 CYS HB3 H 2.653 0.03 2 677 306 53 CYS C C 172.304 0.30 1 678 306 53 CYS CA C 55.245 0.30 1 679 306 53 CYS CB C 32.716 0.30 1 680 306 53 CYS N N 114.013 0.30 1 681 307 54 THR H H 8.905 0.03 1 682 307 54 THR HA H 4.476 0.03 1 683 307 54 THR HB H 3.796 0.03 1 684 307 54 THR HG2 H 1.143 0.03 1 685 307 54 THR C C 172.485 0.30 1 686 307 54 THR CA C 61.767 0.30 1 687 307 54 THR CB C 71.260 0.30 1 688 307 54 THR CG2 C 22.172 0.30 1 689 307 54 THR N N 116.936 0.30 1 690 308 55 VAL H H 8.909 0.03 1 691 308 55 VAL HA H 4.736 0.03 1 692 308 55 VAL HB H 1.955 0.03 1 693 308 55 VAL HG1 H 0.770 0.03 2 694 308 55 VAL HG2 H 0.836 0.03 2 695 308 55 VAL C C 175.840 0.30 1 696 308 55 VAL CA C 61.407 0.30 1 697 308 55 VAL CB C 32.943 0.30 1 698 308 55 VAL CG1 C 21.483 0.30 1 699 308 55 VAL CG2 C 21.283 0.30 1 700 308 55 VAL N N 126.237 0.30 1 701 309 56 GLU H H 9.343 0.03 1 702 309 56 GLU HA H 4.673 0.03 1 703 309 56 GLU HB2 H 2.065 0.03 2 704 309 56 GLU HB3 H 1.826 0.03 2 705 309 56 GLU HG2 H 2.135 0.03 2 706 309 56 GLU HG3 H 2.077 0.03 2 707 309 56 GLU C C 174.976 0.30 1 708 309 56 GLU CA C 55.131 0.30 1 709 309 56 GLU CB C 32.805 0.30 1 710 309 56 GLU CG C 36.211 0.30 1 711 309 56 GLU N N 128.810 0.30 1 712 310 57 LYS H H 8.804 0.03 1 713 310 57 LYS HA H 4.576 0.03 1 714 310 57 LYS HB2 H 1.841 0.03 2 715 310 57 LYS HB3 H 1.722 0.03 2 716 310 57 LYS HG2 H 1.440 0.03 2 717 310 57 LYS HG3 H 1.440 0.03 2 718 310 57 LYS HD2 H 1.484 0.03 2 719 310 57 LYS HD3 H 1.484 0.03 2 720 310 57 LYS HE2 H 2.973 0.03 2 721 310 57 LYS HE3 H 2.973 0.03 2 722 310 57 LYS C C 174.544 0.30 1 723 310 57 LYS CA C 53.834 0.30 1 724 310 57 LYS CB C 32.450 0.30 1 725 310 57 LYS CG C 28.923 0.30 1 726 310 57 LYS CD C 24.574 0.30 1 727 310 57 LYS CE C 42.048 0.30 1 728 310 57 LYS N N 126.122 0.30 1 729 311 58 PRO HA H 4.576 0.03 1 730 311 58 PRO HB2 H 2.054 0.03 2 731 311 58 PRO HB3 H 2.359 0.03 2 732 311 58 PRO HG2 H 2.126 0.03 2 733 311 58 PRO HG3 H 2.073 0.03 2 734 311 58 PRO HD2 H 3.944 0.03 2 735 311 58 PRO HD3 H 3.875 0.03 2 736 311 58 PRO C C 177.448 0.30 1 737 311 58 PRO CA C 62.953 0.30 1 738 311 58 PRO CB C 32.350 0.30 1 739 311 58 PRO CG C 27.244 0.30 1 740 311 58 PRO CD C 51.013 0.30 1 741 312 59 CYS H H 8.816 0.03 1 742 312 59 CYS HA H 4.436 0.03 1 743 312 59 CYS HB2 H 2.982 0.03 2 744 312 59 CYS HB3 H 2.982 0.03 2 745 312 59 CYS C C 175.802 0.30 1 746 312 59 CYS CA C 59.515 0.30 1 747 312 59 CYS CB C 27.496 0.30 1 748 312 59 CYS N N 120.577 0.30 1 749 313 60 GLY H H 8.325 0.03 1 750 313 60 GLY HA2 H 4.150 0.03 2 751 313 60 GLY HA3 H 3.931 0.03 2 752 313 60 GLY C C 174.956 0.30 1 753 313 60 GLY CA C 45.462 0.30 1 754 313 60 GLY N N 108.548 0.30 1 755 314 61 GLY H H 8.300 0.03 1 756 314 61 GLY HA2 H 3.978 0.03 2 757 314 61 GLY HA3 H 3.978 0.03 2 758 314 61 GLY C C 174.671 0.30 1 759 314 61 GLY CA C 45.337 0.30 1 760 314 61 GLY N N 108.423 0.30 1 761 315 62 GLY H H 8.393 0.03 1 762 315 62 GLY HA2 H 4.070 0.03 2 763 315 62 GLY HA3 H 3.955 0.03 2 764 315 62 GLY C C 174.160 0.30 1 765 315 62 GLY CA C 45.207 0.30 1 766 315 62 GLY N N 108.991 0.30 1 767 316 63 GLN H H 8.356 0.03 1 768 316 63 GLN HA H 4.355 0.03 1 769 316 63 GLN HB2 H 2.188 0.03 2 770 316 63 GLN HB3 H 1.905 0.03 2 771 316 63 GLN HG2 H 2.307 0.03 2 772 316 63 GLN HG3 H 2.307 0.03 2 773 316 63 GLN HE21 H 7.570 0.03 2 774 316 63 GLN HE22 H 6.900 0.03 2 775 316 63 GLN C C 175.504 0.30 1 776 316 63 GLN CA C 56.060 0.30 1 777 316 63 GLN CB C 29.795 0.30 1 778 316 63 GLN CG C 33.866 0.30 1 779 316 63 GLN N N 118.411 0.30 1 780 316 63 GLN NE2 N 113.325 0.30 1 781 317 64 ASP H H 8.083 0.03 1 782 317 64 ASP HA H 4.945 0.03 1 783 317 64 ASP HB2 H 2.757 0.03 2 784 317 64 ASP HB3 H 2.499 0.03 2 785 317 64 ASP C C 175.625 0.30 1 786 317 64 ASP CA C 53.177 0.30 1 787 317 64 ASP CB C 42.821 0.30 1 788 317 64 ASP N N 121.273 0.30 1 789 318 65 SER H H 8.559 0.03 1 790 318 65 SER HA H 5.025 0.03 1 791 318 65 SER HB2 H 3.843 0.03 2 792 318 65 SER HB3 H 3.648 0.03 2 793 318 65 SER C C 171.274 0.30 1 794 318 65 SER CA C 58.192 0.30 1 795 318 65 SER CB C 66.394 0.30 1 796 318 65 SER N N 115.280 0.30 1 797 319 66 LEU H H 8.577 0.03 1 798 319 66 LEU HA H 4.238 0.03 1 799 319 66 LEU HB2 H 1.224 0.03 2 800 319 66 LEU HB3 H 0.540 0.03 2 801 319 66 LEU HG H 0.239 0.03 1 802 319 66 LEU HD1 H 0.279 0.03 2 803 319 66 LEU HD2 H -0.584 0.03 2 804 319 66 LEU C C 174.565 0.30 1 805 319 66 LEU CA C 54.135 0.30 1 806 319 66 LEU CB C 46.215 0.30 1 807 319 66 LEU CG C 26.612 0.30 1 808 319 66 LEU CD1 C 25.220 0.30 1 809 319 66 LEU CD2 C 22.875 0.30 1 810 319 66 LEU N N 123.537 0.30 1 811 320 67 LEU H H 8.786 0.03 1 812 320 67 LEU HA H 4.930 0.03 1 813 320 67 LEU HB2 H 1.490 0.03 2 814 320 67 LEU HB3 H 1.142 0.03 2 815 320 67 LEU HG H 1.310 0.03 1 816 320 67 LEU HD1 H 0.509 0.03 2 817 320 67 LEU HD2 H 0.302 0.03 2 818 320 67 LEU C C 175.601 0.30 1 819 320 67 LEU CA C 52.985 0.30 1 820 320 67 LEU CB C 45.429 0.30 1 821 320 67 LEU CG C 26.739 0.30 1 822 320 67 LEU CD1 C 25.280 0.30 1 823 320 67 LEU CD2 C 25.646 0.30 1 824 320 67 LEU N N 121.689 0.30 1 825 321 68 TYR H H 8.978 0.03 1 826 321 68 TYR HA H 4.921 0.03 1 827 321 68 TYR HB2 H 2.999 0.03 2 828 321 68 TYR HB3 H 2.426 0.03 2 829 321 68 TYR HD1 H 6.809 0.03 3 830 321 68 TYR HD2 H 6.809 0.03 3 831 321 68 TYR HE1 H 6.433 0.03 3 832 321 68 TYR HE2 H 6.433 0.03 3 833 321 68 TYR C C 173.526 0.30 1 834 321 68 TYR CA C 56.086 0.30 1 835 321 68 TYR CB C 40.515 0.30 1 836 321 68 TYR CD1 C 132.830 0.30 3 837 321 68 TYR CD2 C 132.830 0.30 3 838 321 68 TYR CE1 C 118.031 0.30 3 839 321 68 TYR CE2 C 118.031 0.30 3 840 321 68 TYR N N 124.207 0.30 1 841 322 69 PRO HA H 4.511 0.03 1 842 322 69 PRO HB2 H 2.384 0.03 2 843 322 69 PRO HB3 H 1.881 0.03 2 844 322 69 PRO HG2 H 2.158 0.03 2 845 322 69 PRO HG3 H 2.080 0.03 2 846 322 69 PRO HD2 H 3.759 0.03 2 847 322 69 PRO HD3 H 4.024 0.03 2 848 322 69 PRO C C 176.023 0.30 1 849 322 69 PRO CA C 62.694 0.30 1 850 322 69 PRO CB C 32.026 0.30 1 851 322 69 PRO CG C 27.858 0.30 1 852 322 69 PRO CD C 50.720 0.30 1 853 323 70 ALA H H 7.820 0.03 1 854 323 70 ALA HA H 3.876 0.03 1 855 323 70 ALA HB H 1.080 0.03 1 856 323 70 ALA C C 177.212 0.30 1 857 323 70 ALA CA C 52.725 0.30 1 858 323 70 ALA CB C 18.883 0.30 1 859 323 70 ALA N N 123.941 0.30 1 860 324 71 ARG H H 8.419 0.03 1 861 324 71 ARG HA H 4.236 0.03 1 862 324 71 ARG HB2 H 1.778 0.03 2 863 324 71 ARG HB3 H 1.687 0.03 2 864 324 71 ARG HG2 H 1.614 0.03 2 865 324 71 ARG HG3 H 1.553 0.03 2 866 324 71 ARG HD2 H 3.134 0.03 2 867 324 71 ARG HD3 H 3.134 0.03 2 868 324 71 ARG HE H 7.193 0.03 