################################### # 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_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 30232 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _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 $chem_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 1 '2D 1H-13C HSQC' . . . 30232 1 2 '2D 1H-1H TOCSY' . . . 30232 1 3 '2D 1H-1H NOESY' . . . 30232 1 4 '2D 1H-1H COSY' . . . 30232 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_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.Ambiguity_set_ID _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 ASP H H 1 7.129 0.001 . . . . . . A 3 ASP H . 30232 1 2 . 1 . 1 3 3 ASP HA H 1 5.029 0.000 . . . . . . A 3 ASP HA . 30232 1 3 . 1 . 1 3 3 ASP HB2 H 1 2.850 0.001 . . . . . . A 3 ASP HB2 . 30232 1 4 . 1 . 1 3 3 ASP HB3 H 1 2.605 0.000 . . . . . . A 3 ASP HB3 . 30232 1 5 . 1 . 1 3 3 ASP CB C 13 40.241 0.000 . . . . . . A 3 ASP CB . 30232 1 6 . 1 . 1 4 4 PRO HA H 1 4.415 0.000 . . . . . . A 4 PRO HA . 30232 1 7 . 1 . 1 4 4 PRO HB2 H 1 2.242 0.003 . . . . . . A 4 PRO HB2 . 30232 1 8 . 1 . 1 4 4 PRO HB3 H 1 1.931 0.000 . . . . . . A 4 PRO HB3 . 30232 1 9 . 1 . 1 4 4 PRO HG2 H 1 2.016 0.000 . . . . . . A 4 PRO HG2 . 30232 1 10 . 1 . 1 4 4 PRO HG3 H 1 2.016 0.000 . . . . . . A 4 PRO HG3 . 30232 1 11 . 1 . 1 4 4 PRO HD2 H 1 3.885 0.005 . . . . . . A 4 PRO HD2 . 30232 1 12 . 1 . 1 4 4 PRO HD3 H 1 3.885 0.005 . . . . . . A 4 PRO HD3 . 30232 1 13 . 1 . 1 4 4 PRO CD C 13 48.287 0.000 . . . . . . A 4 PRO CD . 30232 1 14 . 1 . 1 5 5 VAL H H 1 7.491 0.000 . . . . . . A 5 VAL H . 30232 1 15 . 1 . 1 5 5 VAL HA H 1 3.872 0.002 . . . . . . A 5 VAL HA . 30232 1 16 . 1 . 1 5 5 VAL HB H 1 1.875 0.008 . . . . . . A 5 VAL HB . 30232 1 17 . 1 . 1 5 5 VAL HG11 H 1 0.619 0.001 . . . . . . A 5 VAL HG11 . 30232 1 18 . 1 . 1 5 5 VAL HG12 H 1 0.619 0.001 . . . . . . A 5 VAL HG12 . 30232 1 19 . 1 . 1 5 5 VAL HG13 H 1 0.619 0.001 . . . . . . A 5 VAL HG13 . 30232 1 20 . 1 . 1 5 5 VAL HG21 H 1 0.764 0.000 . . . . . . A 5 VAL HG21 . 30232 1 21 . 1 . 1 5 5 VAL HG22 H 1 0.764 0.000 . . . . . . A 5 VAL HG22 . 30232 1 22 . 1 . 1 5 5 VAL HG23 H 1 0.764 0.000 . . . . . . A 5 VAL HG23 . 30232 1 23 . 1 . 1 5 5 VAL CA C 13 60.731 0.000 . . . . . . A 5 VAL CA . 30232 1 24 . 1 . 1 5 5 VAL CB C 13 29.282 0.000 . . . . . . A 5 VAL CB . 