################################### # 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 19085 _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 . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _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 3 '2D 1H-15N HSQC' . . . 19085 1 4 '2D 1H-13C HSQC aliphatic' . . . 19085 1 5 '2D 1H-13C HSQC aromatic' . . . 19085 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 1 1 GLU HA H 1 4.013 0.020 . 1 . . . A 1 GLU HA . 19085 1 2 . 1 1 1 1 GLU HB2 H 1 2.094 0.020 . 2 . . . A 1 GLU HB2 . 19085 1 3 . 1 1 1 1 GLU HB3 H 1 2.093 0.020 . 2 . . . A 1 GLU HB3 . 19085 1 4 . 1 1 1 1 GLU HG2 H 1 2.429 0.020 . 1 . . . A 1 GLU HG2 . 19085 1 5 . 1 1 1 1 GLU HG3 H 1 2.432 0.020 . 1 . . . A 1 GLU HG3 . 19085 1 6 . 1 1 1 1 GLU CA C 13 55.332 0.200 . 1 . . . A 1 GLU CA . 19085 1 7 . 1 1 1 1 GLU CB C 13 29.372 0.200 . 1 . . . A 1 GLU CB . 19085 1 8 . 1 1 1 1 GLU CG C 13 33.572 0.200 . 1 . . . A 1 GLU CG . 19085 1 9 . 1 1 2 2 ALA H H 1 8.685 0.020 . 1 . . . A 2 ALA H . 19085 1 10 . 1 1 2 2 ALA HA H 1 4.301 0.020 . 1 . . . A 2 ALA HA . 19085 1 11 . 1 1 2 2 ALA HB1 H 1 1.334 0.020 . 1 . . . A 2 ALA HB1 . 19085 1 12 . 1 1 2 2 ALA HB2 H 1 1.334 0.020 . 1 . . . A 2 ALA HB2 . 19085 1 13 . 1 1 2 2 ALA HB3 H 1 1.334 0.020 . 1 . . . A 2 ALA HB3 . 19085 1 14 . 1 1 2 2 ALA CA C 13 52.406 0.200 . 1 . . . A 2 ALA CA . 19085 1 15 . 1 1 2 2 ALA CB C 13 19.210 0.200 . 1 . . . A 2 ALA CB . 19085 1 16 . 1 1 2 2 ALA N N 15 126.951 0.200 . 1 . . . A 2 ALA N . 19085 1 17 . 1 1 3 3 ALA H H 1 8.328 0.020 . 1 . . . A 3 ALA H . 19085 1 18 . 1 1 3 3 ALA HA H 1 4.269 0.020 . 1 . . . A 3 ALA HA . 19085 1 19 . 1 1 3 3 ALA HB1 H 1 1.306 0.020 . 1 . . . A 3 ALA HB1 . 19085 1 20 . 1 1 3 3 ALA HB2 H 1 1.306 0.020 . 1 . . . A 3 ALA HB2 . 19085 1 21 . 1 1 3 3 ALA HB3 H 1 1.306 0.020 . 1 . . . A 3 ALA HB3 . 19085 1 22 . 1 1 3 3 ALA CA C 13 52.178 0.200 . 1 . . . A 3 ALA CA . 19085 1 23 . 1 1 3 3 ALA CB C 13 19.345 0.200 . 1 . . . A 3 ALA CB . 19085 1 24 . 1 1 3 3 ALA N N 15 124.358 0.200 . 1 . . . A 3 ALA N . 19085 1 25 . 1 1 4 4 VAL H H 1 8.107 0.020 . 1 . . . A 4 VAL H . 19085 1 26 . 1 1 4 4 VAL HA H 1 3.949 0.020 . 1 . . . A 4 VAL HA . 19085 1 27 . 1 1 4 4 VAL HB H 1 1.931 0.020 . 1 . . . A 4 VAL HB . 19085 1 28 . 1 1 4 4 VAL HG11 H 1 0.838 0.020 . 2 . . . A 4 VAL HG11 . 19085 1 29 . 1 1 4 4 VAL HG12 H 1 0.838 0.020 . 2 . . . A 4 VAL HG12 . 19085 1 30 . 1 1 4 4 VAL HG13 H 1 0.838 0.020 . 2 . . . A 4 VAL HG13 . 19085 1 31 . 1 1 4 4 VAL HG21 H 1 0.838 0.020 . 2 . . . A 4 VAL HG21 . 19085 1 32 . 1 1 4 4 VAL HG22 H 1 0.838 0.020 . 2 . . . A 4 VAL HG22 . 19085 1 33 . 1 1 4 4 VAL HG23 H 1 0.838 0.020 . 2 . . . A 4 VAL HG23 . 19085 1 34 . 1 1 4 4 VAL CA C 13 62.170 0.200 . 1 . . . A 4 VAL CA . 19085 1 35 . 1 1 4 4 VAL CB C 13 32.626 0.200 . 1 . . . A 4 VAL CB . 19085 1 36 . 1 1 4 4 VAL CG1 C 13 20.325 0.200 . 1 . . . A 4 VAL CG1 . 19085 1 37 . 1 1 4 4 VAL CG2 C 13 21.131 0.200 . 1 . . . A 4 VAL CG2 . 19085 1 38 . 1 1 4 4 VAL N N 15 119.842 0.200 . 1 . . . A 4 VAL N . 19085 1 39 . 1 1 5 5 CYS H H 1 7.666 0.020 . 1 . . . A 5 CYS H . 19085 1 40 . 1 1 5 5 CYS HA H 1 4.633 0.020 . 1 . . . A 5 CYS HA . 19085 1 41 . 1 1 5 5 CYS HB2 H 1 0.660 0.020 . 1 . . . A 5 CYS HB2 . 19085 1 42 . 1 1 5 5 CYS HB3 H 1 2.085 0.020 . 1 . . . A 5 CYS HB3 . 19085 1 43 . 1 1 5 5 CYS CB C 13 35.325 0.200 . 1 . . . A 5 CYS CB . 19085 1 44 . 1 1 5 5 CYS N N 15 121.502 0.200 . 1 . . . A 5 CYS N . 19085 1 45 . 