1 869 324 71 ARG C C 175.937 0.30 1 870 324 71 ARG CA C 55.980 0.30 1 871 324 71 ARG CB C 30.603 0.30 1 872 324 71 ARG CG C 27.125 0.30 1 873 324 71 ARG CD C 43.392 0.30 1 874 324 71 ARG N N 120.227 0.30 1 875 324 71 ARG NE N 84.743 0.30 1 876 325 72 ARG H H 8.305 0.03 1 877 325 72 ARG HA H 4.298 0.03 1 878 325 72 ARG HB2 H 1.746 0.03 2 879 325 72 ARG HB3 H 1.746 0.03 2 880 325 72 ARG HG2 H 1.556 0.03 2 881 325 72 ARG HG3 H 1.556 0.03 2 882 325 72 ARG HD2 H 3.064 0.03 2 883 325 72 ARG HD3 H 3.064 0.03 2 884 325 72 ARG HE H 7.711 0.03 1 885 325 72 ARG C C 176.069 0.30 1 886 325 72 ARG CA C 55.815 0.30 1 887 325 72 ARG CB C 30.860 0.30 1 888 325 72 ARG CG C 26.905 0.30 1 889 325 72 ARG CD C 43.392 0.30 1 890 325 72 ARG N N 122.809 0.30 1 891 326 73 GLU H H 8.534 0.03 1 892 326 73 GLU HA H 4.244 0.03 1 893 326 73 GLU HB2 H 1.969 0.03 2 894 326 73 GLU HB3 H 1.862 0.03 2 895 326 73 GLU HG2 H 2.220 0.03 2 896 326 73 GLU HG3 H 2.220 0.03 2 897 326 73 GLU C C 176.023 0.30 1 898 326 73 GLU CA C 56.255 0.30 1 899 326 73 GLU CB C 30.371 0.30 1 900 326 73 GLU CG C 36.138 0.30 1 901 326 73 GLU N N 122.621 0.30 1 902 327 74 GLN H H 8.449 0.03 1 903 327 74 GLN HA H 4.558 0.03 1 904 327 74 GLN HB2 H 2.053 0.03 2 905 327 74 GLN HB3 H 1.888 0.03 2 906 327 74 GLN HG2 H 2.330 0.03 2 907 327 74 GLN HG3 H 2.330 0.03 2 908 327 74 GLN HE21 H 7.575 0.03 2 909 327 74 GLN HE22 H 6.883 0.03 2 910 327 74 GLN C C 175.630 0.30 1 911 327 74 GLN CA C 53.521 0.30 1 912 327 74 GLN CB C 29.176 0.30 1 913 327 74 GLN CG C 33.654 0.30 1 914 327 74 GLN N N 122.581 0.30 1 915 327 74 GLN NE2 N 112.720 0.30 1 916 328 75 PRO HA H 4.373 0.03 1 917 328 75 PRO HB2 H 2.240 0.03 2 918 328 75 PRO HB3 H 1.843 0.03 2 919 328 75 PRO HG2 H 1.970 0.03 2 920 328 75 PRO HG3 H 1.970 0.03 2 921 328 75 PRO HD2 H 3.716 0.03 2 922 328 75 PRO HD3 H 3.579 0.03 2 923 328 75 PRO C C 176.685 0.30 1 924 328 75 PRO CA C 62.837 0.30 1 925 328 75 PRO CB C 32.106 0.30 1 926 328 75 PRO CG C 27.345 0.30 1 927 328 75 PRO CD C 50.573 0.30 1 928 329 76 LEU H H 8.386 0.03 1 929 329 76 LEU HA H 4.273 0.03 1 930 329 76 LEU HB2 H 1.595 0.03 2 931 329 76 LEU HB3 H 1.527 0.03 2 932 329 76 LEU HG H 1.613 0.03 1 933 329 76 LEU HD1 H 0.884 0.03 2 934 329 76 LEU HD2 H 0.884 0.03 2 935 329 76 LEU C C 177.426 0.30 1 936 329 76 LEU CA C 55.131 0.30 1 937 329 76 LEU CB C 42.500 0.30 1 938 329 76 LEU CG C 27.154 0.30 1 939 329 76 LEU CD1 C 24.780 0.30 1 940 329 76 LEU CD2 C 23.535 0.30 1 941 329 76 LEU N N 122.745 0.30 1 942 330 77 LYS H H 8.379 0.03 1 943 330 77 LYS HA H 4.338 0.03 1 944 330 77 LYS HB2 H 1.790 0.03 2 945 330 77 LYS HB3 H 1.746 0.03 2 946 330 77 LYS HG2 H 1.666 0.03 2 947 330 77 LYS HG3 H 1.666 0.03 2 948 330 77 LYS HD2 H 1.408 0.03 2 949 330 77 LYS HD3 H 1.408 0.03 2 950 330 77 LYS HE2 H 2.970 0.03 2 951 330 77 LYS HE3 H 2.970 0.03 2 952 330 77 LYS C C 176.504 0.30 1 953 330 77 LYS CA C 56.182 0.30 1 954 330 77 LYS CB C 33.188 0.30 1 955 330 77 LYS CG C 29.030 0.30 1 956 330 77 LYS CD C 24.634 0.30 1 957 330 77 LYS CE C 42.073 0.30 1 958 330 77 LYS N N 122.745 0.30 1 959 331 78 SER H H 8.450 0.03 1 960 331 78 SER HA H 4.430 0.03 1 961 331 78 SER HB2 H 3.879 0.03 2 962 331 78 SER HB3 H 3.791 0.03 2 963 331 78 SER C C 174.461 0.30 1 964 331 78 SER CA C 57.957 0.30 1 965 331 78 SER CB C 63.951 0.30 1 966 331 78 SER N N 117.485 0.30 1 967 332 79 ASP H H 8.422 0.03 1 968 332 79 ASP HA H 4.580 0.03 1 969 332 79 ASP HB2 H 2.650 0.03 2 970 332 79 ASP HB3 H 2.650 0.03 2 971 332 79 ASP C C 175.991 0.30 1 972 332 79 ASP CA C 54.467 0.30 1 973 332 79 ASP CB C 40.840 0.30 1 974 332 79 ASP N N 122.425 0.30 1 975 333 80 GLN H H 8.158 0.03 1 976 333 80 GLN HA H 4.286 0.03 1 977 333 80 GLN HB2 H 2.056 0.03 2 978 333 80 GLN HB3 H 1.905 0.03 2 979 333 80 GLN HG2 H 2.298 0.03 2 980 333 80 GLN HG3 H 2.298 0.03 2 981 333 80 GLN HE21 H 7.575 0.03 2 982 333 80 GLN HE22 H 6.883 0.03 2 983 333 80 GLN C C 175.361 0.30 1 984 333 80 GLN CA C 55.400 0.30 1 985 333 80 GLN CB C 29.710 0.30 1 986 333 80 GLN CG C 33.720 0.30 1 987 333 80 GLN N N 119.371 0.30 1 988 333 80 GLN NE2 N 112.720 0.30 1 989 334 81 ASP H H 8.353 0.03 1 990 334 81 ASP HA H 4.815 0.03 1 991 334 81 ASP HB2 H 2.719 0.03 2 992 334 81 ASP HB3 H 2.519 0.03 2 993 334 81 ASP C C 174.651 0.30 1 994 334 81 ASP CA C 52.448 0.30 1 995 334 81 ASP CB C 40.898 0.30 1 996 334 81 ASP N N 123.342 0.30 1 997 335 82 PRO HA H 4.394 0.03 1 998 335 82 PRO HB2 H 2.287 0.03 2 999 335 82 PRO HB3 H 1.932 0.03 2 1000 335 82 PRO HG2 H 1.987 0.03 2 1001 335 82 PRO HG3 H 1.987 0.03 2 1002 335 82 PRO HD2 H 3.845 0.03 2 1003 335 82 PRO HD3 H 3.658 0.03 2 1004 335 82 PRO C C 177.373 0.30 1 1005 335 82 PRO CA C 63.721 0.30 1 1006 335 82 PRO CB C 32.161 0.30 1 1007 335 82 PRO CG C 27.198 0.30 1 1008 335 82 PRO CD C 50.793 0.30 1 1009 336 83 GLU H H 8.501 0.03 1 1010 336 83 GLU HA H 4.178 0.03 1 1011 336 83 GLU HB2 H 2.038 0.03 2 1012 336 83 GLU HB3 H 1.932 0.03 2 1013 336 83 GLU HG2 H 2.289 0.03 2 1014 336 83 GLU HG3 H 2.215 0.03 2 1015 336 83 GLU C C 176.734 0.30 1 1016 336 83 GLU CA C 56.836 0.30 1 1017 336 83 GLU CB C 29.756 0.30 1 1018 336 83 GLU CG C 36.504 0.30 1 1019 336 83 GLU N N 119.750 0.30 1 1020 337 84 LYS H H 8.033 0.03 1 1021 337 84 LYS HA H 4.249 0.03 1 1022 337 84 LYS HB2 H 1.826 0.03 2 1023 337 84 LYS HB3 H 1.729 0.03 2 1024 337 84 LYS HG2 H 1.658 0.03 2 1025 337 84 LYS HG3 H 1.658 0.03 2 1026 337 84 LYS HD2 H 1.400 0.03 2 1027 337 84 LYS HD3 H 1.400 0.03 2 1028 337 84 LYS HE2 H 2.970 0.03 2 1029 337 84 LYS HE3 H 2.970 0.03 2 1030 337 84 LYS C C 176.117 0.30 1 1031 337 84 LYS CA C 56.273 0.30 1 1032 337 84 LYS CB C 33.191 0.30 1 1033 337 84 LYS CG C 28.957 0.30 1 1034 337 84 LYS CD C 24.853 0.30 1 1035 337 84 LYS CE C 42.146 0.30 1 1036 337 84 LYS N N 121.329 0.30 1 1037 338 85 GLU H H 8.256 0.03 1 1038 338 85 GLU HA H 4.244 0.03 1 1039 338 85 GLU HB2 H 1.986 0.03 2 1040 338 85 GLU HB3 H 1.870 0.03 2 1041 338 85 GLU HG2 H 2.228 0.03 2 1042 338 85 GLU HG3 H 2.228 0.03 2 1043 338 85 GLU C C 174.503 0.30 1 1044 338 85 GLU CA C 56.459 0.30 1 1045 338 85 GLU CB C 30.382 0.30 1 1046 338 85 GLU CG C 36.284 0.30 1 1047 338 85 GLU N N 121.867 0.30 1 1048 339 86 LEU H H 8.341 0.03 1 1049 339 86 LEU HA H 4.562 0.03 1 1050 339 86 LEU HB2 H 1.565 0.03 2 1051 339 86 LEU HB3 H 1.509 0.03 2 1052 339 86 LEU HG H 1.730 0.03 1 1053 339 86 LEU HD1 H 0.906 0.03 2 1054 339 86 LEU HD2 H 0.872 0.03 2 1055 339 86 LEU C C 175.174 0.30 1 1056 339 86 LEU CA C 52.876 0.30 1 1057 339 86 LEU CB C 41.588 0.30 1 1058 339 86 LEU CG C 26.863 0.30 1 1059 339 86 LEU CD1 C 25.108 