30232 1 25 . 1 . 1 5 5 VAL CG1 C 13 18.215 0.012 . . . . . . A 5 VAL CG1 . 30232 1 26 . 1 . 1 5 5 VAL CG2 C 13 18.215 0.012 . . . . . . A 5 VAL CG2 . 30232 1 27 . 1 . 1 6 6 TYR H H 1 7.649 0.001 . . . . . . A 6 TYR H . 30232 1 28 . 1 . 1 6 6 TYR HA H 1 4.629 0.011 . . . . . . A 6 TYR HA . 30232 1 29 . 1 . 1 6 6 TYR HB2 H 1 2.713 0.001 . . . . . . A 6 TYR HB2 . 30232 1 30 . 1 . 1 6 6 TYR HB3 H 1 3.071 0.000 . . . . . . A 6 TYR HB3 . 30232 1 31 . 1 . 1 6 6 TYR HD1 H 1 7.052 0.000 . . . . . . A 6 TYR HD1 . 30232 1 32 . 1 . 1 6 6 TYR HD2 H 1 7.052 0.000 . . . . . . A 6 TYR HD2 . 30232 1 33 . 1 . 1 6 6 TYR HE1 H 1 6.821 0.000 . . . . . . A 6 TYR HE1 . 30232 1 34 . 1 . 1 6 6 TYR HE2 H 1 6.821 0.000 . . . . . . A 6 TYR HE2 . 30232 1 35 . 1 . 1 6 6 TYR CA C 13 55.803 0.000 . . . . . . A 6 TYR CA . 30232 1 36 . 1 . 1 6 6 TYR CB C 13 36.928 0.000 . . . . . . A 6 TYR CB . 30232 1 37 . 1 . 1 7 7 THR H H 1 8.200 0.000 . . . . . . A 7 THR H . 30232 1 38 . 1 . 1 7 7 THR HA H 1 4.411 0.002 . . . . . . A 7 THR HA . 30232 1 39 . 1 . 1 7 7 THR HB H 1 4.083 0.000 . . . . . . A 7 THR HB . 30232 1 40 . 1 . 1 7 7 THR HG21 H 1 1.162 0.002 . . . . . . A 7 THR HG21 . 30232 1 41 . 1 . 1 7 7 THR HG22 H 1 1.162 0.002 . . . . . . A 7 THR HG22 . 30232 1 42 . 1 . 1 7 7 THR HG23 H 1 1.162 0.002 . . . . . . A 7 THR HG23 . 30232 1 43 . 1 . 1 7 7 THR CA C 13 61.320 0.000 . . . . . . A 7 THR CA . 30232 1 44 . 1 . 1 7 7 THR CB C 13 67.688 0.000 . . . . . . A 7 THR CB . 30232 1 45 . 1 . 1 7 7 THR CG2 C 13 18.793 0.000 . . . . . . A 7 THR CG2 . 30232 1 46 . 1 . 1 8 8 CYS H H 1 8.352 0.000 . . . . . . A 8 CYS H . 30232 1 47 . 1 . 1 8 8 CYS HA H 1 5.075 0.000 . . . . . . A 8 CYS HA . 30232 1 48 . 1 . 1 8 8 CYS HB2 H 1 3.258 0.000 . . . . . . A 8 CYS HB2 . 30232 1 49 . 1 . 1 8 8 CYS HB3 H 1 2.618 0.000 . . . . . . A 8 CYS HB3 . 30232 1 50 . 1 . 1 9 9 ARG H H 1 8.492 0.001 . . . . . . A 9 ARG H . 30232 1 51 . 1 . 1 9 9 ARG HA H 1 4.531 0.003 . . . . . . A 9 ARG HA . 30232 1 52 . 1 . 1 9 9 ARG HB2 H 1 1.712 0.004 . . . . . . A 9 ARG HB2 . 30232 1 53 . 1 . 1 9 9 ARG HB3 H 1 1.895 0.000 . . . . . . A 9 ARG HB3 . 30232 1 54 . 1 . 1 9 9 ARG HG2 H 1 1.587 0.000 . . . . . . A 9 ARG HG2 . 30232 1 55 . 1 . 1 9 9 ARG HG3 H 1 1.587 0.000 . . . . . . A 9 ARG HG3 . 30232 1 56 . 1 . 1 9 9 ARG HD2 H 1 3.205 0.001 . . . . . . A 9 ARG HD2 . 