################################### # 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 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 26920 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.3 _Assigned_chem_shift_list.Chem_shift_15N_err 0.3 _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 26920 1 2 '3D HNCACB' . . . 26920 1 3 '3D CBCA(CO)NH' . . . 26920 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $NMRPipe . . 26920 1 2 $VNMRJ . . 26920 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 3 3 GLU H H 1 8.822 0.02 . 1 . . . . 350 GLU H . 26920 1 2 . 1 1 3 3 GLU CA C 13 57.165 0.3 . 1 . . . . 350 GLU CA . 26920 1 3 . 1 1 3 3 GLU CB C 13 29.862 0.3 . 1 . . . . 350 GLU CB . 26920 1 4 . 1 1 3 3 GLU N N 15 122.885 0.3 . 1 . . . . 350 GLU N . 26920 1 5 . 1 1 4 4 ARG H H 1 8.439 0.02 . 1 . . . . 351 ARG H . 26920 1 6 . 1 1 4 4 ARG CA C 13 56.567 0.3 . 1 . . . . 351 ARG CA . 26920 1 7 . 1 1 4 4 ARG CB C 13 30.59 0.3 . 1 . . . . 351 ARG CB . 26920 1 8 . 1 1 4 4 ARG N N 15 121.979 0.3 . 1 . . . . 351 ARG N . 26920 1 9 . 1 1 5 5 LEU H H 1 8.22 0.02 . 1 . . . . 352 LEU H . 26920 1 10 . 1 1 5 5 LEU CA C 13 55.404 0.3 . 1 . . . . 352 LEU CA . 26920 1 11 . 1 1 5 5 LEU CB C 13 42.298 0.3 . 1 . . . . 352 LEU CB . 26920 1 12 . 1 1 5 5 LEU N N 15 123.112 0.3 . 1 . . . . 352 LEU N . 26920 1 13 . 1 1 6 6 ALA H H 1 8.207 0.02 . 1 . . . . 353 ALA H . 26920 1 14 . 1 1 6 6 ALA CA C 13 52.819 0.3 . 1 . . . . 353 ALA CA . 26920 1 15 . 1 1 6 6 ALA CB C 13 19.359 0.3 . 1 . . . . 353 ALA CB . 26920 1 16 . 1 1 6 6 ALA N N 15 123.905 0.3 . 1 . . . . 353 ALA N . 26920 1 17 . 1 1 7 7 TYR H H 1 8.043 0.02 . 1 . . . . 354 TYR H . 26920 1 18 . 1 1 7 7 TYR CA C 13 58.229 0.3 . 1 . . . . 354 TYR CA . 26920 1 19 . 1 1 7 7 TYR CB C 13 39.356 0.3 . 1 . . . . 354 TYR CB . 26920 1 20 . 1 1 7 7 TYR N N 15 119.033 0.3 . 1 . . . . 354 TYR N . 26920 1 21 . 1 1 8 8 ILE H H 1 7.721 0.02 . 1 . . . . 355 ILE H . 26920 1 22 . 1 1 8 8 ILE CA C 13 61.012 0.3 . 1 . . . . 355 ILE CA . 26920 1 23 . 1 1 8 8 ILE CB C 13 38.801 0.3 . 1 . . . . 355 ILE CB . 26920 1 24 . 1 1 8 8 ILE N N 15 121.865 0.3 . 1 . . . . 355 ILE N . 26920 1 25 . 1 1 9 9 ASN H H 1 8.726 0.02 . 1 . . . . 356 ASN H . 26920 1 26 . 1 1 9 9 ASN CA C 13 51.453 0.3 . 1 . . . . 356 ASN CA . 26920 1 27 . 1 1 9 9 ASN CB C 13 39.209 0.3 . 1 . . . . 356 ASN CB . 26920 1 28 . 1 1 9 9 ASN N N 15 123.451 0.3 . 1 . . . . 356 ASN N . 26920 1 29 . 1 1 10 10 PRO CA C 13 64.27 0.3 . 1 . . . . 357 PRO CA . 26920 1 30 . 1 1 10 10 PRO CB C 13 32.291 0.3 . 1 . . . . 357 PRO CB . 26920 1 31 . 1 1 11 11 ASP H H 1 8.22 0.02 . 1 . . . . 358 ASP H . 26920 1 32 . 1 1 11 11 ASP CA C 13 55.81 0.3 . 1 . . . . 358 ASP CA . 26920 1 33 . 1 1 11 11 ASP CB C 13 40.566 0.3 . 1 . . . . 358 ASP CB . 26920 1 34 . 1 1 11 11 ASP N N 15 119.26 0.3 . 1 . . . . 358 ASP N . 26920 1 35 . 1 1 12 12 LEU H H 1 7.906 0.02 . 1 . . . . 359 LEU H . 26920 1 36 . 1 1 12 12 LEU CA C 13 56.954 0.3 . 1 . . . . 359 LEU CA . 26920 1 37 . 1 1 12 12 LEU CB C 13 41.871 0.3 . 1 . . . . 359 LEU CB . 26920 1 38 . 1 1 12 12 LEU N N 15 122.205 0.3 . 1 . . . . 359 LEU N . 26920 1 39 . 1 1 13 13 ALA H H 1 8.186 0.02 . 1 . . . . 360 ALA H . 26920 1 40 . 1 1 13 13 ALA CA C 13 54.963 0.3 . 1 . . . . 360 ALA CA . 26920 1 41 . 1 1 13 13 ALA CB C 13 19.757 0.3 . 1 . . . . 360 ALA CB . 26920 1 42 . 1 1 13 13 ALA N N 15 120.846 0.3 . 1 . . . . 360 ALA N . 26920 1 43 . 1 1 14 14 LEU H H 1 7.591 0.02 . 1 . . . . 361 LEU H . 26920 1 44 . 1 1 14 14 LEU CA C 13 57.866 0.3 . 1 . . . . 361 LEU CA . 26920 1 45 . 1 1 14 14 LEU CB C 13 42.018 0.3 . 1 . . . . 361 LEU CB . 26920 1 46 . 1 1 14 14 LEU N N 15 118.58 0.3 . 1 . . . . 361 LEU N . 26920 1 47 . 1 1 15 15 GLU H H 1 7.913 0.02 . 1 . . . . 362 GLU H . 26920 1 48 . 1 1 15 15 GLU CA C 13 59.56 0.3 . 1 . . . . 362 GLU CA . 26920 1 49 . 1 1 15 15 GLU CB C 13 29.798 0.3 . 1 . . . . 362 GLU CB . 26920 1 50 . 1 1 15 15 GLU N N 15 118.354 0.3 . 1 . . . . 362 GLU N . 26920 1 51 . 1 1 16 16 GLU H H 1 8.056 0.02 . 1 . . . . 363 GLU H . 26920 1 52 . 1 1 16 16 GLU CA C 13 59.262 0.3 . 1 . . . . 363 GLU CA . 26920 1 53 . 1 1 16 16 GLU CB C 13 29.275 0.3 . 1 . . . . 363 GLU CB . 26920 1 54 . 1 1 16 16 GLU N N 15 118.24 0.3 . 1 . . . . 363 GLU N . 26920 1 55 . 1 1 17 17 LYS H H 1 7.373 0.02 . 1 . . . . 364 LYS H . 26920 1 56 . 1 1 17 17 LYS CA C 13 60.315 0.3 . 1 . . . . 364 LYS CA . 26920 1 57 . 1 1 17 17 LYS CB C 13 33.115 0.3 . 1 . . . . 364 LYS CB . 