1 1 6 6 THR H H 1 8.411 0.020 . 1 . . . A 6 THR H . 19085 1 46 . 1 1 6 6 THR HA H 1 4.674 0.006 . 1 . . . A 6 THR HA . 19085 1 47 . 1 1 6 6 THR HB H 1 4.730 0.005 . 1 . . . A 6 THR HB . 19085 1 48 . 1 1 6 6 THR HG21 H 1 1.368 0.020 . 1 . . . A 6 THR HG21 . 19085 1 49 . 1 1 6 6 THR HG22 H 1 1.368 0.020 . 1 . . . A 6 THR HG22 . 19085 1 50 . 1 1 6 6 THR HG23 H 1 1.368 0.020 . 1 . . . A 6 THR HG23 . 19085 1 51 . 1 1 6 6 THR CG2 C 13 19.226 0.200 . 1 . . . A 6 THR CG2 . 19085 1 52 . 1 1 6 6 THR N N 15 109.529 0.200 . 1 . . . A 6 THR N . 19085 1 53 . 1 1 7 7 THR H H 1 8.362 0.020 . 1 . . . A 7 THR H . 19085 1 54 . 1 1 7 7 THR HA H 1 4.729 0.020 . 1 . . . A 7 THR HA . 19085 1 55 . 1 1 7 7 THR HB H 1 4.639 0.020 . 1 . . . A 7 THR HB . 19085 1 56 . 1 1 7 7 THR HG21 H 1 1.277 0.020 . 1 . . . A 7 THR HG21 . 19085 1 57 . 1 1 7 7 THR HG22 H 1 1.277 0.020 . 1 . . . A 7 THR HG22 . 19085 1 58 . 1 1 7 7 THR HG23 H 1 1.277 0.020 . 1 . . . A 7 THR HG23 . 19085 1 59 . 1 1 7 7 THR CG2 C 13 21.199 0.200 . 1 . . . A 7 THR CG2 . 19085 1 60 . 1 1 7 7 THR N N 15 112.520 0.200 . 1 . . . A 7 THR N . 19085 1 61 . 1 1 8 8 GLU H H 1 7.885 0.020 . 1 . . . A 8 GLU H . 19085 1 62 . 1 1 8 8 GLU HA H 1 4.138 0.020 . 1 . . . A 8 GLU HA . 19085 1 63 . 1 1 8 8 GLU HB2 H 1 2.026 0.020 . 1 . . . A 8 GLU HB2 . 19085 1 64 . 1 1 8 8 GLU HB3 H 1 1.975 0.020 . 1 . . . A 8 GLU HB3 . 19085 1 65 . 1 1 8 8 GLU HG2 H 1 2.408 0.020 . 1 . . . A 8 GLU HG2 . 19085 1 66 . 1 1 8 8 GLU HG3 H 1 2.297 0.020 . 1 . . . A 8 GLU HG3 . 19085 1 67 . 1 1 8 8 GLU CA C 13 57.299 0.200 . 1 . . . A 8 GLU CA . 19085 1 68 . 1 1 8 8 GLU CB C 13 29.033 0.200 . 1 . . . A 8 GLU CB . 19085 1 69 . 1 1 8 8 GLU CG C 13 34.170 0.200 . 1 . . . A 8 GLU CG . 19085 1 70 . 1 1 8 8 GLU N N 15 123.121 0.200 . 1 . . . A 8 GLU N . 19085 1 71 . 1 1 9 9 TRP H H 1 8.799 0.020 . 1 . . . A 9 TRP H . 19085 1 72 . 1 1 9 9 TRP HA H 1 4.938 0.020 . 1 . . . A 9 TRP HA . 19085 1 73 . 1 1 9 9 TRP HB2 H 1 3.370 0.020 . 1 . . . A 9 TRP HB2 . 19085 1 74 . 1 1 9 9 TRP HB3 H 1 3.197 0.020 . 1 . . . A 9 TRP HB3 . 19085 1 75 . 1 1 9 9 TRP HD1 H 1 7.214 0.020 . 1 . . . A 9 TRP HD1 . 19085 1 76 . 1 1 9 9 TRP HE1 H 1 10.207 0.020 . 1 . . . A 9 TRP HE1 . 19085 1 77 . 1 1 9 9 TRP HE3 H 1 7.719 0.020 . 1 . . . A 9 TRP HE3 . 19085 1 78 . 1 1 9 9 TRP HZ2 H 1 7.437 0.020 . 1 . . . A 9 TRP HZ2 . 19085 1 79 . 1 1 9 9 TRP HZ3 H 1 7.010 0.020 . 1 . . . A 9 TRP HZ3 . 19085 1 80 . 1 1 9 9 TRP HH2 H 1 7.098 0.020 . 1 . . . A 9 TRP HH2 . 19085 1 81 . 1 1 9 9 TRP CB C 13 29.305 0.200 . 1 . . . A 9 TRP CB . 19085 1 82 . 1 1 9 9 TRP CD1 C 13 128.213 0.200 . 1 . . . A 9 TRP CD1 . 19085 1 83 . 1 1 9 9 TRP CZ2 C 13 114.466 0.200 . 1 . . . A 9 TRP CZ2 . 19085 1 84 . 1 1 9 9 TRP CZ3 C 13 121.816 0.200 . 1 . . . A 9 TRP CZ3 . 19085 1 85 . 1 1 9 9 TRP CH2 C 13 124.635 0.200 . 1 . . . A 9 TRP CH2 . 19085 1 86 . 1 1 9 9 TRP N N 15 126.973 0.200 . 1 . . . A 9 TRP N . 19085 1 87 . 1 1 9 9 TRP NE1 N 15 129.549 0.200 . 1 . . . A 9 TRP NE1 . 19085 1 88 . 1 1 10 10 ASP H H 1 8.790 0.020 . 1 . . . A 10 ASP H . 19085 1 89 . 1 1 10 10 ASP HA H 1 4.656 0.020 . 1 . . . A 10 ASP HA . 19085 1 90 . 1 1 10 10 ASP HB2 H 1 2.682 0.020 . 1 . . . A 10 ASP HB2 . 19085 1 91 . 1 1 10 10 ASP HB3 H 1 2.621 0.020 . 1 . . . A 10 ASP HB3 . 19085 1 92 . 1 1 10 10 ASP CA C 13 50.047 0.200 . 1 . . . A 10 ASP CA . 19085 1 93 . 1 1 10 10 ASP CB C 13 38.489 0.200 . 1 . . . A 10 ASP CB . 19085 1 94 . 1 1 10 10 ASP N N 15 126.641 0.200 . 1 . . . A 10 ASP N . 19085 1 95 . 