0.30 1 1060 339 86 LEU CD2 C 23.277 0.30 1 1061 339 86 LEU N N 125.578 0.30 1 1062 340 87 PRO HA H 4.665 0.03 1 1063 340 87 PRO HB2 H 2.307 0.03 2 1064 340 87 PRO HB3 H 1.863 0.03 2 1065 340 87 PRO HG2 H 1.998 0.03 2 1066 340 87 PRO HG3 H 1.998 0.03 2 1067 340 87 PRO HD2 H 3.809 0.03 2 1068 340 87 PRO HD3 H 3.587 0.03 2 1069 340 87 PRO CA C 61.187 0.30 1 1070 340 87 PRO CB C 30.450 0.30 1 1071 340 87 PRO CG C 27.168 0.30 1 1072 340 87 PRO CD C 50.344 0.30 1 1073 341 88 PRO HA H 4.645 0.03 1 1074 341 88 PRO HB2 H 2.357 0.03 2 1075 341 88 PRO HB3 H 2.071 0.03 2 1076 341 88 PRO HG2 H 1.902 0.03 2 1077 341 88 PRO HG3 H 1.794 0.03 2 1078 341 88 PRO HD2 H 3.449 0.03 2 1079 341 88 PRO HD3 H 3.449 0.03 2 1080 341 88 PRO CA C 62.316 0.30 1 1081 341 88 PRO CB C 34.355 0.30 1 1082 341 88 PRO CG C 24.725 0.30 1 1083 341 88 PRO CD C 50.167 0.30 1 1084 342 89 PRO HA H 4.645 0.03 1 1085 342 89 PRO HB2 H 2.357 0.03 2 1086 342 89 PRO HB3 H 2.071 0.03 2 1087 342 89 PRO HG2 H 1.902 0.03 2 1088 342 89 PRO HG3 H 1.794 0.03 2 1089 342 89 PRO HD2 H 3.449 0.03 2 1090 342 89 PRO HD3 H 3.449 0.03 2 1091 342 89 PRO CA C 62.316 0.30 1 1092 342 89 PRO CB C 34.355 0.30 1 1093 342 89 PRO CG C 24.725 0.30 1 1094 342 89 PRO CD C 50.167 0.30 1 1095 343 90 PRO HA H 4.645 0.03 1 1096 343 90 PRO HB2 H 2.357 0.03 2 1097 343 90 PRO HB3 H 2.071 0.03 2 1098 343 90 PRO HG2 H 1.902 0.03 2 1099 343 90 PRO HG3 H 1.794 0.03 2 1100 343 90 PRO HD2 H 3.449 0.03 2 1101 343 90 PRO HD3 H 3.449 0.03 2 1102 343 90 PRO CA C 62.316 0.30 1 1103 343 90 PRO CB C 34.355 0.30 1 1104 343 90 PRO CG C 24.725 0.30 1 1105 343 90 PRO CD C 50.167 0.30 1 1106 344 91 PRO HA H 4.377 0.03 1 1107 344 91 PRO HB2 H 2.236 0.03 2 1108 344 91 PRO HB3 H 1.852 0.03 2 1109 344 91 PRO HG2 H 1.970 0.03 2 1110 344 91 PRO HG3 H 1.970 0.03 2 1111 344 91 PRO HD2 H 3.775 0.03 2 1112 344 91 PRO HD3 H 3.580 0.03 2 1113 344 91 PRO C C 176.265 0.30 1 1114 344 91 PRO CA C 62.628 0.30 1 1115 344 91 PRO CB C 31.923 0.30 1 1116 344 91 PRO CG C 27.272 0.30 1 1117 344 91 PRO CD C 50.353 0.30 1 1118 345 92 ALA H H 8.353 0.03 1 1119 345 92 ALA HA H 4.530 0.03 1 1120 345 92 ALA HB H 1.322 0.03 1 1121 345 92 ALA C C 175.549 0.30 1 1122 345 92 ALA CA C 50.317 0.30 1 1123 345 92 ALA CB C 18.100 0.30 1 1124 345 92 ALA N N 125.578 0.30 1 1125 346 93 PRO HA H 4.364 0.03 1 1126 346 93 PRO HB2 H 2.259 0.03 2 1127 346 93 PRO HB3 H 1.852 0.03 2 1128 346 93 PRO HG2 H 1.986 0.03 2 1129 346 93 PRO HG3 H 1.986 0.03 2 1130 346 93 PRO HD2 H 3.593 0.03 2 1131 346 93 PRO HD3 H 3.775 0.03 2 1132 346 93 PRO C C 176.793 0.30 1 1133 346 93 PRO CA C 62.854 0.30 1 1134 346 93 PRO CB C 31.994 0.30 1 1135 346 93 PRO CG C 27.272 0.30 1 1136 346 93 PRO CD C 50.426 0.30 1 1137 347 94 LYS H H 8.436 0.03 1 1138 347 94 LYS HA H 4.214 0.03 1 1139 347 94 LYS HB2 H 1.746 0.03 2 1140 347 94 LYS HB3 H 1.746 0.03 2 1141 347 94 LYS HG2 H 1.666 0.03 2 1142 347 94 LYS HG3 H 1.666 0.03 2 1143 347 94 LYS HD2 H 1.416 0.03 2 1144 347 94 LYS HD3 H 1.416 0.03 2 1145 347 94 LYS HE2 H 2.970 0.03 2 1146 347 94 LYS HE3 H 2.970 0.03 2 1147 347 94 LYS C C 176.436 0.30 1 1148 347 94 LYS CA C 56.190 0.30 1 1149 347 94 LYS CB C 33.005 0.30 1 1150 347 94 LYS CG C 29.030 0.30 1 1151 347 94 LYS CD C 24.634 0.30 1 1152 347 94 LYS CE C 42.146 0.30 1 1153 347 94 LYS N N 122.112 0.30 1 1154 348 95 GLN H H 8.457 0.03 1 1155 348 95 GLN HA H 4.322 0.03 1 1156 348 95 GLN HB2 H 2.025 0.03 2 1157 348 95 GLN HB3 H 1.931 0.03 2 1158 348 95 GLN HG2 H 2.322 0.03 2 1159 348 95 GLN HG3 H 2.322 0.03 2 1160 348 95 GLN HE21 H 7.575 0.03 2 1161 348 95 GLN HE22 H 6.883 0.03 2 1162 348 95 GLN C C 175.647 0.30 1 1163 348 95 GLN CA C 55.506 0.30 1 1164 348 95 GLN CB C 29.417 0.30 1 1165 348 95 GLN CG C 33.793 0.30 1 1166 348 95 GLN N N 122.581 0.30 1 1167 348 95 GLN NE2 N 112.720 0.30 1 1168 349 96 GLU H H 8.561 0.03 1 1169 349 96 GLU HA H 4.267 0.03 1 1170 349 96 GLU HB2 H 1.923 0.03 2 1171 349 96 GLU HB3 H 1.923 0.03 2 1172 349 96 GLU HG2 H 2.220 0.03 2 1173 349 96 GLU HG3 H 2.220 0.03 2 1174 349 96 GLU C C 176.153 0.30 1 1175 349 96 GLU CA C 56.340 0.30 1 1176 349 96 GLU CB C 30.360 0.30 1 1177 349 96 GLU CG C 36.138 0.30 1 1178 349 96 GLU N N 123.613 0.30 1 1179 350 97 VAL H H 8.362 0.03 1 1180 350 97 VAL HA H 4.401 0.03 1 1181 350 97 VAL HB H 2.050 0.03 1 1182 350 97 VAL HG1 H 0.908 0.03 2 1183 350 97 VAL HG2 H 0.953 0.03 2 1184 350 97 VAL C C 174.468 0.30 1 1185 350 97 VAL CA C 59.817 0.30 1 1186 350 97 VAL CB C 32.550 0.30 1 1187 350 97 VAL CG1 C 20.530 0.30 1 1188 350 97 VAL CG2 C 20.963 0.30 1 1189 350 97 VAL N N 123.342 0.30 1 1190 351 98 PRO HA H 4.417 0.03 1 1191 351 98 PRO HB2 H 2.286 0.03 2 1192 351 98 PRO HB3 H 1.888 0.03 2 1193 351 98 PRO HG2 H 1.997 0.03 2 1194 351 98 PRO HG3 H 1.997 0.03 2 1195 351 98 PRO HD2 H 3.673 0.03 2 1196 351 98 PRO HD3 H 3.853 0.03 2 1197 351 98 PRO C C 176.981 0.30 1 1198 351 98 PRO CA C 63.239 0.30 1 1199 351 98 PRO CB C 31.923 0.30 1 1200 351 98 PRO CG C 27.345 0.30 1 1201 351 98 PRO CD C 51.086 0.30 1 1202 352 99 SER H H 8.481 0.03 1 1203 352 99 SER HA H 4.373 0.03 1 1204 352 99 SER HB2 H 3.874 0.03 2 1205 352 99 SER HB3 H 3.791 0.03 2 1206 352 99 SER C C 174.754 0.30 1 1207 352 99 SER CA C 58.438 0.30 1 1208 352 99 SER CB C 63.865 0.30 1 1209 352 99 SER N N 116.487 0.30 1 1210 353 100 GLN H H 8.502 0.03 1 1211 353 100 GLN HA H 4.345 0.03 1 1212 353 100 GLN HB2 H 2.118 0.03 2 1213 353 100 GLN HB3 H 1.967 0.03 2 1214 353 100 GLN HG2 H 2.353 0.03 2 1215 353 100 GLN HG3 H 2.353 0.03 2 1216 353 100 GLN HE21 H 7.575 0.03 2 1217 353 100 GLN HE22 H 6.883 0.03 2 1218 353 100 GLN C C 176.312 0.30 1 1219 353 100 GLN CA C 56.042 0.30 1 1220 353 100 GLN CB C 29.481 0.30 1 1221 353 100 GLN CG C 33.720 0.30 1 1222 353 100 GLN N N 122.228 0.30 1 1223 353 100 GLN NE2 N 112.720 0.30 1 1224 354 101 GLY H H 8.428 0.03 1 1225 354 101 GLY HA2 H 3.934 0.03 2 1226 354 101 GLY HA3 H 3.934 0.03 2 1227 354 101 GLY C C 173.680 0.30 1 1228 354 101 GLY CA C 45.067 0.30 1 1229 354 101 GLY N N 110.028 0.30 1 1230 355 102 SER H H 8.239 0.03 1 1231 355 102 SER HA H 4.734 0.03 1 1232 355 102 SER HB2 H 3.830 0.03 2 1233 355 102 SER HB3 H 3.752 0.03 2 1234 355 102 SER C C 172.493 0.30 1 1235 355 102 SER CA C 56.495 0.30 1 1236 355 102 SER CB C 63.314 0.30 1 1237 355 102 SER N N 117.008 0.30 1 1238 356 103 PRO HA H 4.391 0.03 1 1239 356 103 PRO HB2 H 2.233 0.03 2 1240 356 103 PRO HB3 H 1.861 0.03 2 1241 356 103 PRO HG2 H 1.986 0.03 2 1242 356 103 PRO HG3 H 1.986 0.03 2 1243 356 103 PRO HD2 H 3.798 0.03 2 1244 356 103 PRO HD3 H 3.658 0.03 2 1245 356 103 PRO C C 176.314 