26920 1 58 . 1 1 17 17 LYS N N 15 124.471 0.3 . 1 . . . . 364 LYS N . 26920 1 59 . 1 1 19 19 LYS H H 1 7.998 0.02 . 1 . . . . 366 LYS H . 26920 1 60 . 1 1 19 19 LYS CA C 13 59.802 0.3 . 1 . . . . 366 LYS CA . 26920 1 61 . 1 1 19 19 LYS CB C 13 31.294 0.3 . 1 . . . . 366 LYS CB . 26920 1 62 . 1 1 19 19 LYS N N 15 121.652 0.3 . 1 . . . . 366 LYS N . 26920 1 63 . 1 1 20 20 GLY H H 1 8.487 0.02 . 1 . . . . 367 GLY H . 26920 1 64 . 1 1 20 20 GLY CA C 13 48.188 0.3 . 1 . . . . 367 GLY CA . 26920 1 65 . 1 1 20 20 GLY N N 15 108.045 0.3 . 1 . . . . 367 GLY N . 26920 1 66 . 1 1 21 21 ASN H H 1 8.733 0.02 . 1 . . . . 368 ASN H . 26920 1 67 . 1 1 21 21 ASN CA C 13 55.874 0.3 . 1 . . . . 368 ASN CA . 26920 1 68 . 1 1 21 21 ASN CB C 13 37.575 0.3 . 1 . . . . 368 ASN CB . 26920 1 69 . 1 1 21 21 ASN N N 15 120.844 0.3 . 1 . . . . 368 ASN N . 26920 1 70 . 1 1 22 22 GLU H H 1 8.125 0.02 . 1 . . . . 369 GLU H . 26920 1 71 . 1 1 22 22 GLU CA C 13 59.802 0.3 . 1 . . . . 369 GLU CA . 26920 1 72 . 1 1 22 22 GLU CB C 13 29.556 0.3 . 1 . . . . 369 GLU CB . 26920 1 73 . 1 1 22 22 GLU N N 15 121.865 0.3 . 1 . . . . 369 GLU N . 26920 1 74 . 1 1 23 23 CYS H H 1 8.049 0.02 . 1 . . . . 370 CYS H . 26920 1 75 . 1 1 23 23 CYS CA C 13 64.158 0.3 . 1 . . . . 370 CYS CA . 26920 1 76 . 1 1 23 23 CYS CB C 13 26.774 0.3 . 1 . . . . 370 CYS CB . 26920 1 77 . 1 1 23 23 CYS N N 15 116.655 0.3 . 1 . . . . 370 CYS N . 26920 1 78 . 1 1 24 24 PHE H H 1 9.205 0.02 . 1 . . . . 371 PHE H . 26920 1 79 . 1 1 24 24 PHE CA C 13 62.425 0.3 . 1 . . . . 371 PHE CA . 26920 1 80 . 1 1 24 24 PHE CB C 13 40.427 0.3 . 1 . . . . 371 PHE CB . 26920 1 81 . 1 1 24 24 PHE N N 15 122.319 0.3 . 1 . . . . 371 PHE N . 26920 1 82 . 1 1 25 25 GLN H H 1 8.501 0.02 . 1 . . . . 372 GLN H . 26920 1 83 . 1 1 25 25 GLN CA C 13 58.713 0.3 . 1 . . . . 372 GLN CA . 26920 1 84 . 1 1 25 25 GLN CB C 13 28.467 0.3 . 1 . . . . 372 GLN CB . 26920 1 85 . 1 1 25 25 GLN N N 15 119.033 0.3 . 1 . . . . 372 GLN N . 26920 1 86 . 1 1 26 26 LYS H H 1 7.284 0.02 . 1 . . . . 373 LYS H . 26920 1 87 . 1 1 26 26 LYS CA C 13 56.415 0.3 . 1 . . . . 373 LYS CA . 26920 1 88 . 1 1 26 26 LYS CB C 13 33.065 0.3 . 1 . . . . 373 LYS CB . 26920 1 89 . 1 1 26 26 LYS N N 15 115.408 0.3 . 1 . . . . 373 LYS N . 26920 1 90 . 1 1 27 27 GLY H H 1 7.509 0.02 . 1 . . . . 374 GLY H . 26920 1 91 . 1 1 27 27 GLY CA C 13 44.679 0.3 . 1 . . . . 374 GLY CA . 26920 1 92 . 1 1 27 27 GLY N N 15 107.592 0.3 . 1 . . . . 374 GLY N . 26920 1 93 . 1 1 28 28 ASP H H 1 7.844 0.02 . 1 . . . . 375 ASP H . 26920 1 94 . 1 1 28 28 ASP CA C 13 51.016 0.3 . 1 . . . . 375 ASP CA . 26920 1 95 . 1 1 28 28 ASP CB C 13 39.227 0.3 . 1 . . . . 375 ASP CB . 26920 1 96 . 1 1 28 28 ASP N N 15 120.846 0.3 . 1 . . . . 375 ASP N . 26920 1 97 . 1 1 29 29 TYR H H 1 7.188 0.02 . 1 . . . . 376 TYR H . 26920 1 98 . 1 1 29 29 TYR CA C 13 62.222 0.3 . 1 . . . . 376 TYR CA . 26920 1 99 . 1 1 29 29 TYR CB C 13 35.726 0.3 . 1 . . . . 376 TYR CB . 26920 1 100 . 1 1 29 29 TYR N N 15 120.053 0.3 . 1 . . . . 376 TYR N . 26920 1 101 . 1 1 30 30 PRO CA C 13 66.335 0.3 . 1 . . . . 377 PRO CA . 26920 1 102 . 1 1 30 30 PRO CB C 13 31.242 0.3 . 1 . . . . 377 PRO CB . 26920 1 103 . 1 1 31 31 GLN H H 1 7.202 0.02 . 1 . . . . 378 GLN H . 26920 1 104 . 1 1 31 31 GLN CA C 13 57.866 0.3 . 1 . . . . 378 GLN CA . 26920 1 105 . 1 1 31 31 GLN CB C 13 28.83 0.3 . 1 . . . . 378 GLN CB . 26920 1 106 . 1 1 31 31 GLN N N 15 116.428 0.3 . 1 . . . . 378 GLN N . 26920 1 107 . 1 1 32 32 ALA H H 1 8.4 0.02 . 1 . . . . 379 ALA H . 26920 1 108 . 1 1 32 32 ALA CB C 13 18.977 0.3 . 1 . . . . 379 ALA CB . 26920 1 109 . 1 1 32 32 ALA N N 15 120.842 0.3 . 1 . . . . 379 ALA N . 26920 1 110 . 1 1 33 33 MET H H 1 8.432 0.02 . 1 . . . . 380 MET H . 26920 1 111 . 1 1 33 33 MET CA C 13 59.613 0.3 . 1 . . . . 380 MET CA . 26920 1 112 . 1 1 33 33 MET CB C 13 31.492 0.3 . 1 . . . . 380 MET CB . 26920 1 113 . 1 1 33 33 MET N N 15 115.862 0.3 . 1 . . . . 380 MET N . 26920 1 114 . 1 1 34 34 LYS H H 1 7.503 0.02 . 1 . . . . 381 LYS H . 26920 1 115 . 1 1 34 34 LYS CA C 13 60.134 0.3 . 1 . . . . 381 LYS CA . 26920 1 116 . 1 1 34 34 LYS CB C 13 32.029 0.3 . 1 . . . . 381 LYS CB . 26920 1 117 . 1 1 34 34 LYS N N 15 122.545 0.3 . 1 . . . . 381 LYS N . 26920 1 118 . 1 1 35 35 HIS H H 1 7.762 0.02 . 1 . . . . 382 HIS H . 26920 1 119 . 1 1 35 35 HIS CA C 13 59.694 0.3 . 1 . . . . 382 HIS CA . 26920 1 120 . 1 1 35 35 HIS CB C 13 28.256 0.3 . 1 . . . . 382 HIS CB . 26920 1 121 . 