1 1 11 11 PRO HA H 1 4.054 0.020 . 1 . . . A 11 PRO HA . 19085 1 96 . 1 1 11 11 PRO HB2 H 1 0.643 0.020 . 1 . . . A 11 PRO HB2 . 19085 1 97 . 1 1 11 11 PRO HB3 H 1 0.998 0.020 . 1 . . . A 11 PRO HB3 . 19085 1 98 . 1 1 11 11 PRO HG2 H 1 1.399 0.020 . 1 . . . A 11 PRO HG2 . 19085 1 99 . 1 1 11 11 PRO HG3 H 1 1.508 0.020 . 1 . . . A 11 PRO HG3 . 19085 1 100 . 1 1 11 11 PRO HD2 H 1 3.189 0.020 . 1 . . . A 11 PRO HD2 . 19085 1 101 . 1 1 11 11 PRO HD3 H 1 1.131 0.020 . 1 . . . A 11 PRO HD3 . 19085 1 102 . 1 1 11 11 PRO CA C 13 62.749 0.200 . 1 . . . A 11 PRO CA . 19085 1 103 . 1 1 11 11 PRO CB C 13 33.189 0.200 . 1 . . . A 11 PRO CB . 19085 1 104 . 1 1 11 11 PRO CG C 13 27.725 0.200 . 1 . . . A 11 PRO CG . 19085 1 105 . 1 1 11 11 PRO CD C 13 48.989 0.200 . 1 . . . A 11 PRO CD . 19085 1 106 . 1 1 12 12 VAL H H 1 8.078 0.020 . 1 . . . A 12 VAL H . 19085 1 107 . 1 1 12 12 VAL HA H 1 4.447 0.020 . 1 . . . A 12 VAL HA . 19085 1 108 . 1 1 12 12 VAL HB H 1 1.820 0.020 . 1 . . . A 12 VAL HB . 19085 1 109 . 1 1 12 12 VAL HG11 H 1 0.831 0.020 . 2 . . . A 12 VAL HG11 . 19085 1 110 . 1 1 12 12 VAL HG12 H 1 0.831 0.020 . 2 . . . A 12 VAL HG12 . 19085 1 111 . 1 1 12 12 VAL HG13 H 1 0.831 0.020 . 2 . . . A 12 VAL HG13 . 19085 1 112 . 1 1 12 12 VAL HG21 H 1 0.584 0.020 . 2 . . . A 12 VAL HG21 . 19085 1 113 . 1 1 12 12 VAL HG22 H 1 0.584 0.020 . 2 . . . A 12 VAL HG22 . 19085 1 114 . 1 1 12 12 VAL HG23 H 1 0.584 0.020 . 2 . . . A 12 VAL HG23 . 19085 1 115 . 1 1 12 12 VAL CG1 C 13 22.666 0.200 . 1 . . . A 12 VAL CG1 . 19085 1 116 . 1 1 12 12 VAL CG2 C 13 20.589 0.200 . 1 . . . A 12 VAL CG2 . 19085 1 117 . 1 1 12 12 VAL N N 15 110.024 0.200 . 1 . . . A 12 VAL N . 19085 1 118 . 1 1 13 13 CYS H H 1 8.431 0.020 . 1 . . . A 13 CYS H . 19085 1 119 . 1 1 13 13 CYS HA H 1 5.222 0.020 . 1 . . . A 13 CYS HA . 19085 1 120 . 1 1 13 13 CYS HB2 H 1 1.266 0.020 . 1 . . . A 13 CYS HB2 . 19085 1 121 . 1 1 13 13 CYS HB3 H 1 2.434 0.020 . 1 . . . A 13 CYS HB3 . 19085 1 122 . 1 1 13 13 CYS CA C 13 53.837 0.200 . 1 . . . A 13 CYS CA . 19085 1 123 . 1 1 13 13 CYS CB C 13 38.384 0.200 . 1 . . . A 13 CYS CB . 19085 1 124 . 1 1 13 13 CYS N N 15 120.371 0.200 . 1 . . . A 13 CYS N . 19085 1 125 . 1 1 14 14 GLY H H 1 9.577 0.020 . 1 . . . A 14 GLY H . 19085 1 126 . 1 1 14 14 GLY HA2 H 1 4.648 0.020 . 1 . . . A 14 GLY HA2 . 19085 1 127 . 1 1 14 14 GLY HA3 H 1 4.151 0.020 . 1 . . . A 14 GLY HA3 . 19085 1 128 . 1 1 14 14 GLY CA C 13 45.741 0.200 . 1 . . . A 14 GLY CA . 19085 1 129 . 1 1 14 14 GLY N N 15 116.333 0.200 . 1 . . . A 14 GLY N . 19085 1 130 . 1 1 15 15 LYS H H 1 8.838 0.020 . 1 . . . A 15 LYS H . 19085 1 131 . 1 1 15 15 LYS HA H 1 4.004 0.020 . 1 . . . A 15 LYS HA . 19085 1 132 . 1 1 15 15 LYS HB2 H 1 1.703 0.020 . 1 . . . A 15 LYS HB2 . 19085 1 133 . 1 1 15 15 LYS HB3 H 1 1.979 0.020 . 1 . . . A 15 LYS HB3 . 19085 1 134 . 1 1 15 15 LYS HG2 H 1 1.213 0.020 . 2 . . . A 15 LYS HG2 . 19085 1 135 . 1 1 15 15 LYS HG3 H 1 1.210 0.020 . 2 . . . A 15 LYS HG3 . 19085 1 136 . 1 1 15 15 LYS HD2 H 1 1.646 0.020 . 1 . . . A 15 LYS HD2 . 19085 1 137 . 1 1 15 15 LYS HD3 H 1 1.589 0.020 . 1 . . . A 15 LYS HD3 . 19085 1 138 . 1 1 15 15 LYS HE2 H 1 2.973 0.020 . 2 . . . A 15 LYS HE2 . 19085 1 139 . 1 1 15 15 LYS HE3 H 1 2.974 0.020 . 2 . . . A 15 LYS HE3 . 19085 1 140 . 1 1 15 15 LYS CA C 13 59.084 0.200 . 1 . . . A 15 LYS CA . 19085 1 141 . 1 1 15 15 LYS CB C 13 32.259 0.200 . 1 . . . A 15 LYS CB . 19085 1 142 . 1 1 15 15 LYS CG C 13 26.452 0.200 . 