0.30 1 1246 356 103 PRO CA C 63.164 0.30 1 1247 356 103 PRO CB C 32.064 0.30 1 1248 356 103 PRO CG C 27.345 0.30 1 1249 356 103 PRO CD C 50.720 0.30 1 1250 357 104 ALA H H 8.359 0.03 1 1251 357 104 ALA HA H 4.252 0.03 1 1252 357 104 ALA HB H 1.322 0.03 1 1253 357 104 ALA C C 177.544 0.30 1 1254 357 104 ALA CA C 52.514 0.30 1 1255 357 104 ALA CB C 19.334 0.30 1 1256 357 104 ALA N N 124.244 0.30 1 1257 358 105 VAL H H 8.060 0.03 1 1258 358 105 VAL HA H 3.986 0.03 1 1259 358 105 VAL HB H 1.884 0.03 1 1260 358 105 VAL HG1 H 0.837 0.03 2 1261 358 105 VAL HG2 H 0.837 0.03 2 1262 358 105 VAL C C 175.568 0.30 1 1263 358 105 VAL CA C 61.791 0.30 1 1264 358 105 VAL CB C 32.680 0.30 1 1265 358 105 VAL CG1 C 21.109 0.30 1 1266 358 105 VAL CG2 C 21.190 0.30 1 1267 358 105 VAL N N 119.293 0.30 1 1268 359 106 MET H H 8.754 0.03 1 1269 359 106 MET HA H 4.663 0.03 1 1270 359 106 MET HB2 H 1.932 0.03 2 1271 359 106 MET HB3 H 2.134 0.03 2 1272 359 106 MET HG2 H 2.743 0.03 2 1273 359 106 MET HG3 H 2.583 0.03 2 1274 359 106 MET HE H 2.083 0.03 1 1275 359 106 MET C C 175.337 0.30 1 1276 359 106 MET CA C 54.261 0.30 1 1277 359 106 MET CB C 31.894 0.30 1 1278 359 106 MET CG C 32.346 0.30 1 1279 359 106 MET CE C 17.308 0.30 1 1280 359 106 MET N N 125.779 0.30 1 1281 360 107 PRO HA H 4.210 0.03 1 1282 360 107 PRO HB2 H 2.364 0.03 2 1283 360 107 PRO HB3 H 1.975 0.03 2 1284 360 107 PRO HG2 H 1.993 0.03 2 1285 360 107 PRO HG3 H 1.993 0.03 2 1286 360 107 PRO HD2 H 3.802 0.03 2 1287 360 107 PRO HD3 H 3.625 0.03 2 1288 360 107 PRO C C 177.702 0.30 1 1289 360 107 PRO CA C 65.465 0.30 1 1290 360 107 PRO CB C 31.919 0.30 1 1291 360 107 PRO CG C 27.345 0.30 1 1292 360 107 PRO CD C 50.793 0.30 1 1293 361 108 ASP H H 8.545 0.03 1 1294 361 108 ASP HA H 4.502 0.03 1 1295 361 108 ASP HB2 H 2.660 0.03 2 1296 361 108 ASP HB3 H 2.588 0.03 2 1297 361 108 ASP C C 177.460 0.30 1 1298 361 108 ASP CA C 55.602 0.30 1 1299 361 108 ASP CB C 40.358 0.30 1 1300 361 108 ASP N N 116.729 0.30 1 1301 362 109 VAL H H 7.407 0.03 1 1302 362 109 VAL HA H 3.664 0.03 1 1303 362 109 VAL HB H 2.126 0.03 1 1304 362 109 VAL HG1 H 0.626 0.03 2 1305 362 109 VAL HG2 H 0.867 0.03 2 1306 362 109 VAL C C 177.428 0.30 1 1307 362 109 VAL CA C 66.073 0.30 1 1308 362 109 VAL CB C 31.572 0.30 1 1309 362 109 VAL CG1 C 21.006 0.30 1 1310 362 109 VAL CG2 C 22.509 0.30 1 1311 362 109 VAL N N 120.085 0.30 1 1312 363 110 LYS H H 7.998 0.03 1 1313 363 110 LYS HA H 3.652 0.03 1 1314 363 110 LYS HB2 H 1.879 0.03 2 1315 363 110 LYS HB3 H 1.879 0.03 2 1316 363 110 LYS HG2 H 1.768 0.03 2 1317 363 110 LYS HG3 H 1.768 0.03 2 1318 363 110 LYS HD2 H 1.554 0.03 2 1319 363 110 LYS HD3 H 1.195 0.03 2 1320 363 110 LYS HE2 H 2.997 0.03 2 1321 363 110 LYS HE3 H 2.997 0.03 2 1322 363 110 LYS C C 177.910 0.30 1 1323 363 110 LYS CA C 61.549 0.30 1 1324 363 110 LYS CB C 31.982 0.30 1 1325 363 110 LYS CG C 29.790 0.30 1 1326 363 110 LYS CD C 26.734 0.30 1 1327 363 110 LYS CE C 41.927 0.30 1 1328 363 110 LYS N N 119.362 0.30 1 1329 364 111 GLU H H 8.105 0.03 1 1330 364 111 GLU HA H 4.049 0.03 1 1331 364 111 GLU HB2 H 2.118 0.03 2 1332 364 111 GLU HB3 H 2.037 0.03 2 1333 364 111 GLU HG2 H 2.344 0.03 2 1334 364 111 GLU HG3 H 2.289 0.03 2 1335 364 111 GLU C C 179.663 0.30 1 1336 364 111 GLU CA C 59.649 0.30 1 1337 364 111 GLU CB C 29.308 0.30 1 1338 364 111 GLU CG C 36.513 0.30 1 1339 364 111 GLU N N 118.099 0.30 1 1340 365 112 LYS H H 7.795 0.03 1 1341 365 112 LYS HA H 4.070 0.03 1 1342 365 112 LYS HB2 H 2.085 0.03 2 1343 365 112 LYS HB3 H 1.838 0.03 2 1344 365 112 LYS HG2 H 1.092 0.03 2 1345 365 112 LYS HG3 H 0.413 0.03 2 1346 365 112 LYS HD2 H 1.383 0.03 2 1347 365 112 LYS HD3 H 1.453 0.03 2 1348 365 112 LYS HE2 H 2.695 0.03 2 1349 365 112 LYS HE3 H 2.475 0.03 2 1350 365 112 LYS C C 180.360 0.30 1 1351 365 112 LYS CA C 59.359 0.30 1 1352 365 112 LYS CB C 33.508 0.30 1 1353 365 112 LYS CG C 28.777 0.30 1 1354 365 112 LYS CD C 26.726 0.30 1 1355 365 112 LYS CE C 42.039 0.30 1 1356 365 112 LYS N N 119.826 0.30 1 1357 366 113 VAL H H 8.872 0.03 1 1358 366 113 VAL HA H 3.733 0.03 1 1359 366 113 VAL HB H 2.377 0.03 1 1360 366 113 VAL HG1 H 0.884 0.03 2 1361 366 113 VAL HG2 H 1.260 0.03 2 1362 366 113 VAL C C 176.654 0.30 1 1363 366 113 VAL CA C 68.099 0.30 1 1364 366 113 VAL CB C 31.191 0.30 1 1365 366 113 VAL CG1 C 21.411 0.30 1 1366 366 113 VAL CG2 C 24.637 0.30 1 1367 366 113 VAL N N 122.417 0.30 1 1368 367 114 ALA H H 8.283 0.03 1 1369 367 114 ALA HA H 3.988 0.03 1 1370 367 114 ALA HB H 1.601 0.03 1 1371 367 114 ALA C C 180.568 0.30 1 1372 367 114 ALA CA C 56.061 0.30 1 1373 367 114 ALA CB C 18.012 0.30 1 1374 367 114 ALA N N 121.583 0.30 1 1375 368 115 GLU H H 7.969 0.03 1 1376 368 115 GLU HA H 4.055 0.03 1 1377 368 115 GLU HB2 H 2.130 0.03 2 1378 368 115 GLU HB3 H 2.230 0.03 2 1379 368 115 GLU HG2 H 2.238 0.03 2 1380 368 115 GLU HG3 H 2.235 0.03 2 1381 368 115 GLU C C 179.312 0.30 1 1382 368 115 GLU CA C 59.343 0.30 1 1383 368 115 GLU CB C 29.622 0.30 1 1384 368 115 GLU CG C 36.285 0.30 1 1385 368 115 GLU N N 118.074 0.30 1 1386 369 116 LEU H H 8.284 0.03 1 1387 369 116 LEU HA H 4.057 0.03 1 1388 369 116 LEU HB2 H 2.245 0.03 2 1389 369 116 LEU HB3 H 2.096 0.03 2 1390 369 116 LEU HG H 1.545 0.03 1 1391 369 116 LEU HD1 H 1.033 0.03 2 1392 369 116 LEU HD2 H 0.864 0.03 2 1393 369 116 LEU C C 179.056 0.30 1 1394 369 116 LEU CA C 58.767 0.30 1 1395 369 116 LEU CB C 42.998 0.30 1 1396 369 116 LEU CG C 26.730 0.30 1 1397 369 116 LEU CD1 C 26.242 0.30 1 1398 369 116 LEU CD2 C 27.030 0.30 1 1399 369 116 LEU N N 122.400 0.30 1 1400 370 117 LEU H H 8.520 0.03 1 1401 370 117 LEU HA H 4.134 0.03 1 1402 370 117 LEU HB2 H 1.926 0.03 2 1403 370 117 LEU HB3 H 1.434 0.03 2 1404 370 117 LEU HG H 0.716 0.03 1 1405 370 117 LEU HD1 H 0.688 0.03 2 1406 370 117 LEU HD2 H 0.688 0.03 2 1407 370 117 LEU C C 179.504 0.30 1 1408 370 117 LEU CA C 57.400 0.30 1 1409 370 117 LEU CB C 41.118 0.30 1 1410 370 117 LEU CG C 27.271 0.30 1 1411 370 117 LEU CD1 C 23.329 0.30 1 1412 370 117 LEU CD2 C 23.329 0.30 1 1413 370 117 LEU N N 116.729 0.30 1 1414 371 118 GLY H H 7.845 0.03 1 1415 371 118 GLY HA2 H 3.939 0.03 2 1416 371 118 GLY HA3 H 3.939 0.03 2 1417 371 118 GLY C C 174.908 0.30 1 1418 371 118 GLY CA C 46.511 0.30 1 1419 371 118 GLY N N 105.982 0.30 1 1420 372 119 LYS H H 7.673 0.03 1 1421 372 119 LYS HA H 4.224 0.03 1 1422 372 119 LYS HB2 H 1.853 0.03 2 1423 372 119 LYS HB3 H 1.698 0.03 2 1424 372 119 LYS HG2 H 1.573 0.03 2 1425 372 119 LYS HG3 H 1.573 0.03 2 1426 372 119 LYS HD2 H 1.396 0.03 2 1427 372 119 LYS HD3 H 1.396 0.03 2 