1 1 35 35 HIS N N 15 119.033 0.3 . 1 . . . . 382 HIS N . 26920 1 122 . 1 1 36 36 TYR H H 1 9.116 0.02 . 1 . . . . 383 TYR H . 26920 1 123 . 1 1 36 36 TYR CA C 13 59.858 0.3 . 1 . . . . 383 TYR CA . 26920 1 124 . 1 1 36 36 TYR CB C 13 37.299 0.3 . 1 . . . . 383 TYR CB . 26920 1 125 . 1 1 36 36 TYR N N 15 117.108 0.3 . 1 . . . . 383 TYR N . 26920 1 126 . 1 1 37 37 THR H H 1 8.425 0.02 . 1 . . . . 384 THR H . 26920 1 127 . 1 1 37 37 THR CA C 13 67.367 0.3 . 1 . . . . 384 THR CA . 26920 1 128 . 1 1 37 37 THR CB C 13 68.876 0.3 . 1 . . . . 384 THR CB . 26920 1 129 . 1 1 37 37 THR N N 15 116.315 0.3 . 1 . . . . 384 THR N . 26920 1 130 . 1 1 39 39 ALA H H 1 8.62 0.02 . 1 . . . . 386 ALA H . 26920 1 131 . 1 1 39 39 ALA CA C 13 55.874 0.3 . 1 . . . . 386 ALA CA . 26920 1 132 . 1 1 39 39 ALA CB C 13 19.195 0.3 . 1 . . . . 386 ALA CB . 26920 1 133 . 1 1 39 39 ALA N N 15 121.638 0.3 . 1 . . . . 386 ALA N . 26920 1 134 . 1 1 40 40 ILE H H 1 8.227 0.02 . 1 . . . . 387 ILE H . 26920 1 135 . 1 1 40 40 ILE CA C 13 64.762 0.3 . 1 . . . . 387 ILE CA . 26920 1 136 . 1 1 40 40 ILE CB C 13 38.872 0.3 . 1 . . . . 387 ILE CB . 26920 1 137 . 1 1 40 40 ILE N N 15 120.053 0.3 . 1 . . . . 387 ILE N . 26920 1 138 . 1 1 41 41 LYS H H 1 7.503 0.02 . 1 . . . . 388 LYS H . 26920 1 139 . 1 1 41 41 LYS CA C 13 59.318 0.3 . 1 . . . . 388 LYS CA . 26920 1 140 . 1 1 41 41 LYS CB C 13 32.702 0.3 . 1 . . . . 388 LYS CB . 26920 1 141 . 1 1 41 41 LYS N N 15 117.334 0.3 . 1 . . . . 388 LYS N . 26920 1 142 . 1 1 42 42 ARG H H 1 7.338 0.02 . 1 . . . . 389 ARG H . 26920 1 143 . 1 1 42 42 ARG CA C 13 56.657 0.3 . 1 . . . . 389 ARG CA . 26920 1 144 . 1 1 42 42 ARG CB C 13 31.129 0.3 . 1 . . . . 389 ARG CB . 26920 1 145 . 1 1 42 42 ARG N N 15 114.389 0.3 . 1 . . . . 389 ARG N . 26920 1 146 . 1 1 43 43 ASN H H 1 8.077 0.02 . 1 . . . . 390 ASN H . 26920 1 147 . 1 1 43 43 ASN CA C 13 51.212 0.3 . 1 . . . . 390 ASN CA . 26920 1 148 . 1 1 43 43 ASN CB C 13 38.388 0.3 . 1 . . . . 390 ASN CB . 26920 1 149 . 1 1 43 43 ASN N N 15 114.616 0.3 . 1 . . . . 390 ASN N . 26920 1 150 . 1 1 44 44 PRO CA C 13 64.166 0.3 . 1 . . . . 391 PRO CA . 26920 1 151 . 1 1 45 45 ARG H H 1 7.912 0.02 . 1 . . . . 392 ARG H . 26920 1 152 . 1 1 45 45 ARG CA C 13 55.205 0.3 . 1 . . . . 392 ARG CA . 26920 1 153 . 1 1 45 45 ARG CB C 13 29.435 0.3 . 1 . . . . 392 ARG CB . 26920 1 154 . 1 1 45 45 ARG N N 15 117.792 0.3 . 1 . . . . 392 ARG N . 26920 1 155 . 1 1 46 46 ASP H H 1 7.318 0.02 . 1 . . . . 393 ASP H . 26920 1 156 . 1 1 46 46 ASP CA C 13 53.027 0.3 . 1 . . . . 393 ASP CA . 26920 1 157 . 1 1 46 46 ASP CB C 13 40.687 0.3 . 1 . . . . 393 ASP CB . 26920 1 158 . 1 1 46 46 ASP N N 15 119.26 0.3 . 1 . . . . 393 ASP N . 26920 1 159 . 1 1 47 47 ALA H H 1 8.637 0.02 . 1 . . . . 394 ALA H . 26920 1 160 . 1 1 47 47 ALA CA C 13 55.931 0.3 . 1 . . . . 394 ALA CA . 26920 1 161 . 1 1 47 47 ALA CB C 13 20.56 0.3 . 1 . . . . 394 ALA CB . 26920 1 162 . 1 1 47 47 ALA N N 15 128.322 0.3 . 1 . . . . 394 ALA N . 26920 1 163 . 1 1 48 48 LYS H H 1 7.995 0.02 . 1 . . . . 395 LYS H . 26920 1 164 . 1 1 48 48 LYS CA C 13 59.681 0.3 . 1 . . . . 395 LYS CA . 26920 1 165 . 1 1 48 48 LYS CB C 13 31.613 0.3 . 1 . . . . 395 LYS CB . 26920 1 166 . 1 1 48 48 LYS N N 15 113.483 0.3 . 1 . . . . 395 LYS N . 26920 1 167 . 1 1 49 49 LEU H H 1 7.345 0.02 . 1 . . . . 396 LEU H . 26920 1 168 . 1 1 49 49 LEU CA C 13 57.503 0.3 . 1 . . . . 396 LEU CA . 26920 1 169 . 1 1 49 49 LEU CB C 13 42.26 0.3 . 1 . . . . 396 LEU CB . 26920 1 170 . 1 1 49 49 LEU N N 15 117.334 0.3 . 1 . . . . 396 LEU N . 26920 1 171 . 1 1 50 50 TYR H H 1 6.935 0.02 . 1 . . . . 397 TYR H . 26920 1 172 . 1 1 50 50 TYR CA C 13 62.222 0.3 . 1 . . . . 397 TYR CA . 26920 1 173 . 1 1 50 50 TYR CB C 13 38.388 0.3 . 1 . . . . 397 TYR CB . 26920 1 174 . 1 1 50 50 TYR N N 15 116.315 0.3 . 1 . . . . 397 TYR N . 26920 1 175 . 1 1 51 51 SER H H 1 7.708 0.02 . 1 . . . . 398 SER H . 26920 1 176 . 1 1 51 51 SER CA C 13 61.653 0.3 . 1 . . . . 398 SER CA . 26920 1 177 . 1 1 51 51 SER CB C 13 63.19 0.3 . 1 . . . . 398 SER CB . 26920 1 178 . 1 1 51 51 SER N N 15 112.803 0.3 . 1 . . . . 398 SER N . 26920 1 179 . 1 1 52 52 ASN H H 1 7.769 0.02 . 1 . . . . 399 ASN H . 26920 1 180 . 1 1 52 52 ASN CA C 13 55.689 0.3 . 1 . . . . 399 ASN CA . 26920 1 181 . 1 1 52 52 ASN CB C 13 36.694 0.3 . 1 . . . . 399 ASN CB . 26920 1 182 . 1 1 52 52 ASN N N 15 119.487 0.3 . 1 . . . . 399 ASN N . 26920 1 183 . 1 1 53 53 ARG H H 1 8.282 0.02 . 