1 . . . A 15 LYS CG . 19085 1 143 . 1 1 15 15 LYS CE C 13 41.913 0.200 . 1 . . . A 15 LYS CE . 19085 1 144 . 1 1 15 15 LYS N N 15 122.042 0.200 . 1 . . . A 15 LYS N . 19085 1 145 . 1 1 16 16 ASP H H 1 8.354 0.020 . 1 . . . A 16 ASP H . 19085 1 146 . 1 1 16 16 ASP HA H 1 4.405 0.020 . 1 . . . A 16 ASP HA . 19085 1 147 . 1 1 16 16 ASP HB2 H 1 2.966 0.020 . 1 . . . A 16 ASP HB2 . 19085 1 148 . 1 1 16 16 ASP HB3 H 1 2.648 0.020 . 1 . . . A 16 ASP HB3 . 19085 1 149 . 1 1 16 16 ASP CB C 13 39.824 0.200 . 1 . . . A 16 ASP CB . 19085 1 150 . 1 1 16 16 ASP N N 15 116.512 0.200 . 1 . . . A 16 ASP N . 19085 1 151 . 1 1 17 17 GLY H H 1 8.215 0.020 . 1 . . . A 17 GLY H . 19085 1 152 . 1 1 17 17 GLY HA2 H 1 4.089 0.020 . 1 . . . A 17 GLY HA2 . 19085 1 153 . 1 1 17 17 GLY HA3 H 1 3.640 0.020 . 1 . . . A 17 GLY HA3 . 19085 1 154 . 1 1 17 17 GLY CA C 13 45.730 0.200 . 1 . . . A 17 GLY CA . 19085 1 155 . 1 1 17 17 GLY N N 15 108.685 0.200 . 1 . . . A 17 GLY N . 19085 1 156 . 1 1 18 18 LYS H H 1 7.827 0.020 . 1 . . . A 18 LYS H . 19085 1 157 . 1 1 18 18 LYS HA H 1 4.396 0.020 . 1 . . . A 18 LYS HA . 19085 1 158 . 1 1 18 18 LYS HB2 H 1 1.764 0.020 . 1 . . . A 18 LYS HB2 . 19085 1 159 . 1 1 18 18 LYS HB3 H 1 1.390 0.020 . 1 . . . A 18 LYS HB3 . 19085 1 160 . 1 1 18 18 LYS HG2 H 1 1.091 0.020 . 1 . . . A 18 LYS HG2 . 19085 1 161 . 1 1 18 18 LYS HG3 H 1 0.928 0.020 . 1 . . . A 18 LYS HG3 . 19085 1 162 . 1 1 18 18 LYS HD2 H 1 1.523 0.020 . 1 . . . A 18 LYS HD2 . 19085 1 163 . 1 1 18 18 LYS HD3 H 1 1.454 0.020 . 1 . . . A 18 LYS HD3 . 19085 1 164 . 1 1 18 18 LYS HE2 H 1 2.789 0.020 . 2 . . . A 18 LYS HE2 . 19085 1 165 . 1 1 18 18 LYS HE3 H 1 2.789 0.020 . 2 . . . A 18 LYS HE3 . 19085 1 166 . 1 1 18 18 LYS CA C 13 54.813 0.200 . 1 . . . A 18 LYS CA . 19085 1 167 . 1 1 18 18 LYS CB C 13 33.625 0.200 . 1 . . . A 18 LYS CB . 19085 1 168 . 1 1 18 18 LYS CG C 13 25.294 0.200 . 1 . . . A 18 LYS CG . 19085 1 169 . 1 1 18 18 LYS CD C 13 28.902 0.200 . 1 . . . A 18 LYS CD . 19085 1 170 . 1 1 18 18 LYS CE C 13 42.326 0.200 . 1 . . . A 18 LYS CE . 19085 1 171 . 1 1 18 18 LYS N N 15 121.419 0.200 . 1 . . . A 18 LYS N . 19085 1 172 . 1 1 19 19 THR H H 1 8.344 0.020 . 1 . . . A 19 THR H . 19085 1 173 . 1 1 19 19 THR HA H 1 4.843 0.020 . 1 . . . A 19 THR HA . 19085 1 174 . 1 1 19 19 THR HB H 1 3.992 0.020 . 1 . . . A 19 THR HB . 19085 1 175 . 1 1 19 19 THR HG21 H 1 1.131 0.020 . 1 . . . A 19 THR HG21 . 19085 1 176 . 1 1 19 19 THR HG22 H 1 1.131 0.020 . 1 . . . A 19 THR HG22 . 19085 1 177 . 1 1 19 19 THR HG23 H 1 1.131 0.020 . 1 . . . A 19 THR HG23 . 19085 1 178 . 1 1 19 19 THR CB C 13 69.515 0.200 . 1 . . . A 19 THR CB . 19085 1 179 . 1 1 19 19 THR CG2 C 13 23.928 0.200 . 1 . . . A 19 THR CG2 . 19085 1 180 . 1 1 19 19 THR N N 15 121.800 0.200 . 1 . . . A 19 THR N . 19085 1 181 . 1 1 20 20 TYR H H 1 9.355 0.020 . 1 . . . A 20 TYR H . 19085 1 182 . 1 1 20 20 TYR HA H 1 4.508 0.020 . 1 . . . A 20 TYR HA . 19085 1 183 . 1 1 20 20 TYR HB2 H 1 2.553 0.020 . 1 . . . A 20 TYR HB2 . 19085 1 184 . 1 1 20 20 TYR HB3 H 1 2.865 0.020 . 1 . . . A 20 TYR HB3 . 19085 1 185 . 1 1 20 20 TYR HD1 H 1 6.969 0.020 . 3 . . . A 20 TYR HD1 . 19085 1 186 . 1 1 20 20 TYR HD2 H 1 6.969 0.020 . 3 . . . A 20 TYR HD2 . 19085 1 187 . 1 1 20 20 TYR CB C 13 41.681 0.200 . 1 . . . A 20 TYR CB . 19085 1 188 . 1 1 20 20 TYR CD1 C 13 133.349 0.200 . 1 . . . A 20 TYR CD1 . 19085 1 189 . 1 1 20 20 TYR CD2 C 13 133.349 0.200 . 1 . . . A 20 TYR CD2 . 19085 1 190 . 