1428 372 119 LYS HE2 H 2.904 0.03 2 1429 372 119 LYS HE3 H 2.904 0.03 2 1430 372 119 LYS C C 176.409 0.30 1 1431 372 119 LYS CA C 56.242 0.30 1 1432 372 119 LYS CB C 31.972 0.30 1 1433 372 119 LYS CG C 28.829 0.30 1 1434 372 119 LYS CD C 24.900 0.30 1 1435 372 119 LYS CE C 42.363 0.30 1 1436 372 119 LYS N N 117.696 0.30 1 1437 373 120 TYR H H 7.675 0.03 1 1438 373 120 TYR HA H 4.644 0.03 1 1439 373 120 TYR HB2 H 2.877 0.03 2 1440 373 120 TYR HB3 H 2.642 0.03 2 1441 373 120 TYR HD1 H 7.216 0.03 3 1442 373 120 TYR HD2 H 7.216 0.03 3 1443 373 120 TYR HE1 H 6.681 0.03 3 1444 373 120 TYR HE2 H 6.681 0.03 3 1445 373 120 TYR C C 176.978 0.30 1 1446 373 120 TYR CA C 57.293 0.30 1 1447 373 120 TYR CB C 37.793 0.30 1 1448 373 120 TYR CD1 C 133.730 0.30 3 1449 373 120 TYR CD2 C 133.730 0.30 3 1450 373 120 TYR CE1 C 117.876 0.30 3 1451 373 120 TYR CE2 C 117.876 0.30 3 1452 373 120 TYR N N 121.073 0.30 1 1453 374 121 SER HA H 4.297 0.03 1 1454 374 121 SER HB2 H 4.011 0.03 2 1455 374 121 SER HB3 H 3.939 0.03 2 1456 374 121 SER C C 176.079 0.30 1 1457 374 121 SER CA C 61.213 0.30 1 1458 374 121 SER CB C 62.913 0.30 1 1459 375 122 SER H H 8.628 0.03 1 1460 375 122 SER HA H 4.815 0.03 1 1461 375 122 SER HB2 H 4.034 0.03 2 1462 375 122 SER HB3 H 4.034 0.03 2 1463 375 122 SER C C 173.864 0.30 1 1464 375 122 SER CA C 57.704 0.30 1 1465 375 122 SER CB C 63.511 0.30 1 1466 375 122 SER N N 116.087 0.30 1 1467 376 123 GLY H H 7.666 0.03 1 1468 376 123 GLY HA2 H 3.572 0.03 2 1469 376 123 GLY HA3 H 3.572 0.03 2 1470 376 123 GLY C C 171.853 0.30 1 1471 376 123 GLY CA C 44.666 0.30 1 1472 376 123 GLY N N 108.908 0.30 1 1473 377 124 LEU H H 8.413 0.03 1 1474 377 124 LEU HA H 4.390 0.03 1 1475 377 124 LEU HB2 H 1.261 0.03 2 1476 377 124 LEU HB3 H 0.607 0.03 2 1477 377 124 LEU HG H 1.247 0.03 1 1478 377 124 LEU HD1 H 0.198 0.03 2 1479 377 124 LEU HD2 H 0.198 0.03 2 1480 377 124 LEU C C 175.824 0.30 1 1481 377 124 LEU CA C 52.607 0.30 1 1482 377 124 LEU CB C 46.101 0.30 1 1483 377 124 LEU CG C 26.195 0.30 1 1484 377 124 LEU CD1 C 22.941 0.30 1 1485 377 124 LEU CD2 C 22.941 0.30 1 1486 377 124 LEU N N 122.388 0.30 1 1487 378 125 TRP H H 8.373 0.03 1 1488 378 125 TRP HA H 4.633 0.03 1 1489 378 125 TRP HB2 H 3.452 0.03 2 1490 378 125 TRP HB3 H 2.907 0.03 2 1491 378 125 TRP HD1 H 7.306 0.03 1 1492 378 125 TRP HE1 H 10.172 0.03 1 1493 378 125 TRP HE3 H 7.617 0.03 1 1494 378 125 TRP HZ2 H 7.448 0.03 1 1495 378 125 TRP HZ3 H 6.888 0.03 1 1496 378 125 TRP HH2 H 7.149 0.03 1 1497 378 125 TRP C C 178.140 0.30 1 1498 378 125 TRP CA C 57.968 0.30 1 1499 378 125 TRP CB C 29.136 0.30 1 1500 378 125 TRP CD1 C 127.204 0.30 1 1501 378 125 TRP CE3 C 121.151 0.30 1 1502 378 125 TRP CZ2 C 114.077 0.30 1 1503 378 125 TRP CZ3 C 121.209 0.30 1 1504 378 125 TRP CH2 C 124.365 0.30 1 1505 378 125 TRP N N 127.587 0.30 1 1506 378 125 TRP NE1 N 128.943 0.30 1 1507 379 126 ALA H H 9.056 0.03 1 1508 379 126 ALA HA H 3.744 0.03 1 1509 379 126 ALA HB H 1.389 0.03 1 1510 379 126 ALA C C 179.374 0.30 1 1511 379 126 ALA CA C 55.910 0.30 1 1512 379 126 ALA CB C 18.245 0.30 1 1513 379 126 ALA N N 127.250 0.30 1 1514 380 127 SER H H 8.341 0.03 1 1515 380 127 SER HA H 4.079 0.03 1 1516 380 127 SER HB2 H 3.861 0.03 2 1517 380 127 SER HB3 H 3.861 0.03 2 1518 380 127 SER C C 175.409 0.30 1 1519 380 127 SER CA C 60.197 0.30 1 1520 380 127 SER CB C 62.316 0.30 1 1521 380 127 SER N N 108.621 0.30 1 1522 381 128 ALA H H 7.706 0.03 1 1523 381 128 ALA HA H 4.457 0.03 1 1524 381 128 ALA HB H 1.554 0.03 1 1525 381 128 ALA C C 177.460 0.30 1 1526 381 128 ALA CA C 52.126 0.30 1 1527 381 128 ALA CB C 20.032 0.30 1 1528 381 128 ALA N N 124.367 0.30 1 1529 382 129 LEU H H 7.399 0.03 1 1530 382 129 LEU HA H 4.034 0.03 1 1531 382 129 LEU HB2 H 1.917 0.03 2 1532 382 129 LEU HB3 H 1.165 0.03 2 1533 382 129 LEU HG H 0.400 0.03 1 1534 382 129 LEU HD1 H 0.396 0.03 2 1535 382 129 LEU HD2 H 0.695 0.03 2 1536 382 129 LEU C C 173.094 0.30 1 1537 382 129 LEU CA C 59.547 0.30 1 1538 382 129 LEU CB C 38.981 0.30 1 1539 382 129 LEU CG C 26.211 0.30 1 1540 382 129 LEU CD1 C 25.875 0.30 1 1541 382 129 LEU CD2 C 24.334 0.30 1 1542 382 129 LEU N N 120.085 0.30 1 1543 383 130 PRO HA H 3.616 0.03 1 1544 383 130 PRO HB2 H 2.334 0.03 2 1545 383 130 PRO HB3 H 1.944 0.03 2 1546 383 130 PRO HG2 H 2.189 0.03 2 1547 383 130 PRO HG3 H 2.189 0.03 2 1548 383 130 PRO HD2 H 3.560 0.03 2 1549 383 130 PRO HD3 H 3.483 0.03 2 1550 383 130 PRO C C 179.033 0.30 1 1551 383 130 PRO CA C 67.315 0.30 1 1552 383 130 PRO CB C 30.562 0.30 1 1553 383 130 PRO CG C 29.134 0.30 1 1554 383 130 PRO CD C 49.110 0.30 1 1555 384 131 LYS H H 7.889 0.03 1 1556 384 131 LYS HA H 4.226 0.03 1 1557 384 131 LYS HB2 H 1.818 0.03 2 1558 384 131 LYS HB3 H 1.818 0.03 2 1559 384 131 LYS HG2 H 1.620 0.03 2 1560 384 131 LYS HG3 H 1.620 0.03 2 1561 384 131 LYS HD2 H 1.415 0.03 2 1562 384 131 LYS HD3 H 1.415 0.03 2 1563 384 131 LYS HE2 H 3.034 0.03 2 1564 384 131 LYS HE3 H 3.034 0.03 2 1565 384 131 LYS C C 177.822 0.30 1 1566 384 131 LYS CA C 58.863 0.30 1 1567 384 131 LYS CB C 32.368 0.30 1 1568 384 131 LYS CG C 28.568 0.30 1 1569 384 131 LYS CD C 24.900 0.30 1 1570 384 131 LYS CE C 42.363 0.30 1 1571 384 131 LYS N N 118.189 0.30 1 1572 385 132 ALA H H 7.909 0.03 1 1573 385 132 ALA HA H 4.170 0.03 1 1574 385 132 ALA HB H 1.408 0.03 1 1575 385 132 ALA C C 180.523 0.30 1 1576 385 132 ALA CA C 55.255 0.30 1 1577 385 132 ALA CB C 18.522 0.30 1 1578 385 132 ALA N N 121.257 0.30 1 1579 386 133 PHE H H 9.018 0.03 1 1580 386 133 PHE HA H 4.070 0.03 1 1581 386 133 PHE HB2 H 3.452 0.03 2 1582 386 133 PHE HB3 H 2.834 0.03 2 1583 386 133 PHE HD1 H 6.041 0.03 3 1584 386 133 PHE HD2 H 6.041 0.03 3 1585 386 133 PHE HE1 H 6.653 0.03 3 1586 386 133 PHE HE2 H 6.653 0.03 3 1587 386 133 PHE HZ H 7.085 0.03 1 1588 386 133 PHE C C 176.771 0.30 1 1589 386 133 PHE CA C 61.742 0.30 1 1590 386 133 PHE CB C 40.509 0.30 1 1591 386 133 PHE CD1 C 131.474 0.30 3 1592 386 133 PHE CD2 C 131.474 0.30 3 1593 386 133 PHE CE1 C 130.653 0.30 3 1594 386 133 PHE CE2 C 130.650 0.30 3 1595 386 133 PHE CZ C 129.979 0.30 1 1596 386 133 PHE N N 119.041 0.30 1 1597 387 134 GLU H H 8.491 0.03 1 1598 387 134 GLU HA H 4.440 0.03 1 1599 387 134 GLU HB2 H 2.316 0.03 2 1600 387 134 GLU HB3 H 2.144 0.03 2 1601 387 134 GLU HG2 H 2.616 0.03 2 1602 387 134 GLU HG3 H 2.402 0.03 2 1603 387 134 GLU C C 180.445 0.30 1 1604 387 134 GLU CA C 59.732 0.30 1 1605 387 134 GLU CB C 29.424 0.30 1 1606 387 134 GLU CG C 36.338 0.30 1 1607 387 134 GLU N N 122.007 0.30 1 1608 388 135 ASP H H 8.923 0.03 1 1609 388 135 ASP