1 . . . . 400 ARG H . 26920 1 184 . 1 1 53 53 ARG CA C 13 61.939 0.3 . 1 . . . . 400 ARG CA . 26920 1 185 . 1 1 53 53 ARG CB C 13 29.786 0.3 . 1 . . . . 400 ARG CB . 26920 1 186 . 1 1 53 53 ARG N N 15 122.092 0.3 . 1 . . . . 400 ARG N . 26920 1 187 . 1 1 54 54 ALA H H 1 8.897 0.02 . 1 . . . . 401 ALA H . 26920 1 188 . 1 1 54 54 ALA CA C 13 56.365 0.3 . 1 . . . . 401 ALA CA . 26920 1 189 . 1 1 54 54 ALA CB C 13 20.241 0.3 . 1 . . . . 401 ALA CB . 26920 1 190 . 1 1 54 54 ALA N N 15 122.545 0.3 . 1 . . . . 401 ALA N . 26920 1 191 . 1 1 55 55 ALA H H 1 7.66 0.02 . 1 . . . . 402 ALA H . 26920 1 192 . 1 1 55 55 ALA CA C 13 55.384 0.3 . 1 . . . . 402 ALA CA . 26920 1 193 . 1 1 55 55 ALA CB C 13 18.063 0.3 . 1 . . . . 402 ALA CB . 26920 1 194 . 1 1 55 55 ALA N N 15 120.28 0.3 . 1 . . . . 402 ALA N . 26920 1 195 . 1 1 56 56 CYS H H 1 7.619 0.02 . 1 . . . . 403 CYS H . 26920 1 196 . 1 1 56 56 CYS CA C 13 63.674 0.3 . 1 . . . . 403 CYS CA . 26920 1 197 . 1 1 56 56 CYS CB C 13 27.379 0.3 . 1 . . . . 403 CYS CB . 26920 1 198 . 1 1 56 56 CYS N N 15 117.221 0.3 . 1 . . . . 403 CYS N . 26920 1 199 . 1 1 57 57 TYR H H 1 8.829 0.02 . 1 . . . . 404 TYR H . 26920 1 200 . 1 1 57 57 TYR CA C 13 61.254 0.3 . 1 . . . . 404 TYR CA . 26920 1 201 . 1 1 57 57 TYR CB C 13 37.541 0.3 . 1 . . . . 404 TYR CB . 26920 1 202 . 1 1 57 57 TYR N N 15 118.58 0.3 . 1 . . . . 404 TYR N . 26920 1 203 . 1 1 59 59 LYS H H 1 7.393 0.02 . 1 . . . . 406 LYS H . 26920 1 204 . 1 1 59 59 LYS CA C 13 57.382 0.3 . 1 . . . . 406 LYS CA . 26920 1 205 . 1 1 59 59 LYS CB C 13 31.976 0.3 . 1 . . . . 406 LYS CB . 26920 1 206 . 1 1 59 59 LYS N N 15 122.205 0.3 . 1 . . . . 406 LYS N . 26920 1 207 . 1 1 60 60 LEU H H 1 7.421 0.02 . 1 . . . . 407 LEU H . 26920 1 208 . 1 1 60 60 LEU CA C 13 54.842 0.3 . 1 . . . . 407 LEU CA . 26920 1 209 . 1 1 60 60 LEU CB C 13 42.018 0.3 . 1 . . . . 407 LEU CB . 26920 1 210 . 1 1 60 60 LEU N N 15 117.561 0.3 . 1 . . . . 407 LEU N . 26920 1 211 . 1 1 61 61 LEU H H 1 7.441 0.02 . 1 . . . . 408 LEU H . 26920 1 212 . 1 1 61 61 LEU CA C 13 55.689 0.3 . 1 . . . . 408 LEU CA . 26920 1 213 . 1 1 61 61 LEU CB C 13 37.42 0.3 . 1 . . . . 408 LEU CB . 26920 1 214 . 1 1 61 61 LEU N N 15 113.369 0.3 . 1 . . . . 408 LEU N . 26920 1 215 . 1 1 62 62 GLU H H 1 8.056 0.02 . 1 . . . . 409 GLU H . 26920 1 216 . 1 1 62 62 GLU CA C 13 53.148 0.3 . 1 . . . . 409 GLU CA . 26920 1 217 . 1 1 62 62 GLU CB C 13 28.225 0.3 . 1 . . . . 409 GLU CB . 26920 1 218 . 1 1 62 62 GLU N N 15 120.959 0.3 . 1 . . . . 409 GLU N . 26920 1 219 . 1 1 63 63 PHE H H 1 6.894 0.02 . 1 . . . . 410 PHE H . 26920 1 220 . 1 1 63 63 PHE CA C 13 61.133 0.3 . 1 . . . . 410 PHE CA . 26920 1 221 . 1 1 63 63 PHE CB C 13 38.751 0.3 . 1 . . . . 410 PHE CB . 26920 1 222 . 1 1 63 63 PHE N N 15 118.694 0.3 . 1 . . . . 410 PHE N . 26920 1 223 . 1 1 64 64 GLN H H 1 8.487 0.02 . 1 . . . . 411 GLN H . 26920 1 224 . 1 1 64 64 GLN CA C 13 59.439 0.3 . 1 . . . . 411 GLN CA . 26920 1 225 . 1 1 64 64 GLN CB C 13 27.5 0.3 . 1 . . . . 411 GLN CB . 26920 1 226 . 1 1 64 64 GLN N N 15 116.655 0.3 . 1 . . . . 411 GLN N . 26920 1 227 . 1 1 65 65 LEU H H 1 7.58 0.02 . 1 . . . . 412 LEU H . 26920 1 228 . 1 1 65 65 LEU CA C 13 57.624 0.3 . 1 . . . . 412 LEU CA . 26920 1 229 . 1 1 65 65 LEU CB C 13 38.388 0.3 . 1 . . . . 412 LEU CB . 26920 1 230 . 1 1 65 65 LEU N N 15 119.895 0.3 . 1 . . . . 412 LEU N . 26920 1 231 . 1 1 66 66 ALA H H 1 8.001 0.02 . 1 . . . . 413 ALA H . 26920 1 232 . 1 1 66 66 ALA CA C 13 55.961 0.3 . 1 . . . . 413 ALA CA . 26920 1 233 . 1 1 66 66 ALA CB C 13 19.152 0.3 . 1 . . . . 413 ALA CB . 26920 1 234 . 1 1 66 66 ALA N N 15 121.242 0.3 . 1 . . . . 413 ALA N . 26920 1 235 . 1 1 67 67 LEU H H 1 8.439 0.02 . 1 . . . . 414 LEU H . 26920 1 236 . 1 1 67 67 LEU CA C 13 58.713 0.3 . 1 . . . . 414 LEU CA . 26920 1 237 . 1 1 67 67 LEU CB C 13 41.413 0.3 . 1 . . . . 414 LEU CB . 26920 1 238 . 1 1 67 67 LEU N N 15 118.467 0.3 . 1 . . . . 414 LEU N . 26920 1 239 . 1 1 68 68 LYS H H 1 7.639 0.02 . 1 . . . . 415 LYS H . 26920 1 240 . 1 1 68 68 LYS CA C 13 59.802 0.3 . 1 . . . . 415 LYS CA . 26920 1 241 . 1 1 68 68 LYS CB C 13 32.339 0.3 . 1 . . . . 415 LYS CB . 26920 1 242 . 1 1 68 68 LYS N N 15 119.713 0.3 . 1 . . . . 415 LYS N . 26920 1 243 . 1 1 69 69 ASP H H 1 7.503 0.02 . 1 . . . . 416 ASP H . 26920 1 244 . 1 1 69 69 ASP CA C 13 57.866 0.3 . 1 . . . . 416 ASP CA . 26920 1 245 . 1 1 69 69 ASP CB C 13 40.445 0.3 . 1 . . . . 416 ASP CB . 26920 1 246 . 