1 1 20 20 TYR N N 15 127.910 0.200 . 1 . . . A 20 TYR N . 19085 1 191 . 1 1 21 21 SER H H 1 9.035 0.020 . 1 . . . A 21 SER H . 19085 1 192 . 1 1 21 21 SER HA H 1 3.804 0.020 . 1 . . . A 21 SER HA . 19085 1 193 . 1 1 21 21 SER HB2 H 1 4.010 0.020 . 1 . . . A 21 SER HB2 . 19085 1 194 . 1 1 21 21 SER HB3 H 1 3.895 0.020 . 1 . . . A 21 SER HB3 . 19085 1 195 . 1 1 21 21 SER CA C 13 61.968 0.200 . 1 . . . A 21 SER CA . 19085 1 196 . 1 1 21 21 SER CB C 13 63.517 0.200 . 1 . . . A 21 SER CB . 19085 1 197 . 1 1 21 21 SER N N 15 116.849 0.200 . 1 . . . A 21 SER N . 19085 1 198 . 1 1 22 22 ASN H H 1 7.344 0.020 . 1 . . . A 22 ASN H . 19085 1 199 . 1 1 22 22 ASN HA H 1 4.813 0.020 . 1 . . . A 22 ASN HA . 19085 1 200 . 1 1 22 22 ASN HB2 H 1 3.035 0.020 . 1 . . . A 22 ASN HB2 . 19085 1 201 . 1 1 22 22 ASN HB3 H 1 3.441 0.020 . 1 . . . A 22 ASN HB3 . 19085 1 202 . 1 1 22 22 ASN HD21 H 1 8.400 0.020 . 1 . . . A 22 ASN HD21 . 19085 1 203 . 1 1 22 22 ASN HD22 H 1 6.549 0.020 . 1 . . . A 22 ASN HD22 . 19085 1 204 . 1 1 22 22 ASN CB C 13 40.080 0.200 . 1 . . . A 22 ASN CB . 19085 1 205 . 1 1 22 22 ASN N N 15 105.634 0.200 . 1 . . . A 22 ASN N . 19085 1 206 . 1 1 22 22 ASN ND2 N 15 116.393 0.200 . 1 . . . A 22 ASN ND2 . 19085 1 207 . 1 1 23 23 LEU H H 1 8.832 0.020 . 1 . . . A 23 LEU H . 19085 1 208 . 1 1 23 23 LEU HA H 1 3.857 0.020 . 1 . . . A 23 LEU HA . 19085 1 209 . 1 1 23 23 LEU HB2 H 1 1.648 0.020 . 1 . . . A 23 LEU HB2 . 19085 1 210 . 1 1 23 23 LEU HB3 H 1 1.558 0.020 . 1 . . . A 23 LEU HB3 . 19085 1 211 . 1 1 23 23 LEU HG H 1 1.697 0.020 . 1 . . . A 23 LEU HG . 19085 1 212 . 1 1 23 23 LEU HD11 H 1 0.855 0.020 . 2 . . . A 23 LEU HD11 . 19085 1 213 . 1 1 23 23 LEU HD12 H 1 0.855 0.020 . 2 . . . A 23 LEU HD12 . 19085 1 214 . 1 1 23 23 LEU HD13 H 1 0.855 0.020 . 2 . . . A 23 LEU HD13 . 19085 1 215 . 1 1 23 23 LEU HD21 H 1 0.908 0.020 . 2 . . . A 23 LEU HD21 . 19085 1 216 . 1 1 23 23 LEU HD22 H 1 0.908 0.020 . 2 . . . A 23 LEU HD22 . 19085 1 217 . 1 1 23 23 LEU HD23 H 1 0.908 0.020 . 2 . . . A 23 LEU HD23 . 19085 1 218 . 1 1 23 23 LEU CA C 13 57.560 0.200 . 1 . . . A 23 LEU CA . 19085 1 219 . 1 1 23 23 LEU CB C 13 42.864 0.200 . 1 . . . A 23 LEU CB . 19085 1 220 . 1 1 23 23 LEU CD1 C 13 25.176 0.200 . 1 . . . A 23 LEU CD1 . 19085 1 221 . 1 1 23 23 LEU CD2 C 13 24.580 0.200 . 1 . . . A 23 LEU CD2 . 19085 1 222 . 1 1 23 23 LEU N N 15 118.802 0.200 . 1 . . . A 23 LEU N . 19085 1 223 . 1 1 24 24 CYS H H 1 8.180 0.020 . 1 . . . A 24 CYS H . 19085 1 224 . 1 1 24 24 CYS HA H 1 4.139 0.020 . 1 . . . A 24 CYS HA . 19085 1 225 . 1 1 24 24 CYS HB2 H 1 2.747 0.020 . 1 . . . A 24 CYS HB2 . 19085 1 226 . 1 1 24 24 CYS HB3 H 1 3.189 0.020 . 1 . . . A 24 CYS HB3 . 19085 1 227 . 1 1 24 24 CYS CA C 13 60.622 0.200 . 1 . . . A 24 CYS CA . 19085 1 228 . 1 1 24 24 CYS CB C 13 35.293 0.200 . 1 . . . A 24 CYS CB . 19085 1 229 . 1 1 24 24 CYS N N 15 119.567 0.200 . 1 . . . A 24 CYS N . 19085 1 230 . 1 1 25 25 TRP H H 1 7.587 0.020 . 1 . . . A 25 TRP H . 19085 1 231 . 1 1 25 25 TRP HA H 1 4.340 0.020 . 1 . . . A 25 TRP HA . 19085 1 232 . 1 1 25 25 TRP HB2 H 1 3.231 0.020 . 1 . . . A 25 TRP HB2 . 19085 1 233 . 1 1 25 25 TRP HB3 H 1 3.748 0.020 . 1 . . . A 25 TRP HB3 . 19085 1 234 . 1 1 25 25 TRP HD1 H 1 7.369 0.020 . 1 . . . A 25 TRP HD1 . 19085 1 235 . 1 1 25 25 TRP HE1 H 1 9.739 0.020 . 1 . . . A 25 TRP HE1 . 19085 1 236 . 1 1 25 25 TRP HE3 H 1 7.853 0.020 . 1 . . . A 25 TRP HE3 . 19085 1 237 . 1 1 25 25 TRP HZ2 H 1 7.196 0.020 . 1 . . . A 25 TRP HZ2 . 