HA H 4.331 0.03 1 1610 388 135 ASP HB2 H 2.761 0.03 2 1611 388 135 ASP HB3 H 2.576 0.03 2 1612 388 135 ASP C C 177.418 0.30 1 1613 388 135 ASP CA C 57.282 0.30 1 1614 388 135 ASP CB C 40.349 0.30 1 1615 388 135 ASP N N 120.559 0.30 1 1616 389 136 MET H H 7.371 0.03 1 1617 389 136 MET HA H 4.034 0.03 1 1618 389 136 MET HB2 H 1.754 0.03 2 1619 389 136 MET HB3 H 1.346 0.03 2 1620 389 136 MET HG2 H 1.699 0.03 2 1621 389 136 MET HG3 H 1.191 0.03 2 1622 389 136 MET HE H 1.916 0.03 1 1623 389 136 MET C C 177.512 0.30 1 1624 389 136 MET CA C 58.034 0.30 1 1625 389 136 MET CB C 32.928 0.30 1 1626 389 136 MET CG C 31.449 0.30 1 1627 389 136 MET CE C 17.485 0.30 1 1628 389 136 MET N N 116.745 0.30 1 1629 390 137 TYR H H 8.435 0.03 1 1630 390 137 TYR HA H 4.506 0.03 1 1631 390 137 TYR HB2 H 2.974 0.03 2 1632 390 137 TYR HB3 H 2.126 0.03 2 1633 390 137 TYR HD1 H 6.381 0.03 3 1634 390 137 TYR HD2 H 6.381 0.03 3 1635 390 137 TYR HE1 H 6.527 0.03 3 1636 390 137 TYR HE2 H 6.527 0.03 3 1637 390 137 TYR C C 175.625 0.30 1 1638 390 137 TYR CA C 58.899 0.30 1 1639 390 137 TYR CB C 38.876 0.30 1 1640 390 137 TYR CD1 C 132.496 0.30 3 1641 390 137 TYR CD2 C 132.496 0.30 3 1642 390 137 TYR CE1 C 118.972 0.30 3 1643 390 137 TYR CE2 C 118.972 0.30 3 1644 390 137 TYR N N 114.334 0.30 1 1645 391 138 LYS H H 8.552 0.03 1 1646 391 138 LYS HA H 4.130 0.03 1 1647 391 138 LYS HB2 H 2.153 0.03 2 1648 391 138 LYS HB3 H 2.007 0.03 2 1649 391 138 LYS HG2 H 1.675 0.03 2 1650 391 138 LYS HG3 H 1.593 0.03 2 1651 391 138 LYS HD2 H 1.274 0.03 2 1652 391 138 LYS HD3 H 1.355 0.03 2 1653 391 138 LYS HE2 H 2.960 0.03 2 1654 391 138 LYS HE3 H 2.960 0.03 2 1655 391 138 LYS C C 174.931 0.30 1 1656 391 138 LYS CA C 56.987 0.30 1 1657 391 138 LYS CB C 28.303 0.30 1 1658 391 138 LYS CG C 28.742 0.30 1 1659 391 138 LYS CD C 25.075 0.30 1 1660 391 138 LYS CE C 42.538 0.30 1 1661 391 138 LYS N N 115.280 0.30 1 1662 392 139 VAL H H 7.144 0.03 1 1663 392 139 VAL HA H 4.440 0.03 1 1664 392 139 VAL HB H 2.060 0.03 1 1665 392 139 VAL HG1 H 0.865 0.03 2 1666 392 139 VAL HG2 H 0.986 0.03 2 1667 392 139 VAL C C 173.694 0.30 1 1668 392 139 VAL CA C 59.402 0.30 1 1669 392 139 VAL CB C 35.592 0.30 1 1670 392 139 VAL CG1 C 19.662 0.30 1 1671 392 139 VAL CG2 C 21.670 0.30 1 1672 392 139 VAL N N 112.905 0.30 1 1673 393 140 LYS H H 8.084 0.03 1 1674 393 140 LYS HA H 4.207 0.03 1 1675 393 140 LYS HB2 H 1.675 0.03 2 1676 393 140 LYS HB3 H 1.675 0.03 2 1677 393 140 LYS HG2 H 1.675 0.03 2 1678 393 140 LYS HG3 H 1.675 0.03 2 1679 393 140 LYS HD2 H 1.452 0.03 2 1680 393 140 LYS HD3 H 1.452 0.03 2 1681 393 140 LYS HE2 H 3.016 0.03 2 1682 393 140 LYS HE3 H 3.016 0.03 2 1683 393 140 LYS C C 176.806 0.30 1 1684 393 140 LYS CA C 56.239 0.30 1 1685 393 140 LYS CB C 32.915 0.30 1 1686 393 140 LYS CG C 28.829 0.30 1 1687 393 140 LYS CD C 24.638 0.30 1 1688 393 140 LYS CE C 42.276 0.30 1 1689 393 140 LYS N N 120.262 0.30 1 1690 394 141 PHE H H 9.462 0.03 1 1691 394 141 PHE HA H 4.079 0.03 1 1692 394 141 PHE HB2 H 2.815 0.03 2 1693 394 141 PHE HB3 H 2.788 0.03 2 1694 394 141 PHE HD1 H 6.038 0.03 3 1695 394 141 PHE HD2 H 6.038 0.03 3 1696 394 141 PHE HE1 H 6.674 0.03 3 1697 394 141 PHE HE2 H 6.674 0.03 3 1698 394 141 PHE HZ H 7.278 0.03 1 1699 394 141 PHE C C 173.921 0.30 1 1700 394 141 PHE CA C 55.652 0.30 1 1701 394 141 PHE CB C 40.016 0.30 1 1702 394 141 PHE CD1 C 131.481 0.30 3 1703 394 141 PHE CD2 C 131.481 0.30 3 1704 394 141 PHE CE1 C 128.565 0.30 3 1705 394 141 PHE CE2 C 128.565 0.30 3 1706 394 141 PHE CZ C 131.902 0.30 1 1707 394 141 PHE N N 127.613 0.30 1 1708 395 142 PRO HA H 4.210 0.03 1 1709 395 142 PRO HB2 H 2.001 0.03 2 1710 395 142 PRO HB3 H 1.694 0.03 2 1711 395 142 PRO HG2 H 1.721 0.03 2 1712 395 142 PRO HG3 H 1.470 0.03 2 1713 395 142 PRO HD2 H 3.245 0.03 2 1714 395 142 PRO HD3 H 1.745 0.03 2 1715 395 142 PRO C C 176.645 0.30 1 1716 395 142 PRO CA C 62.414 0.30 1 1717 395 142 PRO CB C 30.983 0.30 1 1718 395 142 PRO CG C 27.782 0.30 1 1719 395 142 PRO CD C 49.523 0.30 1 1720 396 143 GLU H H 8.558 0.03 1 1721 396 143 GLU HA H 3.872 0.03 1 1722 396 143 GLU HB2 H 2.032 0.03 2 1723 396 143 GLU HB3 H 2.032 0.03 2 1724 396 143 GLU HG2 H 2.363 0.03 2 1725 396 143 GLU HG3 H 2.288 0.03 2 1726 396 143 GLU C C 178.359 0.30 1 1727 396 143 GLU CA C 59.470 0.30 1 1728 396 143 GLU CB C 29.573 0.30 1 1729 396 143 GLU CG C 36.426 0.30 1 1730 396 143 GLU N N 125.659 0.30 1 1731 397 144 ASP H H 8.727 0.03 1 1732 397 144 ASP HA H 4.312 0.03 1 1733 397 144 ASP HB2 H 2.583 0.03 2 1734 397 144 ASP HB3 H 2.507 0.03 2 1735 397 144 ASP C C 178.023 0.30 1 1736 397 144 ASP CA C 56.204 0.30 1 1737 397 144 ASP CB C 39.943 0.30 1 1738 397 144 ASP N N 117.359 0.30 1 1739 398 145 ALA H H 7.378 0.03 1 1740 398 145 ALA HA H 3.984 0.03 1 1741 398 145 ALA HB H 1.089 0.03 1 1742 398 145 ALA C C 178.195 0.30 1 1743 398 145 ALA CA C 54.401 0.30 1 1744 398 145 ALA CB C 18.502 0.30 1 1745 398 145 ALA N N 121.578 0.30 1 1746 399 146 LEU H H 7.423 0.03 1 1747 399 146 LEU HA H 4.114 0.03 1 1748 399 146 LEU HB2 H 1.755 0.03 2 1749 399 146 LEU HB3 H 1.673 0.03 2 1750 399 146 LEU HG H 1.741 0.03 1 1751 399 146 LEU HD1 H 0.890 0.03 2 1752 399 146 LEU HD2 H 0.825 0.03 2 1753 399 146 LEU C C 178.004 0.30 1 1754 399 146 LEU CA C 56.029 0.30 1 1755 399 146 LEU CB C 41.829 0.30 1 1756 399 146 LEU CG C 27.345 0.30 1 1757 399 146 LEU CD1 C 24.726 0.30 1 1758 399 146 LEU CD2 C 24.027 0.30 1 1759 399 146 LEU N N 114.762 0.30 1 1760 400 147 LYS H H 7.387 0.03 1 1761 400 147 LYS HA H 4.124 0.03 1 1762 400 147 LYS HB2 H 1.890 0.03 2 1763 400 147 LYS HB3 H 1.787 0.03 2 1764 400 147 LYS HG2 H 1.657 0.03 2 1765 400 147 LYS HG3 H 1.657 0.03 2 1766 400 147 LYS HD2 H 1.504 0.03 2 1767 400 147 LYS HD3 H 1.426 0.03 2 1768 400 147 LYS HE2 H 2.951 0.03 2 1769 400 147 LYS HE3 H 2.951 0.03 2 1770 400 147 LYS C C 176.649 0.30 1 1771 400 147 LYS CA C 57.708 0.30 1 1772 400 147 LYS CB C 32.570 0.30 1 1773 400 147 LYS CG C 29.179 0.30 1 1774 400 147 LYS CD C 25.250 0.30 1 1775 400 147 LYS CE C 42.188 0.30 1 1776 400 147 LYS N N 116.222 0.30 1 1777 401 148 ASN H H 7.480 0.03 1 1778 401 148 ASN HA H 4.989 0.03 1 1779 401 148 ASN HB2 H 2.895 0.03 2 1780 401 148 ASN HB3 H 2.587 0.03 2 1781 401 148 ASN HD21 H 7.609 0.03 2 1782 401 148 ASN HD22 H 6.960 0.03 2 1783 401 148 ASN C C 175.497 0.30 1 1784 401 148 ASN CA C 51.767 0.30 1 1785 401 148 ASN CB C 38.531 0.30 1 1786 401 148 ASN N N 116.723 0.30 1 1787 401 148 ASN ND2 N 112.269 0.30 1 1788 402 149 LEU H H 8.508 0.03 1 1789 402 149 LEU HA H 4.011 0.03 1 1790 402 149 LEU HB2 H 1.806 0.03 2 