1 1 69 69 ASP N N 15 121.186 0.3 . 1 . . . . 416 ASP N . 26920 1 247 . 1 1 70 70 CYS H H 1 8.35 0.02 . 1 . . . . 417 CYS H . 26920 1 248 . 1 1 70 70 CYS CA C 13 65.004 0.3 . 1 . . . . 417 CYS CA . 26920 1 249 . 1 1 70 70 CYS CB C 13 26.774 0.3 . 1 . . . . 417 CYS CB . 26920 1 250 . 1 1 70 70 CYS N N 15 117.901 0.3 . 1 . . . . 417 CYS N . 26920 1 251 . 1 1 71 71 GLU H H 1 8.138 0.02 . 1 . . . . 418 GLU H . 26920 1 252 . 1 1 71 71 GLU CA C 13 58.713 0.3 . 1 . . . . 418 GLU CA . 26920 1 253 . 1 1 71 71 GLU CB C 13 28.467 0.3 . 1 . . . . 418 GLU CB . 26920 1 254 . 1 1 71 71 GLU N N 15 117.561 0.3 . 1 . . . . 418 GLU N . 26920 1 255 . 1 1 72 72 GLU H H 1 7.38 0.02 . 1 . . . . 419 GLU H . 26920 1 256 . 1 1 72 72 GLU CA C 13 59.067 0.3 . 1 . . . . 419 GLU CA . 26920 1 257 . 1 1 72 72 GLU CB C 13 28.79 0.3 . 1 . . . . 419 GLU CB . 26920 1 258 . 1 1 72 72 GLU N N 15 119.94 0.3 . 1 . . . . 419 GLU N . 26920 1 259 . 1 1 73 73 CYS H H 1 7.742 0.02 . 1 . . . . 420 CYS H . 26920 1 260 . 1 1 73 73 CYS CA C 13 63.19 0.3 . 1 . . . . 420 CYS CA . 26920 1 261 . 1 1 73 73 CYS CB C 13 26.895 0.3 . 1 . . . . 420 CYS CB . 26920 1 262 . 1 1 73 73 CYS N N 15 117.561 0.3 . 1 . . . . 420 CYS N . 26920 1 263 . 1 1 74 74 ILE H H 1 7.995 0.02 . 1 . . . . 421 ILE H . 26920 1 264 . 1 1 74 74 ILE CA C 13 64.52 0.3 . 1 . . . . 421 ILE CA . 26920 1 265 . 1 1 74 74 ILE CB C 13 39.114 0.3 . 1 . . . . 421 ILE CB . 26920 1 266 . 1 1 74 74 ILE N N 15 117.787 0.3 . 1 . . . . 421 ILE N . 26920 1 267 . 1 1 75 75 GLN H H 1 7.626 0.02 . 1 . . . . 422 GLN H . 26920 1 268 . 1 1 75 75 GLN CA C 13 58.35 0.3 . 1 . . . . 422 GLN CA . 26920 1 269 . 1 1 75 75 GLN CB C 13 28.83 0.3 . 1 . . . . 422 GLN CB . 26920 1 270 . 1 1 75 75 GLN N N 15 116.541 0.3 . 1 . . . . 422 GLN N . 26920 1 271 . 1 1 76 76 LEU H H 1 7.947 0.02 . 1 . . . . 423 LEU H . 26920 1 272 . 1 1 76 76 LEU CA C 13 57.503 0.3 . 1 . . . . 423 LEU CA . 26920 1 273 . 1 1 76 76 LEU CB C 13 44.437 0.3 . 1 . . . . 423 LEU CB . 26920 1 274 . 1 1 76 76 LEU N N 15 118.694 0.3 . 1 . . . . 423 LEU N . 26920 1 275 . 1 1 77 77 GLU H H 1 8.415 0.02 . 1 . . . . 424 GLU H . 26920 1 276 . 1 1 77 77 GLU CA C 13 53.895 0.3 . 1 . . . . 424 GLU CA . 26920 1 277 . 1 1 77 77 GLU CB C 13 31.585 0.3 . 1 . . . . 424 GLU CB . 26920 1 278 . 1 1 77 77 GLU N N 15 117.453 0.3 . 1 . . . . 424 GLU N . 26920 1 279 . 1 1 78 78 PRO CA C 13 64.9 0.3 . 1 . . . . 425 PRO CA . 26920 1 280 . 1 1 78 78 PRO CB C 13 32.395 0.3 . 1 . . . . 425 PRO CB . 26920 1 281 . 1 1 79 79 THR H H 1 8.131 0.02 . 1 . . . . 426 THR H . 26920 1 282 . 1 1 79 79 THR CA C 13 61.496 0.3 . 1 . . . . 426 THR CA . 26920 1 283 . 1 1 79 79 THR CB C 13 68.876 0.3 . 1 . . . . 426 THR CB . 26920 1 284 . 1 1 79 79 THR N N 15 107.366 0.3 . 1 . . . . 426 THR N . 26920 1 285 . 1 1 80 80 PHE H H 1 8.043 0.02 . 1 . . . . 427 PHE H . 26920 1 286 . 1 1 80 80 PHE CA C 13 55.983 0.3 . 1 . . . . 427 PHE CA . 26920 1 287 . 1 1 80 80 PHE CB C 13 38.353 0.3 . 1 . . . . 427 PHE CB . 26920 1 288 . 1 1 80 80 PHE N N 15 123.565 0.3 . 1 . . . . 427 PHE N . 26920 1 289 . 1 1 81 81 ILE H H 1 8.918 0.02 . 1 . . . . 428 ILE H . 26920 1 290 . 1 1 81 81 ILE CA C 13 64.661 0.3 . 1 . . . . 428 ILE CA . 26920 1 291 . 1 1 81 81 ILE CB C 13 38.353 0.3 . 1 . . . . 428 ILE CB . 26920 1 292 . 1 1 81 81 ILE N N 15 131.721 0.3 . 1 . . . . 428 ILE N . 26920 1 293 . 1 1 82 82 LYS H H 1 5.978 0.02 . 1 . . . . 429 LYS H . 26920 1 294 . 1 1 82 82 LYS CA C 13 56.536 0.3 . 1 . . . . 429 LYS CA . 26920 1 295 . 1 1 82 82 LYS CB C 13 31.613 0.3 . 1 . . . . 429 LYS CB . 26920 1 296 . 1 1 82 82 LYS N N 15 115.408 0.3 . 1 . . . . 429 LYS N . 26920 1 297 . 1 1 83 83 GLY H H 1 6.976 0.02 . 1 . . . . 430 GLY H . 26920 1 298 . 1 1 83 83 GLY CA C 13 48.43 0.3 . 1 . . . . 430 GLY CA . 26920 1 299 . 1 1 83 83 GLY N N 15 104.194 0.3 . 1 . . . . 430 GLY N . 26920 1 300 . 1 1 84 84 TYR H H 1 6.833 0.02 . 1 . . . . 431 TYR H . 26920 1 301 . 1 1 84 84 TYR CA C 13 60.77 0.3 . 1 . . . . 431 TYR CA . 26920 1 302 . 1 1 84 84 TYR CB C 13 38.509 0.3 . 1 . . . . 431 TYR CB . 26920 1 303 . 1 1 84 84 TYR N N 15 115.748 0.3 . 1 . . . . 431 TYR N . 26920 1 304 . 1 1 85 85 THR H H 1 8.35 0.02 . 1 . . . . 432 THR H . 26920 1 305 . 1 1 85 85 THR CA C 13 66.698 0.3 . 1 . . . . 432 THR CA . 26920 1 306 . 1 1 85 85 THR N N 15 109.744 0.3 . 1 . . . . 432 THR N . 26920 1 307 . 1 1 90 90 ALA H H 1 7.653 0.02 . 1 . . . . 437 ALA H . 26920 1 308 . 1 1 90 90 ALA CA C 13 55.477 0.3 . 1 . . . . 