19085 1 238 . 1 1 25 25 TRP HZ3 H 1 7.169 0.020 . 1 . . . A 25 TRP HZ3 . 19085 1 239 . 1 1 25 25 TRP HH2 H 1 7.210 0.020 . 1 . . . A 25 TRP HH2 . 19085 1 240 . 1 1 25 25 TRP CB C 13 30.325 0.200 . 1 . . . A 25 TRP CB . 19085 1 241 . 1 1 25 25 TRP CD1 C 13 128.832 0.200 . 1 . . . A 25 TRP CD1 . 19085 1 242 . 1 1 25 25 TRP CZ2 C 13 114.930 0.200 . 1 . . . A 25 TRP CZ2 . 19085 1 243 . 1 1 25 25 TRP CZ3 C 13 121.513 0.200 . 1 . . . A 25 TRP CZ3 . 19085 1 244 . 1 1 25 25 TRP CH2 C 13 124.814 0.200 . 1 . . . A 25 TRP CH2 . 19085 1 245 . 1 1 25 25 TRP N N 15 120.561 0.200 . 1 . . . A 25 TRP N . 19085 1 246 . 1 1 25 25 TRP NE1 N 15 127.729 0.200 . 1 . . . A 25 TRP NE1 . 19085 1 247 . 1 1 26 26 LEU H H 1 7.312 0.020 . 1 . . . A 26 LEU H . 19085 1 248 . 1 1 26 26 LEU HA H 1 2.935 0.020 . 1 . . . A 26 LEU HA . 19085 1 249 . 1 1 26 26 LEU HB2 H 1 0.969 0.020 . 1 . . . A 26 LEU HB2 . 19085 1 250 . 1 1 26 26 LEU HB3 H 1 1.752 0.020 . 1 . . . A 26 LEU HB3 . 19085 1 251 . 1 1 26 26 LEU HG H 1 1.298 0.020 . 1 . . . A 26 LEU HG . 19085 1 252 . 1 1 26 26 LEU HD11 H 1 0.587 0.020 . 2 . . . A 26 LEU HD11 . 19085 1 253 . 1 1 26 26 LEU HD12 H 1 0.587 0.020 . 2 . . . A 26 LEU HD12 . 19085 1 254 . 1 1 26 26 LEU HD13 H 1 0.587 0.020 . 2 . . . A 26 LEU HD13 . 19085 1 255 . 1 1 26 26 LEU HD21 H 1 0.328 0.020 . 2 . . . A 26 LEU HD21 . 19085 1 256 . 1 1 26 26 LEU HD22 H 1 0.328 0.020 . 2 . . . A 26 LEU HD22 . 19085 1 257 . 1 1 26 26 LEU HD23 H 1 0.328 0.020 . 2 . . . A 26 LEU HD23 . 19085 1 258 . 1 1 26 26 LEU CA C 13 58.635 0.200 . 1 . . . A 26 LEU CA . 19085 1 259 . 1 1 26 26 LEU CB C 13 41.365 0.200 . 1 . . . A 26 LEU CB . 19085 1 260 . 1 1 26 26 LEU CG C 13 25.785 0.200 . 1 . . . A 26 LEU CG . 19085 1 261 . 1 1 26 26 LEU CD1 C 13 26.945 0.200 . 1 . . . A 26 LEU CD1 . 19085 1 262 . 1 1 26 26 LEU CD2 C 13 26.296 0.200 . 1 . . . A 26 LEU CD2 . 19085 1 263 . 1 1 26 26 LEU N N 15 122.581 0.200 . 1 . . . A 26 LEU N . 19085 1 264 . 1 1 27 27 ASN H H 1 8.444 0.020 . 1 . . . A 27 ASN H . 19085 1 265 . 1 1 27 27 ASN HA H 1 4.411 0.020 . 1 . . . A 27 ASN HA . 19085 1 266 . 1 1 27 27 ASN HB2 H 1 2.882 0.020 . 1 . . . A 27 ASN HB2 . 19085 1 267 . 1 1 27 27 ASN HB3 H 1 2.751 0.020 . 1 . . . A 27 ASN HB3 . 19085 1 268 . 1 1 27 27 ASN HD21 H 1 7.521 0.020 . 1 . . . A 27 ASN HD21 . 19085 1 269 . 1 1 27 27 ASN HD22 H 1 6.614 0.020 . 1 . . . A 27 ASN HD22 . 19085 1 270 . 1 1 27 27 ASN CB C 13 37.644 0.200 . 1 . . . A 27 ASN CB . 19085 1 271 . 1 1 27 27 ASN N N 15 117.645 0.200 . 1 . . . A 27 ASN N . 19085 1 272 . 1 1 27 27 ASN ND2 N 15 110.687 0.200 . 1 . . . A 27 ASN ND2 . 19085 1 273 . 1 1 28 28 GLU H H 1 8.365 0.020 . 1 . . . A 28 GLU H . 19085 1 274 . 1 1 28 28 GLU HA H 1 4.017 0.020 . 1 . . . A 28 GLU HA . 19085 1 275 . 1 1 28 28 GLU HB2 H 1 2.260 0.020 . 1 . . . A 28 GLU HB2 . 19085 1 276 . 1 1 28 28 GLU HB3 H 1 2.140 0.020 . 1 . . . A 28 GLU HB3 . 19085 1 277 . 1 1 28 28 GLU HG2 H 1 2.510 0.020 . 1 . . . A 28 GLU HG2 . 19085 1 278 . 1 1 28 28 GLU HG3 H 1 2.476 0.020 . 1 . . . A 28 GLU HG3 . 19085 1 279 . 1 1 28 28 GLU CA C 13 58.804 0.200 . 1 . . . A 28 GLU CA . 19085 1 280 . 1 1 28 28 GLU CB C 13 28.166 0.200 . 1 . . . A 28 GLU CB . 19085 1 281 . 1 1 28 28 GLU CG C 13 33.929 0.200 . 1 . . . A 28 GLU CG . 19085 1 282 . 1 1 28 28 GLU N N 15 121.101 0.200 . 1 . . . A 28 GLU N . 19085 1 283 . 1 1 29 29 ALA H H 1 7.530 0.020 . 1 . . . A 29 ALA H . 19085 1 284 . 1 1 29 29 ALA HA H 1 4.335 0.020 . 1 . . . A 29 ALA HA . 19085 1 285 . 