1791 402 149 LEU HB3 H 1.449 0.03 2 1792 402 149 LEU HG H 1.868 0.03 1 1793 402 149 LEU HD1 H 0.857 0.03 2 1794 402 149 LEU HD2 H 0.827 0.03 2 1795 402 149 LEU C C 177.986 0.30 1 1796 402 149 LEU CA C 57.492 0.30 1 1797 402 149 LEU CB C 41.856 0.30 1 1798 402 149 LEU CG C 26.734 0.30 1 1799 402 149 LEU CD1 C 25.686 0.30 1 1800 402 149 LEU CD2 C 24.027 0.30 1 1801 402 149 LEU N N 125.379 0.30 1 1802 403 150 ALA H H 8.271 0.03 1 1803 403 150 ALA HA H 4.082 0.03 1 1804 403 150 ALA HB H 1.460 0.03 1 1805 403 150 ALA C C 180.305 0.30 1 1806 403 150 ALA CA C 54.795 0.30 1 1807 403 150 ALA CB C 17.911 0.30 1 1808 403 150 ALA N N 119.115 0.30 1 1809 404 151 SER H H 8.106 0.03 1 1810 404 151 SER HA H 4.293 0.03 1 1811 404 151 SER HB2 H 4.002 0.03 2 1812 404 151 SER HB3 H 4.002 0.03 2 1813 404 151 SER C C 175.400 0.30 1 1814 404 151 SER CA C 61.005 0.30 1 1815 404 151 SER CB C 63.331 0.30 1 1816 404 151 SER N N 114.427 0.30 1 1817 405 152 LEU H H 8.032 0.03 1 1818 405 152 LEU HA H 4.505 0.03 1 1819 405 152 LEU HB2 H 1.793 0.03 2 1820 405 152 LEU HB3 H 1.723 0.03 2 1821 405 152 LEU HG H 0.846 0.03 1 1822 405 152 LEU HD1 H 0.770 0.03 2 1823 405 152 LEU HD2 H 0.770 0.03 2 1824 405 152 LEU C C 177.703 0.30 1 1825 405 152 LEU CA C 54.439 0.30 1 1826 405 152 LEU CB C 41.868 0.30 1 1827 405 152 LEU CG C 25.599 0.30 1 1828 405 152 LEU CD1 C 23.241 0.30 1 1829 405 152 LEU CD2 C 23.241 0.30 1 1830 405 152 LEU N N 120.434 0.30 1 1831 406 153 SER H H 7.780 0.03 1 1832 406 153 SER HA H 4.467 0.03 1 1833 406 153 SER HB2 H 4.187 0.03 2 1834 406 153 SER HB3 H 4.055 0.03 2 1835 406 153 SER C C 173.947 0.30 1 1836 406 153 SER CA C 61.670 0.30 1 1837 406 153 SER CB C 63.445 0.30 1 1838 406 153 SER N N 115.900 0.30 1 1839 407 154 ASP H H 8.963 0.03 1 1840 407 154 ASP HA H 4.543 0.03 1 1841 407 154 ASP HB2 H 2.762 0.03 2 1842 407 154 ASP HB3 H 2.579 0.03 2 1843 407 154 ASP C C 177.754 0.30 1 1844 407 154 ASP CA C 55.806 0.30 1 1845 407 154 ASP CB C 40.315 0.30 1 1846 407 154 ASP N N 117.841 0.30 1 1847 408 155 VAL H H 8.008 0.03 1 1848 408 155 VAL HA H 4.645 0.03 1 1849 408 155 VAL HB H 2.475 0.03 1 1850 408 155 VAL HG1 H 0.966 0.03 2 1851 408 155 VAL HG2 H 0.872 0.03 2 1852 408 155 VAL C C 174.543 0.30 1 1853 408 155 VAL CA C 60.806 0.30 1 1854 408 155 VAL CB C 34.002 0.30 1 1855 408 155 VAL CG1 C 18.265 0.30 1 1856 408 155 VAL CG2 C 21.582 0.30 1 1857 408 155 VAL N N 109.299 0.30 1 1858 409 156 CYS H H 7.896 0.03 1 1859 409 156 CYS HA H 5.120 0.03 1 1860 409 156 CYS HB2 H 2.820 0.03 2 1861 409 156 CYS HB3 H 2.643 0.03 2 1862 409 156 CYS C C 171.940 0.30 1 1863 409 156 CYS CA C 56.596 0.30 1 1864 409 156 CYS CB C 30.690 0.30 1 1865 409 156 CYS N N 117.018 0.30 1 1866 410 157 THR H H 8.991 0.03 1 1867 410 157 THR HA H 4.439 0.03 1 1868 410 157 THR HB H 3.932 0.03 1 1869 410 157 THR HG2 H 1.143 0.03 1 1870 410 157 THR C C 172.979 0.30 1 1871 410 157 THR CA C 61.914 0.30 1 1872 410 157 THR CB C 70.345 0.30 1 1873 410 157 THR CG2 C 22.368 0.30 1 1874 410 157 THR N N 116.998 0.30 1 1875 411 158 ILE H H 8.520 0.03 1 1876 411 158 ILE HA H 4.459 0.03 1 1877 411 158 ILE HB H 1.480 0.03 1 1878 411 158 ILE HG12 H 1.393 0.03 1 1879 411 158 ILE HG13 H 0.646 0.03 1 1880 411 158 ILE HG2 H 0.242 0.03 2 1881 411 158 ILE HD1 H 0.644 0.03 1 1882 411 158 ILE C C 175.376 0.30 1 1883 411 158 ILE CA C 60.807 0.30 1 1884 411 158 ILE CB C 39.713 0.30 1 1885 411 158 ILE CG1 C 28.218 0.30 2 1886 411 158 ILE CG2 C 17.653 0.30 1 1887 411 158 ILE CD1 C 14.685 0.30 1 1888 411 158 ILE N N 125.379 0.30 1 1889 412 159 ASN H H 8.892 0.03 1 1890 412 159 ASN HA H 5.017 0.03 1 1891 412 159 ASN HB2 H 2.756 0.03 2 1892 412 159 ASN HB3 H 2.571 0.03 2 1893 412 159 ASN HD21 H 7.028 0.03 2 1894 412 159 ASN HD22 H 6.858 0.03 2 1895 412 159 ASN C C 173.367 0.30 1 1896 412 159 ASN CA C 51.322 0.30 1 1897 412 159 ASN CB C 41.405 0.30 1 1898 412 159 ASN N N 126.429 0.30 1 1899 412 159 ASN ND2 N 110.481 0.30 1 1900 413 160 TYR H H 8.605 0.03 1 1901 413 160 TYR HA H 4.840 0.03 1 1902 413 160 TYR HB2 H 2.885 0.03 2 1903 413 160 TYR HB3 H 2.671 0.03 2 1904 413 160 TYR HD1 H 7.043 0.03 3 1905 413 160 TYR HD2 H 7.043 0.03 3 1906 413 160 TYR HE1 H 6.716 0.03 3 1907 413 160 TYR HE2 H 6.716 0.03 3 1908 413 160 TYR C C 176.395 0.30 1 1909 413 160 TYR CA C 57.808 0.30 1 1910 413 160 TYR CB C 38.829 0.30 1 1911 413 160 TYR CD1 C 133.284 0.30 3 1912 413 160 TYR CD2 C 133.284 0.30 3 1913 413 160 TYR CE1 C 117.940 0.30 3 1914 413 160 TYR CE2 C 117.940 0.30 3 1915 413 160 TYR N N 121.775 0.30 1 1916 414 161 ILE H H 8.563 0.03 1 1917 414 161 ILE HA H 4.236 0.03 1 1918 414 161 ILE HB H 2.089 0.03 1 1919 414 161 ILE HG12 H 1.551 0.03 1 1920 414 161 ILE HG13 H 1.463 0.03 1 1921 414 161 ILE HG2 H 1.041 0.03 2 1922 414 161 ILE HD1 H 0.819 0.03 1 1923 414 161 ILE C C 176.945 0.30 1 1924 414 161 ILE CA C 60.684 0.30 1 1925 414 161 ILE CB C 37.495 0.30 1 1926 414 161 ILE CG1 C 27.432 0.30 2 1927 414 161 ILE CG2 C 17.543 0.30 1 1928 414 161 ILE CD1 C 11.454 0.30 1 1929 414 161 ILE N N 124.716 0.30 1 1930 415 162 SER H H 8.945 0.03 1 1931 415 162 SER HA H 4.310 0.03 1 1932 415 162 SER HB2 H 4.024 0.03 2 1933 415 162 SER HB3 H 3.940 0.03 2 1934 415 162 SER C C 174.911 0.30 1 1935 415 162 SER CA C 59.072 0.30 1 1936 415 162 SER CB C 63.059 0.30 1 1937 415 162 SER N N 121.380 0.30 1 1938 416 163 GLY H H 8.451 0.03 1 1939 416 163 GLY HA2 H 3.798 0.03 2 1940 416 163 GLY HA3 H 4.076 0.03 2 1941 416 163 GLY C C 173.646 0.30 1 1942 416 163 GLY CA C 45.340 0.30 1 1943 416 163 GLY N N 109.757 0.30 1 1944 417 164 ASN HA H 4.719 0.03 1 1945 417 164 ASN HB2 H 3.017 0.03 2 1946 417 164 ASN HB3 H 2.727 0.03 2 1947 417 164 ASN HD21 H 7.665 0.03 2 1948 417 164 ASN HD22 H 7.040 0.03 2 1949 417 164 ASN C C 176.005 0.30 1 1950 417 164 ASN CA C 53.267 0.30 1 1951 417 164 ASN CB C 38.778 0.30 1 1952 417 164 ASN ND2 N 112.530 0.30 1 1953 418 165 THR H H 8.264 0.03 1 1954 418 165 THR HA H 4.062 0.03 1 1955 418 165 THR HB H 4.157 0.03 1 1956 418 165 THR HG2 H 0.992 0.03 1 1957 418 165 THR C C 174.615 0.30 1 1958 418 165 THR CA C 62.687 0.30 1 1959 418 165 THR CB C 69.072 0.30 1 1960 418 165 THR CG2 C 21.495 0.30 1 1961 418 165 THR N N 114.247 0.30 1 1962 419 166 GLN H H 8.404 0.03 1 1963 419 166 GLN HA H 4.412 0.03 1 1964 419 166 GLN HB2 H 1.974 0.03 2 1965 419 166 GLN HB3 H 2.171 0.03 2 1966 419 166 GLN HG2 H 2.326 0.03 2 1967 419 166 GLN HG3 H 2.326 0.03 2 1968 419 166 GLN HE21 H 7.538 0.03 2 1969 419 166 GLN HE22 H 6.844 0.03 2 1970 419 166 GLN C C 176.174 0.30 1 1971 419 166 GLN CA C 56.511 0.30 1 1972 419 166 GLN CB C 