437 ALA CA . 26920 1 309 . 1 1 90 90 ALA CB C 13 16.903 0.3 . 1 . . . . 437 ALA CB . 26920 1 310 . 1 1 90 90 ALA N N 15 122.885 0.3 . 1 . . . . 437 ALA N . 26920 1 311 . 1 1 91 91 LEU H H 1 7.878 0.02 . 1 . . . . 438 LEU H . 26920 1 312 . 1 1 91 91 LEU CA C 13 57.948 0.3 . 1 . . . . 438 LEU CA . 26920 1 313 . 1 1 91 91 LEU CB C 13 42.018 0.3 . 1 . . . . 438 LEU CB . 26920 1 314 . 1 1 91 91 LEU N N 15 117.861 0.3 . 1 . . . . 438 LEU N . 26920 1 315 . 1 1 92 92 GLU H H 1 8.979 0.02 . 1 . . . . 439 GLU H . 26920 1 316 . 1 1 92 92 GLU CA C 13 59.802 0.3 . 1 . . . . 439 GLU CA . 26920 1 317 . 1 1 92 92 GLU CB C 13 29.919 0.3 . 1 . . . . 439 GLU CB . 26920 1 318 . 1 1 92 92 GLU N N 15 120.959 0.3 . 1 . . . . 439 GLU N . 26920 1 319 . 1 1 93 93 ALA H H 1 7.899 0.02 . 1 . . . . 440 ALA H . 26920 1 320 . 1 1 93 93 ALA CA C 13 54.777 0.3 . 1 . . . . 440 ALA CA . 26920 1 321 . 1 1 93 93 ALA CB C 13 17.92 0.3 . 1 . . . . 440 ALA CB . 26920 1 322 . 1 1 93 93 ALA N N 15 124.584 0.3 . 1 . . . . 440 ALA N . 26920 1 323 . 1 1 94 94 MET H H 1 7.174 0.02 . 1 . . . . 441 MET H . 26920 1 324 . 1 1 94 94 MET CA C 13 56.052 0.3 . 1 . . . . 441 MET CA . 26920 1 325 . 1 1 94 94 MET CB C 13 34.033 0.3 . 1 . . . . 441 MET CB . 26920 1 326 . 1 1 94 94 MET N N 15 115.408 0.3 . 1 . . . . 441 MET N . 26920 1 327 . 1 1 95 95 LYS H H 1 7.639 0.02 . 1 . . . . 442 LYS H . 26920 1 328 . 1 1 95 95 LYS CA C 13 57.02 0.3 . 1 . . . . 442 LYS CA . 26920 1 329 . 1 1 95 95 LYS CB C 13 28.709 0.3 . 1 . . . . 442 LYS CB . 26920 1 330 . 1 1 95 95 LYS N N 15 113.143 0.3 . 1 . . . . 442 LYS N . 26920 1 331 . 1 1 96 96 ASP H H 1 7.893 0.02 . 1 . . . . 443 ASP H . 26920 1 332 . 1 1 96 96 ASP CA C 13 51.091 0.3 . 1 . . . . 443 ASP CA . 26920 1 333 . 1 1 96 96 ASP CB C 13 38.993 0.3 . 1 . . . . 443 ASP CB . 26920 1 334 . 1 1 96 96 ASP N N 15 120.86 0.3 . 1 . . . . 443 ASP N . 26920 1 335 . 1 1 97 97 TYR H H 1 7.004 0.02 . 1 . . . . 444 TYR H . 26920 1 336 . 1 1 97 97 TYR CA C 13 61.98 0.3 . 1 . . . . 444 TYR CA . 26920 1 337 . 1 1 97 97 TYR CB C 13 38.554 0.3 . 1 . . . . 444 TYR CB . 26920 1 338 . 1 1 97 97 TYR N N 15 118.24 0.3 . 1 . . . . 444 TYR N . 26920 1 339 . 1 1 98 98 THR H H 1 8.562 0.02 . 1 . . . . 445 THR H . 26920 1 340 . 1 1 98 98 THR CA C 13 66.335 0.3 . 1 . . . . 445 THR CA . 26920 1 341 . 1 1 98 98 THR CB C 13 68.392 0.3 . 1 . . . . 445 THR CB . 26920 1 342 . 1 1 98 98 THR N N 15 113.596 0.3 . 1 . . . . 445 THR N . 26920 1 343 . 1 1 99 99 LYS H H 1 7.345 0.02 . 1 . . . . 446 LYS H . 26920 1 344 . 1 1 99 99 LYS CA C 13 59.309 0.3 . 1 . . . . 446 LYS CA . 26920 1 345 . 1 1 99 99 LYS CB C 13 33.129 0.3 . 1 . . . . 446 LYS CB . 26920 1 346 . 1 1 99 99 LYS N N 15 120.846 0.3 . 1 . . . . 446 LYS N . 26920 1 347 . 1 1 100 100 ALA H H 1 8.337 0.02 . 1 . . . . 447 ALA H . 26920 1 348 . 1 1 100 100 ALA CA C 13 56.037 0.3 . 1 . . . . 447 ALA CA . 26920 1 349 . 1 1 100 100 ALA CB C 13 19.414 0.3 . 1 . . . . 447 ALA CB . 26920 1 350 . 1 1 100 100 ALA N N 15 120.393 0.3 . 1 . . . . 447 ALA N . 26920 1 351 . 1 1 101 101 MET H H 1 8.357 0.02 . 1 . . . . 448 MET H . 26920 1 352 . 1 1 101 101 MET CA C 13 61.375 0.3 . 1 . . . . 448 MET CA . 26920 1 353 . 1 1 101 101 MET CB C 13 34.275 0.3 . 1 . . . . 448 MET CB . 26920 1 354 . 1 1 101 101 MET N N 15 116.201 0.3 . 1 . . . . 448 MET N . 26920 1 355 . 1 1 102 102 ASP H H 1 7.27 0.02 . 1 . . . . 449 ASP H . 26920 1 356 . 1 1 102 102 ASP CA C 13 57.503 0.3 . 1 . . . . 449 ASP CA . 26920 1 357 . 1 1 102 102 ASP CB C 13 41.171 0.3 . 1 . . . . 449 ASP CB . 26920 1 358 . 1 1 102 102 ASP N N 15 117.674 0.3 . 1 . . . . 449 ASP N . 26920 1 359 . 1 1 103 103 VAL H H 1 7.836 0.02 . 1 . . . . 450 VAL H . 26920 1 360 . 1 1 103 103 VAL CA C 13 66.571 0.3 . 1 . . . . 450 VAL CA . 26920 1 361 . 1 1 103 103 VAL CB C 13 31.203 0.3 . 1 . . . . 450 VAL CB . 26920 1 362 . 1 1 103 103 VAL N N 15 120.729 0.3 . 1 . . . . 450 VAL N . 26920 1 363 . 1 1 104 104 TYR H H 1 9.225 0.02 . 1 . . . . 451 TYR H . 26920 1 364 . 1 1 104 104 TYR CA C 13 62.706 0.3 . 1 . . . . 451 TYR CA . 26920 1 365 . 1 1 104 104 TYR CB C 13 38.025 0.3 . 1 . . . . 451 TYR CB . 26920 1 366 . 1 1 104 104 TYR N N 15 120.619 0.3 . 1 . . . . 451 TYR N . 26920 1 367 . 1 1 105 105 GLN H H 1 8.61 0.02 . 1 . . . . 452 GLN H . 26920 1 368 . 1 1 105 105 GLN CA C 13 58.955 0.3 . 1 . . . . 452 GLN CA . 26920 1 369 . 1 1 105 105 GLN CB C 13 28.588 0.3 . 1 . . . . 452 GLN CB . 26920 1 370 . 1 1 105 105 GLN N N 15 117.448 0.3 . 