1 1 29 29 ALA HB1 H 1 1.643 0.020 . 1 . . . A 29 ALA HB1 . 19085 1 286 . 1 1 29 29 ALA HB2 H 1 1.643 0.020 . 1 . . . A 29 ALA HB2 . 19085 1 287 . 1 1 29 29 ALA HB3 H 1 1.643 0.020 . 1 . . . A 29 ALA HB3 . 19085 1 288 . 1 1 29 29 ALA CA C 13 52.561 0.200 . 1 . . . A 29 ALA CA . 19085 1 289 . 1 1 29 29 ALA CB C 13 18.678 0.200 . 1 . . . A 29 ALA CB . 19085 1 290 . 1 1 29 29 ALA N N 15 120.397 0.200 . 1 . . . A 29 ALA N . 19085 1 291 . 1 1 30 30 GLY H H 1 7.793 0.020 . 1 . . . A 30 GLY H . 19085 1 292 . 1 1 30 30 GLY HA2 H 1 3.912 0.020 . 1 . . . A 30 GLY HA2 . 19085 1 293 . 1 1 30 30 GLY HA3 H 1 3.818 0.020 . 1 . . . A 30 GLY HA3 . 19085 1 294 . 1 1 30 30 GLY CA C 13 46.111 0.200 . 1 . . . A 30 GLY CA . 19085 1 295 . 1 1 30 30 GLY N N 15 106.021 0.200 . 1 . . . A 30 GLY N . 19085 1 296 . 1 1 31 31 VAL H H 1 6.611 0.020 . 1 . . . A 31 VAL H . 19085 1 297 . 1 1 31 31 VAL HA H 1 4.066 0.020 . 1 . . . A 31 VAL HA . 19085 1 298 . 1 1 31 31 VAL HB H 1 1.707 0.020 . 1 . . . A 31 VAL HB . 19085 1 299 . 1 1 31 31 VAL HG11 H 1 1.071 0.020 . 2 . . . A 31 VAL HG11 . 19085 1 300 . 1 1 31 31 VAL HG12 H 1 1.071 0.020 . 2 . . . A 31 VAL HG12 . 19085 1 301 . 1 1 31 31 VAL HG13 H 1 1.071 0.020 . 2 . . . A 31 VAL HG13 . 19085 1 302 . 1 1 31 31 VAL HG21 H 1 0.882 0.020 . 2 . . . A 31 VAL HG21 . 19085 1 303 . 1 1 31 31 VAL HG22 H 1 0.882 0.020 . 2 . . . A 31 VAL HG22 . 19085 1 304 . 1 1 31 31 VAL HG23 H 1 0.882 0.020 . 2 . . . A 31 VAL HG23 . 19085 1 305 . 1 1 31 31 VAL CA C 13 60.934 0.200 . 1 . . . A 31 VAL CA . 19085 1 306 . 1 1 31 31 VAL CG1 C 13 21.084 0.200 . 1 . . . A 31 VAL CG1 . 19085 1 307 . 1 1 31 31 VAL CG2 C 13 20.247 0.200 . 1 . . . A 31 VAL CG2 . 19085 1 308 . 1 1 31 31 VAL N N 15 116.550 0.200 . 1 . . . A 31 VAL N . 19085 1 309 . 1 1 32 32 GLY H H 1 8.551 0.020 . 1 . . . A 32 GLY H . 19085 1 310 . 1 1 32 32 GLY HA2 H 1 3.893 0.020 . 1 . . . A 32 GLY HA2 . 19085 1 311 . 1 1 32 32 GLY HA3 H 1 3.650 0.020 . 1 . . . A 32 GLY HA3 . 19085 1 312 . 1 1 32 32 GLY CA C 13 44.572 0.200 . 1 . . . A 32 GLY CA . 19085 1 313 . 1 1 32 32 GLY N N 15 110.423 0.200 . 1 . . . A 32 GLY N . 19085 1 314 . 1 1 33 33 LEU H H 1 8.613 0.020 . 1 . . . A 33 LEU H . 19085 1 315 . 1 1 33 33 LEU HA H 1 3.949 0.020 . 1 . . . A 33 LEU HA . 19085 1 316 . 1 1 33 33 LEU HB2 H 1 1.783 0.020 . 1 . . . A 33 LEU HB2 . 19085 1 317 . 1 1 33 33 LEU HB3 H 1 1.195 0.020 . 1 . . . A 33 LEU HB3 . 19085 1 318 . 1 1 33 33 LEU HG H 1 1.018 0.020 . 1 . . . A 33 LEU HG . 19085 1 319 . 1 1 33 33 LEU HD11 H 1 0.773 0.020 . 2 . . . A 33 LEU HD11 . 19085 1 320 . 1 1 33 33 LEU HD12 H 1 0.773 0.020 . 2 . . . A 33 LEU HD12 . 19085 1 321 . 1 1 33 33 LEU HD13 H 1 0.773 0.020 . 2 . . . A 33 LEU HD13 . 19085 1 322 . 1 1 33 33 LEU HD21 H 1 0.583 0.020 . 2 . . . A 33 LEU HD21 . 19085 1 323 . 1 1 33 33 LEU HD22 H 1 0.583 0.020 . 2 . . . A 33 LEU HD22 . 19085 1 324 . 1 1 33 33 LEU HD23 H 1 0.583 0.020 . 2 . . . A 33 LEU HD23 . 19085 1 325 . 1 1 33 33 LEU CA C 13 55.823 0.200 . 1 . . . A 33 LEU CA . 19085 1 326 . 1 1 33 33 LEU CB C 13 43.070 0.200 . 1 . . . A 33 LEU CB . 19085 1 327 . 1 1 33 33 LEU CG C 13 27.055 0.200 . 1 . . . A 33 LEU CG . 19085 1 328 . 1 1 33 33 LEU CD1 C 13 26.107 0.200 . 1 . . . A 33 LEU CD1 . 19085 1 329 . 1 1 33 33 LEU CD2 C 13 24.589 0.200 . 1 . . . A 33 LEU CD2 . 19085 1 330 . 1 1 33 33 LEU N N 15 124.291 0.200 . 1 . . . A 33 LEU N . 19085 1 331 . 1 1 34 34 ASP H H 1 9.091 0.020 . 1 . . . A 34 ASP H . 19085 1 332 . 1 1 34 34 ASP HA H 1 4.789 0.020 . 