28.946 0.30 1 1973 419 166 GLN CG C 34.068 0.30 1 1974 419 166 GLN N N 118.991 0.30 1 1975 419 166 GLN NE2 N 112.852 0.30 1 1976 420 167 LYS H H 8.031 0.03 1 1977 420 167 LYS HA H 4.580 0.03 1 1978 420 167 LYS HB2 H 1.880 0.03 2 1979 420 167 LYS HB3 H 1.791 0.03 2 1980 420 167 LYS HG2 H 1.433 0.03 2 1981 420 167 LYS HG3 H 1.433 0.03 2 1982 420 167 LYS HD2 H 1.306 0.03 2 1983 420 167 LYS HD3 H 1.215 0.03 2 1984 420 167 LYS HE2 H 2.625 0.03 2 1985 420 167 LYS HE3 H 1.256 0.03 2 1986 420 167 LYS C C 174.203 0.30 1 1987 420 167 LYS CA C 55.499 0.30 1 1988 420 167 LYS CB C 34.149 0.30 1 1989 420 167 LYS CG C 29.066 0.30 1 1990 420 167 LYS CD C 24.900 0.30 1 1991 420 167 LYS CE C 42.138 0.30 1 1992 420 167 LYS N N 122.089 0.30 1 1993 421 168 ALA H H 8.047 0.03 1 1994 421 168 ALA HA H 4.906 0.03 1 1995 421 168 ALA HB H 1.012 0.03 1 1996 421 168 ALA C C 175.973 0.30 1 1997 421 168 ALA CA C 51.374 0.30 1 1998 421 168 ALA CB C 21.359 0.30 1 1999 421 168 ALA N N 123.633 0.30 1 2000 422 169 ILE H H 8.871 0.03 1 2001 422 169 ILE HA H 4.146 0.03 1 2002 422 169 ILE HB H 1.000 0.03 1 2003 422 169 ILE HG12 H 0.579 0.03 1 2004 422 169 ILE HG13 H -0.069 0.03 1 2005 422 169 ILE HG2 H 0.360 0.03 2 2006 422 169 ILE HD1 H 0.068 0.03 1 2007 422 169 ILE C C 172.008 0.30 1 2008 422 169 ILE CA C 60.373 0.30 1 2009 422 169 ILE CB C 40.558 0.30 1 2010 422 169 ILE CG1 C 28.093 0.30 2 2011 422 169 ILE CG2 C 16.210 0.30 1 2012 422 169 ILE CD1 C 12.806 0.30 1 2013 422 169 ILE N N 123.561 0.30 1 2014 423 170 LEU H H 8.292 0.03 1 2015 423 170 LEU HA H 4.990 0.03 1 2016 423 170 LEU HB2 H 1.657 0.03 2 2017 423 170 LEU HB3 H 1.219 0.03 2 2018 423 170 LEU HG H 1.562 0.03 1 2019 423 170 LEU HD1 H 0.710 0.03 2 2020 423 170 LEU HD2 H 0.721 0.03 2 2021 423 170 LEU C C 175.234 0.30 1 2022 423 170 LEU CA C 53.462 0.30 1 2023 423 170 LEU CB C 44.102 0.30 1 2024 423 170 LEU CG C 28.182 0.30 1 2025 423 170 LEU CD1 C 25.195 0.30 1 2026 423 170 LEU CD2 C 25.844 0.30 1 2027 423 170 LEU N N 125.817 0.30 1 2028 424 171 TYR H H 8.622 0.03 1 2029 424 171 TYR HA H 4.943 0.03 1 2030 424 171 TYR HB2 H 3.044 0.03 2 2031 424 171 TYR HB3 H 2.485 0.03 2 2032 424 171 TYR HD1 H 6.864 0.03 3 2033 424 171 TYR HD2 H 6.864 0.03 3 2034 424 171 TYR HE1 H 6.444 0.03 3 2035 424 171 TYR HE2 H 6.444 0.03 3 2036 424 171 TYR C C 176.010 0.30 1 2037 424 171 TYR CA C 55.728 0.30 1 2038 424 171 TYR CB C 41.920 0.30 1 2039 424 171 TYR CD1 C 133.061 0.30 3 2040 424 171 TYR CD2 C 133.061 0.30 3 2041 424 171 TYR CE1 C 118.014 0.30 3 2042 424 171 TYR CE2 C 118.014 0.30 3 2043 424 171 TYR N N 116.406 0.30 1 2044 425 172 ALA H H 9.058 0.03 1 2045 425 172 ALA HA H 4.228 0.03 1 2046 425 172 ALA HB H 1.296 0.03 1 2047 425 172 ALA C C 178.035 0.30 1 2048 425 172 ALA CA C 52.676 0.30 1 2049 425 172 ALA CB C 18.573 0.30 1 2050 425 172 ALA N N 123.887 0.30 1 2051 426 173 LYS H H 8.446 0.03 1 2052 426 173 LYS HA H 4.217 0.03 1 2053 426 173 LYS HB2 H 1.629 0.03 2 2054 426 173 LYS HB3 H 1.405 0.03 2 2055 426 173 LYS HG2 H 1.479 0.03 2 2056 426 173 LYS HG3 H 1.479 0.03 2 2057 426 173 LYS HD2 H 1.212 0.03 2 2058 426 173 LYS HD3 H 1.212 0.03 2 2059 426 173 LYS HE2 H 2.848 0.03 2 2060 426 173 LYS HE3 H 2.848 0.03 2 2061 426 173 LYS C C 175.886 0.30 1 2062 426 173 LYS CA C 56.226 0.30 1 2063 426 173 LYS CB C 33.339 0.30 1 2064 426 173 LYS CG C 29.179 0.30 1 2065 426 173 LYS CD C 24.813 0.30 1 2066 426 173 LYS CE C 42.276 0.30 1 2067 426 173 LYS N N 122.855 0.30 1 2068 427 174 LEU H H 8.289 0.03 1 2069 427 174 LEU HA H 4.586 0.03 1 2070 427 174 LEU HB2 H 1.573 0.03 2 2071 427 174 LEU HB3 H 1.510 0.03 2 2072 427 174 LEU HG H 1.639 0.03 1 2073 427 174 LEU HD1 H 0.905 0.03 2 2074 427 174 LEU HD2 H 0.875 0.03 2 2075 427 174 LEU C C 175.011 0.30 1 2076 427 174 LEU CA C 52.899 0.30 1 2077 427 174 LEU CB C 41.687 0.30 1 2078 427 174 LEU CG C 26.848 0.30 1 2079 427 174 LEU CD1 C 24.998 0.30 1 2080 427 174 LEU CD2 C 23.248 0.30 1 2081 427 174 LEU N N 126.230 0.30 1 2082 428 175 PRO HA H 4.403 0.03 1 2083 428 175 PRO HB2 H 2.234 0.03 2 2084 428 175 PRO HB3 H 1.850 0.03 2 2085 428 175 PRO HG2 H 1.982 0.03 2 2086 428 175 PRO HG3 H 1.982 0.03 2 2087 428 175 PRO HD2 H 3.798 0.03 2 2088 428 175 PRO HD3 H 3.584 0.03 2 2089 428 175 PRO C C 176.575 0.30 1 2090 428 175 PRO CA C 62.647 0.30 1 2091 428 175 PRO CB C 31.919 0.30 1 2092 428 175 PRO CG C 27.258 0.30 1 2093 428 175 PRO CD C 50.483 0.30 1 2094 429 176 LEU H H 8.344 0.03 1 2095 429 176 LEU HA H 4.564 0.03 1 2096 429 176 LEU HB2 H 1.571 0.03 2 2097 429 176 LEU HB3 H 1.509 0.03 2 2098 429 176 LEU HG H 1.640 0.03 1 2099 429 176 LEU HD1 H 0.905 0.03 2 2100 429 176 LEU HD2 H 0.873 0.03 2 2101 429 176 LEU C C 175.809 0.30 1 2102 429 176 LEU CA C 52.921 0.30 1 2103 429 176 LEU CB C 41.697 0.30 1 2104 429 176 LEU CG C 26.869 0.30 1 2105 429 176 LEU CD1 C 25.044 0.30 1 2106 429 176 LEU CD2 C 23.269 0.30 1 2107 429 176 LEU N N 123.676 0.30 1 2108 430 177 PRO HA H 4.468 0.03 1 2109 430 177 PRO HB2 H 2.295 0.03 2 2110 430 177 PRO HB3 H 1.930 0.03 2 2111 430 177 PRO HG2 H 2.020 0.03 2 2112 430 177 PRO HG3 H 2.020 0.03 2 2113 430 177 PRO HD2 H 3.836 0.03 2 2114 430 177 PRO HD3 H 3.630 0.03 2 2115 430 177 PRO C C 177.087 0.30 1 2116 430 177 PRO CA C 63.307 0.30 1 2117 430 177 PRO CB C 32.069 0.30 1 2118 430 177 PRO CG C 27.345 0.30 1 2119 430 177 PRO CD C 50.571 0.30 1 2120 431 178 THR H H 8.106 0.03 1 2121 431 178 THR HA H 4.320 0.03 1 2122 431 178 THR HB H 4.262 0.03 1 2123 431 178 THR HG2 H 1.192 0.03 1 2124 431 178 THR C C 174.354 0.30 1 2125 431 178 THR CA C 61.576 0.30 1 2126 431 178 THR CB C 69.814 0.30 1 2127 431 178 THR CG2 C 21.524 0.30 1 2128 431 178 THR N N 112.613 0.30 1 2129 432 179 ASP H H 8.286 0.03 1 2130 432 179 ASP HA H 4.592 0.03 1 2131 432 179 ASP HB2 H 2.677 0.03 2 2132 432 179 ASP HB3 H 2.633 0.03 2 2133 432 179 ASP C C 175.079 0.30 1 2134 432 179 ASP CA C 54.430 0.30 1 2135 432 179 ASP CB C 41.031 0.30 1 2136 432 179 ASP N N 122.951 0.30 1 2137 433 180 LYS H H 7.831 0.03 1 2138 433 180 LYS HA H 4.124 0.03 1 2139 433 180 LYS HB2 H 1.794 0.03 2 2140 433 180 LYS HB3 H 1.673 0.03 2 2141 433 180 LYS HG2 H 1.630 0.03 2 2142 433 180 LYS HG3 H 1.630 0.03 2 2143 433 180 LYS HD2 H 1.357 0.03 2 2144 433 180 LYS HD3 H 1.357 0.03 2 2145 433 180 LYS HE2 H 2.966 0.03 2 2146 433 180 LYS HE3 H 2.966 0.03 2 2147 433 180 LYS C C 181.180 0.30 1 2148 433 180 LYS CA C 57.627 0.30 1 2149 433 180 LYS CB C 33.731 0.30 1 2150 433 180 LYS CG C 29.003 0.30 1 2151 433 180 LYS CD C 24.528 0.30 1 2152 433 180 LYS CE C 42.116 0.30 1 2153 433 180 LYS N N 126.003 0.30 1 stop_ save_