1 . . . . 452 GLN N . 26920 1 371 . 1 1 106 106 LYS H H 1 7.598 0.02 . 1 . . . . 453 LYS H . 26920 1 372 . 1 1 106 106 LYS CA C 13 58.774 0.3 . 1 . . . . 453 LYS CA . 26920 1 373 . 1 1 106 106 LYS CB C 13 31.492 0.3 . 1 . . . . 453 LYS CB . 26920 1 374 . 1 1 106 106 LYS N N 15 120.28 0.3 . 1 . . . . 453 LYS N . 26920 1 375 . 1 1 107 107 ALA H H 1 7.708 0.02 . 1 . . . . 454 ALA H . 26920 1 376 . 1 1 107 107 ALA CA C 13 55.326 0.3 . 1 . . . . 454 ALA CA . 26920 1 377 . 1 1 107 107 ALA CB C 13 18.305 0.3 . 1 . . . . 454 ALA CB . 26920 1 378 . 1 1 107 107 ALA N N 15 119.713 0.3 . 1 . . . . 454 ALA N . 26920 1 379 . 1 1 108 108 LEU H H 1 7.81 0.02 . 1 . . . . 455 LEU H . 26920 1 380 . 1 1 108 108 LEU CA C 13 56.536 0.3 . 1 . . . . 455 LEU CA . 26920 1 381 . 1 1 108 108 LEU CB C 13 42.018 0.3 . 1 . . . . 455 LEU CB . 26920 1 382 . 1 1 108 108 LEU N N 15 117.787 0.3 . 1 . . . . 455 LEU N . 26920 1 383 . 1 1 109 109 ASP H H 1 8.138 0.02 . 1 . . . . 456 ASP H . 26920 1 384 . 1 1 109 109 ASP CA C 13 56.414 0.3 . 1 . . . . 456 ASP CA . 26920 1 385 . 1 1 109 109 ASP CB C 13 40.445 0.3 . 1 . . . . 456 ASP CB . 26920 1 386 . 1 1 109 109 ASP N N 15 118.92 0.3 . 1 . . . . 456 ASP N . 26920 1 387 . 1 1 110 110 LEU H H 1 7.325 0.02 . 1 . . . . 457 LEU H . 26920 1 388 . 1 1 110 110 LEU CA C 13 56.888 0.3 . 1 . . . . 457 LEU CA . 26920 1 389 . 1 1 110 110 LEU CB C 13 42.743 0.3 . 1 . . . . 457 LEU CB . 26920 1 390 . 1 1 110 110 LEU N N 15 120.28 0.3 . 1 . . . . 457 LEU N . 26920 1 391 . 1 1 111 111 ASP H H 1 8.213 0.02 . 1 . . . . 458 ASP H . 26920 1 392 . 1 1 111 111 ASP CA C 13 53.753 0.3 . 1 . . . . 458 ASP CA . 26920 1 393 . 1 1 111 111 ASP CB C 13 41.989 0.3 . 1 . . . . 458 ASP CB . 26920 1 394 . 1 1 111 111 ASP N N 15 118.24 0.3 . 1 . . . . 458 ASP N . 26920 1 395 . 1 1 112 112 SER H H 1 8.726 0.02 . 1 . . . . 459 SER H . 26920 1 396 . 1 1 112 112 SER CA C 13 60.568 0.3 . 1 . . . . 459 SER CA . 26920 1 397 . 1 1 112 112 SER CB C 13 62.969 0.3 . 1 . . . . 459 SER CB . 26920 1 398 . 1 1 112 112 SER N N 15 121.299 0.3 . 1 . . . . 459 SER N . 26920 1 399 . 1 1 113 113 SER H H 1 8.507 0.02 . 1 . . . . 460 SER H . 26920 1 400 . 1 1 113 113 SER CA C 13 58.207 0.3 . 1 . . . . 460 SER CA . 26920 1 401 . 1 1 113 113 SER CB C 13 64.255 0.3 . 1 . . . . 460 SER CB . 26920 1 402 . 1 1 113 113 SER N N 15 117.108 0.3 . 1 . . . . 460 SER N . 26920 1 403 . 1 1 114 114 CYS H H 1 7.434 0.02 . 1 . . . . 461 CYS H . 26920 1 404 . 1 1 114 114 CYS CA C 13 59.134 0.3 . 1 . . . . 461 CYS CA . 26920 1 405 . 1 1 114 114 CYS CB C 13 26.225 0.3 . 1 . . . . 461 CYS CB . 26920 1 406 . 1 1 114 114 CYS N N 15 121.979 0.3 . 1 . . . . 461 CYS N . 26920 1 407 . 1 1 115 115 LYS H H 1 8.644 0.02 . 1 . . . . 462 LYS H . 26920 1 408 . 1 1 115 115 LYS CA C 13 59.546 0.3 . 1 . . . . 462 LYS CA . 26920 1 409 . 1 1 115 115 LYS CB C 13 32.823 0.3 . 1 . . . . 462 LYS CB . 26920 1 410 . 1 1 115 115 LYS N N 15 107.705 0.3 . 1 . . . . 462 LYS N . 26920 1 411 . 1 1 116 116 GLU H H 1 9.006 0.02 . 1 . . . . 463 GLU H . 26920 1 412 . 1 1 116 116 GLU CA C 13 59.367 0.3 . 1 . . . . 463 GLU CA . 26920 1 413 . 1 1 116 116 GLU CB C 13 29.798 0.3 . 1 . . . . 463 GLU CB . 26920 1 414 . 1 1 116 116 GLU N N 15 117.674 0.3 . 1 . . . . 463 GLU N . 26920 1 415 . 1 1 117 117 ALA H H 1 7.544 0.02 . 1 . . . . 464 ALA H . 26920 1 416 . 1 1 117 117 ALA CA C 13 53.874 0.3 . 1 . . . . 464 ALA CA . 26920 1 417 . 1 1 117 117 ALA CB C 13 18.91 0.3 . 1 . . . . 464 ALA CB . 26920 1 418 . 1 1 117 117 ALA N N 15 121.073 0.3 . 1 . . . . 464 ALA N . 26920 1 419 . 1 1 118 118 ALA H H 1 7.906 0.02 . 1 . . . . 465 ALA H . 26920 1 420 . 1 1 118 118 ALA CA C 13 55.579 0.3 . 1 . . . . 465 ALA CA . 26920 1 421 . 1 1 118 118 ALA CB C 13 18.385 0.3 . 1 . . . . 465 ALA CB . 26920 1 422 . 1 1 118 118 ALA N N 15 123.112 0.3 . 1 . . . . 465 ALA N . 26920 1 423 . 1 1 119 119 ASP H H 1 8.965 0.02 . 1 . . . . 466 ASP H . 26920 1 424 . 1 1 119 119 ASP CA C 13 56.815 0.3 . 1 . . . . 466 ASP CA . 26920 1 425 . 1 1 119 119 ASP CB C 13 39.669 0.3 . 1 . . . . 466 ASP CB . 26920 1 426 . 1 1 119 119 ASP N N 15 118.807 0.3 . 1 . . . . 466 ASP N . 26920 1 427 . 1 1 120 120 GLY H H 1 7.591 0.02 . 1 . . . . 467 GLY H . 26920 1 428 . 1 1 120 120 GLY CA C 13 46.857 0.3 . 1 . . . . 467 GLY CA . 26920 1 429 . 1 1 120 120 GLY N N 15 108.725 0.3 . 1 . . . . 467 GLY N . 26920 1 430 . 1 1 121 121 TYR H H 1 8.179 0.02 . 1 . . . . 468 TYR H . 26920 1 431 . 1 1 121 121 TYR CA C 13 63.406 0.3 . 