1 . . . A 34 ASP HA . 19085 1 333 . 1 1 34 34 ASP HB2 H 1 2.016 0.020 . 1 . . . A 34 ASP HB2 . 19085 1 334 . 1 1 34 34 ASP HB3 H 1 2.424 0.020 . 1 . . . A 34 ASP HB3 . 19085 1 335 . 1 1 34 34 ASP CB C 13 42.065 0.200 . 1 . . . A 34 ASP CB . 19085 1 336 . 1 1 34 34 ASP N N 15 126.710 0.200 . 1 . . . A 34 ASP N . 19085 1 337 . 1 1 35 35 HIS H H 1 7.302 0.020 . 1 . . . A 35 HIS H . 19085 1 338 . 1 1 35 35 HIS HA H 1 4.822 0.020 . 1 . . . A 35 HIS HA . 19085 1 339 . 1 1 35 35 HIS HB2 H 1 3.454 0.020 . 1 . . . A 35 HIS HB2 . 19085 1 340 . 1 1 35 35 HIS HB3 H 1 3.251 0.020 . 1 . . . A 35 HIS HB3 . 19085 1 341 . 1 1 35 35 HIS HD2 H 1 7.174 0.020 . 1 . . . A 35 HIS HD2 . 19085 1 342 . 1 1 35 35 HIS HE1 H 1 8.556 0.020 . 1 . . . A 35 HIS HE1 . 19085 1 343 . 1 1 35 35 HIS CB C 13 30.351 0.200 . 1 . . . A 35 HIS CB . 19085 1 344 . 1 1 35 35 HIS CD2 C 13 122.395 0.200 . 1 . . . A 35 HIS CD2 . 19085 1 345 . 1 1 35 35 HIS CE1 C 13 136.331 0.200 . 1 . . . A 35 HIS CE1 . 19085 1 346 . 1 1 35 35 HIS N N 15 106.163 0.200 . 1 . . . A 35 HIS N . 19085 1 347 . 1 1 36 36 GLU H H 1 9.309 0.020 . 1 . . . A 36 GLU H . 19085 1 348 . 1 1 36 36 GLU HA H 1 4.209 0.020 . 1 . . . A 36 GLU HA . 19085 1 349 . 1 1 36 36 GLU HB2 H 1 2.086 0.020 . 1 . . . A 36 GLU HB2 . 19085 1 350 . 1 1 36 36 GLU HB3 H 1 2.274 0.020 . 1 . . . A 36 GLU HB3 . 19085 1 351 . 1 1 36 36 GLU HG2 H 1 2.420 0.020 . 1 . . . A 36 GLU HG2 . 19085 1 352 . 1 1 36 36 GLU HG3 H 1 2.539 0.020 . 1 . . . A 36 GLU HG3 . 19085 1 353 . 1 1 36 36 GLU CA C 13 57.734 0.200 . 1 . . . A 36 GLU CA . 19085 1 354 . 1 1 36 36 GLU CB C 13 29.241 0.200 . 1 . . . A 36 GLU CB . 19085 1 355 . 1 1 36 36 GLU CG C 13 34.259 0.200 . 1 . . . A 36 GLU CG . 19085 1 356 . 1 1 36 36 GLU N N 15 120.636 0.200 . 1 . . . A 36 GLU N . 19085 1 357 . 1 1 37 37 GLY H H 1 8.153 0.020 . 1 . . . A 37 GLY H . 19085 1 358 . 1 1 37 37 GLY HA2 H 1 3.465 0.020 . 1 . . . A 37 GLY HA2 . 19085 1 359 . 1 1 37 37 GLY HA3 H 1 4.552 0.020 . 1 . . . A 37 GLY HA3 . 19085 1 360 . 1 1 37 37 GLY CA C 13 44.550 0.200 . 1 . . . A 37 GLY CA . 19085 1 361 . 1 1 37 37 GLY N N 15 115.205 0.200 . 1 . . . A 37 GLY N . 19085 1 362 . 1 1 38 38 GLU H H 1 8.099 0.020 . 1 . . . A 38 GLU H . 19085 1 363 . 1 1 38 38 GLU HA H 1 3.899 0.020 . 1 . . . A 38 GLU HA . 19085 1 364 . 1 1 38 38 GLU HB2 H 1 2.093 0.020 . 1 . . . A 38 GLU HB2 . 19085 1 365 . 1 1 38 38 GLU HB3 H 1 1.976 0.020 . 1 . . . A 38 GLU HB3 . 19085 1 366 . 1 1 38 38 GLU HG2 H 1 2.378 0.020 . 1 . . . A 38 GLU HG2 . 19085 1 367 . 1 1 38 38 GLU HG3 H 1 2.429 0.020 . 1 . . . A 38 GLU HG3 . 19085 1 368 . 1 1 38 38 GLU CA C 13 56.221 0.200 . 1 . . . A 38 GLU CA . 19085 1 369 . 1 1 38 38 GLU CB C 13 29.513 0.200 . 1 . . . A 38 GLU CB . 19085 1 370 . 1 1 38 38 GLU CG C 13 34.648 0.200 . 1 . . . A 38 GLU CG . 19085 1 371 . 1 1 38 38 GLU N N 15 112.146 0.200 . 1 . . . A 38 GLU N . 19085 1 372 . 1 1 39 39 CYS H H 1 8.370 0.020 . 1 . . . A 39 CYS H . 19085 1 373 . 1 1 39 39 CYS HA H 1 4.556 0.020 . 1 . . . A 39 CYS HA . 19085 1 374 . 1 1 39 39 CYS HB2 H 1 2.569 0.020 . 1 . . . A 39 CYS HB2 . 19085 1 375 . 1 1 39 39 CYS HB3 H 1 3.246 0.020 . 1 . . . A 39 CYS HB3 . 19085 1 376 . 1 1 39 39 CYS CB C 13 37.325 0.200 . 1 . . . A 39 CYS CB . 19085 1 377 . 1 1 39 39 CYS N N 15 119.239 0.200 . 1 . . . A 39 CYS N . 19085 1 378 . 1 1 40 40 LEU H H 1 8.439 0.020 . 1 . . . A 40 LEU H . 19085 1 379 . 1 1 40 40 LEU N N 15 127.841 0.200 . 1 . . . A 40 LEU N . 19085 1 stop_ save_