1 . . . . 468 TYR CA . 26920 1 432 . 1 1 121 121 TYR CB C 13 38.79 0.3 . 1 . . . . 468 TYR CB . 26920 1 433 . 1 1 121 121 TYR N N 15 122.885 0.3 . 1 . . . . 468 TYR N . 26920 1 434 . 1 1 122 122 GLN H H 1 7.55 0.02 . 1 . . . . 469 GLN H . 26920 1 435 . 1 1 122 122 GLN CA C 13 58.955 0.3 . 1 . . . . 469 GLN CA . 26920 1 436 . 1 1 122 122 GLN CB C 13 28.346 0.3 . 1 . . . . 469 GLN CB . 26920 1 437 . 1 1 122 122 GLN N N 15 115.975 0.3 . 1 . . . . 469 GLN N . 26920 1 438 . 1 1 123 123 ARG H H 1 8.193 0.02 . 1 . . . . 470 ARG H . 26920 1 439 . 1 1 123 123 ARG CA C 13 60.044 0.3 . 1 . . . . 470 ARG CA . 26920 1 440 . 1 1 123 123 ARG CB C 13 31.734 0.3 . 1 . . . . 470 ARG CB . 26920 1 441 . 1 1 123 123 ARG N N 15 118.807 0.3 . 1 . . . . 470 ARG N . 26920 1 442 . 1 1 124 124 CYS H H 1 8.131 0.02 . 1 . . . . 471 CYS H . 26920 1 443 . 1 1 124 124 CYS CA C 13 64.334 0.3 . 1 . . . . 471 CYS CA . 26920 1 444 . 1 1 124 124 CYS CB C 13 28.31 0.3 . 1 . . . . 471 CYS CB . 26920 1 445 . 1 1 124 124 CYS N N 15 117.223 0.3 . 1 . . . . 471 CYS N . 26920 1 446 . 1 1 125 125 MET H H 1 8.227 0.02 . 1 . . . . 472 MET H . 26920 1 447 . 1 1 125 125 MET CA C 13 58.955 0.3 . 1 . . . . 472 MET CA . 26920 1 448 . 1 1 125 125 MET CB C 13 32.46 0.3 . 1 . . . . 472 MET CB . 26920 1 449 . 1 1 125 125 MET N N 15 120.959 0.3 . 1 . . . . 472 MET N . 26920 1 450 . 1 1 126 126 MET H H 1 7.851 0.02 . 1 . . . . 473 MET H . 26920 1 451 . 1 1 126 126 MET CA C 13 57.261 0.3 . 1 . . . . 473 MET CA . 26920 1 452 . 1 1 126 126 MET CB C 13 32.24 0.3 . 1 . . . . 473 MET CB . 26920 1 453 . 1 1 126 126 MET N N 15 116.428 0.3 . 1 . . . . 473 MET N . 26920 1 454 . 1 1 127 127 ALA H H 1 7.585 0.02 . 1 . . . . 474 ALA H . 26920 1 455 . 1 1 127 127 ALA CA C 13 54.127 0.3 . 1 . . . . 474 ALA CA . 26920 1 456 . 1 1 127 127 ALA CB C 13 17.121 0.3 . 1 . . . . 474 ALA CB . 26920 1 457 . 1 1 127 127 ALA N N 15 121.412 0.3 . 1 . . . . 474 ALA N . 26920 1 458 . 1 1 128 128 GLN H H 1 7.468 0.02 . 1 . . . . 475 GLN H . 26920 1 459 . 1 1 128 128 GLN CA C 13 57.261 0.3 . 1 . . . . 475 GLN CA . 26920 1 460 . 1 1 128 128 GLN CB C 13 29.072 0.3 . 1 . . . . 475 GLN CB . 26920 1 461 . 1 1 128 128 GLN N N 15 115.408 0.3 . 1 . . . . 475 GLN N . 26920 1 462 . 1 1 129 129 TYR H H 1 7.639 0.02 . 1 . . . . 476 TYR H . 26920 1 463 . 1 1 129 129 TYR CA C 13 58.592 0.3 . 1 . . . . 476 TYR CA . 26920 1 464 . 1 1 129 129 TYR CB C 13 38.63 0.3 . 1 . . . . 476 TYR CB . 26920 1 465 . 1 1 129 129 TYR N N 15 117.901 0.3 . 1 . . . . 476 TYR N . 26920 1 466 . 1 1 130 130 ASN H H 1 8.002 0.02 . 1 . . . . 477 ASN H . 26920 1 467 . 1 1 130 130 ASN CA C 13 53.511 0.3 . 1 . . . . 477 ASN CA . 26920 1 468 . 1 1 130 130 ASN CB C 13 38.929 0.3 . 1 . . . . 477 ASN CB . 26920 1 469 . 1 1 130 130 ASN N N 15 118.58 0.3 . 1 . . . . 477 ASN N . 26920 1 470 . 1 1 131 131 ARG H H 1 7.981 0.02 . 1 . . . . 478 ARG H . 26920 1 471 . 1 1 131 131 ARG CA C 13 56.415 0.3 . 1 . . . . 478 ARG CA . 26920 1 472 . 1 1 131 131 ARG CB C 13 30.887 0.3 . 1 . . . . 478 ARG CB . 26920 1 473 . 1 1 131 131 ARG N N 15 120.393 0.3 . 1 . . . . 478 ARG N . 26920 1 474 . 1 1 133 133 ASP H H 1 8.364 0.02 . 1 . . . . 480 ASP H . 26920 1 475 . 1 1 133 133 ASP CA C 13 54.479 0.3 . 1 . . . . 480 ASP CA . 26920 1 476 . 1 1 133 133 ASP CB C 13 41.413 0.3 . 1 . . . . 480 ASP CB . 26920 1 477 . 1 1 133 133 ASP N N 15 120.959 0.3 . 1 . . . . 480 ASP N . 26920 1 478 . 1 1 134 134 SER H H 1 8.254 0.02 . 1 . . . . 481 SER H . 26920 1 479 . 1 1 134 134 SER CA C 13 56.415 0.3 . 1 . . . . 481 SER CA . 26920 1 480 . 1 1 134 134 SER CB C 13 63.553 0.3 . 1 . . . . 481 SER CB . 26920 1 481 . 1 1 134 134 SER N N 15 116.655 0.3 . 1 . . . . 481 SER N . 26920 1 482 . 1 1 135 135 PRO CA C 13 63.432 0.3 . 1 . . . . 482 PRO CA . 26920 1 483 . 1 1 135 135 PRO CB C 13 32.186 0.3 . 1 . . . . 482 PRO CB . 26920 1 484 . 1 1 136 136 GLU H H 1 8.446 0.02 . 1 . . . . 483 GLU H . 26920 1 485 . 1 1 136 136 GLU CA C 13 56.415 0.3 . 1 . . . . 483 GLU CA . 26920 1 486 . 1 1 136 136 GLU CB C 13 30.645 0.3 . 1 . . . . 483 GLU CB . 26920 1 487 . 1 1 136 136 GLU N N 15 120.733 0.3 . 1 . . . . 483 GLU N . 26920 1 488 . 1 1 137 137 ASP H H 1 7.926 0.02 . 1 . . . . 484 ASP H . 26920 1 489 . 1 1 137 137 ASP CA C 13 56.123 0.3 . 1 . . . . 484 ASP CA . 26920 1 490 . 1 1 137 137 ASP CB C 13 42.381 0.3 . 1 . . . . 484 ASP CB . 26920 1 491 . 1 1 137 137 ASP N N 15 126.623 0.3 . 1 . . . . 484 ASP N . 26920 1 stop_ save_