30232 1 57 . 1 . 1 9 9 ARG HD3 H 1 3.205 0.001 . . . . . . A 9 ARG HD3 . 30232 1 58 . 1 . 1 9 9 ARG HE H 1 7.242 0.000 . . . . . . A 9 ARG HE . 30232 1 59 . 1 . 1 9 9 ARG CA C 13 52.324 0.000 . . . . . . A 9 ARG CA . 30232 1 60 . 1 . 1 9 9 ARG CG C 13 24.617 0.000 . . . . . . A 9 ARG CG . 30232 1 61 . 1 . 1 10 10 PRO HA H 1 4.359 0.001 . . . . . . A 10 PRO HA . 30232 1 62 . 1 . 1 10 10 PRO HB2 H 1 2.340 0.001 . . . . . . A 10 PRO HB2 . 30232 1 63 . 1 . 1 10 10 PRO HB3 H 1 1.875 0.002 . . . . . . A 10 PRO HB3 . 30232 1 64 . 1 . 1 10 10 PRO HG2 H 1 2.157 0.001 . . . . . . A 10 PRO HG2 . 30232 1 65 . 1 . 1 10 10 PRO HG3 H 1 2.035 0.003 . . . . . . A 10 PRO HG3 . 30232 1 66 . 1 . 1 10 10 PRO HD2 H 1 3.587 0.000 . . . . . . A 10 PRO HD2 . 30232 1 67 . 1 . 1 10 10 PRO HD3 H 1 3.884 0.003 . . . . . . A 10 PRO HD3 . 30232 1 68 . 1 . 1 10 10 PRO CA C 13 61.823 0.000 . . . . . . A 10 PRO CA . 30232 1 69 . 1 . 1 10 10 PRO CD C 13 47.880 0.005 . . . . . . A 10 PRO CD . 30232 1 70 . 1 . 1 11 11 GLY H H 1 8.897 0.000 . . . . . . A 11 GLY H . 30232 1 71 . 1 . 1 11 11 GLY HA2 H 1 4.320 0.001 . . . . . . A 11 GLY HA2 . 30232 1 72 . 1 . 1 11 11 GLY HA3 H 1 3.683 0.001 . . . . . . A 11 GLY HA3 . 30232 1 73 . 1 . 1 11 11 GLY CA C 13 42.316 0.000 . . . . . . A 11 GLY CA . 30232 1 74 . 1 . 1 12 12 GLN H H 1 8.093 0.001 . . . . . . A 12 GLN H . 30232 1 75 . 1 . 1 12 12 GLN HA H 1 4.813 0.000 . . . . . . A 12 GLN HA . 30232 1 76 . 1 . 1 12 12 GLN HB2 H 1 2.338 0.006 . . . . . . A 12 GLN HB2 . 30232 1 77 . 1 . 1 12 12 GLN HB3 H 1 2.262 0.003 . . . . . . A 12 GLN HB3 . 30232 1 78 . 1 . 1 12 12 GLN HG2 H 1 2.852 0.000 . . . . . . A 12 GLN HG2 . 30232 1 79 . 1 . 1 12 12 GLN HG3 H 1 3.039 0.000 . . . . . . A 12 GLN HG3 . 30232 1 80 . 1 . 1 12 12 GLN HE21 H 1 7.682 0.000 . . . . . . A 12 GLN HE21 . 30232 1 81 . 1 . 1 12 12 GLN HE22 H 1 6.747 0.000 . . . . . . A 12 GLN HE22 . 30232 1 82 . 1 . 1 12 12 GLN CB C 13 29.091 0.000 . . . . . . A 12 GLN CB . 30232 1 83 . 1 . 1 12 12 GLN CG C 13 31.765 0.000 . . . . . . A 12 GLN CG . 30232 1 84 . 1 . 1 13 13 THR H H 1 8.977 0.001 . . . . . . A 13 THR H . 30232 1 85 . 1 . 1 13 13 THR HA H 1 4.589 0.002 . . . . . . A 13 THR HA . 30232 1 86 . 1 . 1 13 13 THR HB H 1 4.054 0.001 . . . . . . A 13 THR HB . 30232 1 87 . 1 . 1 13 13 THR HG21 H 1 1.225 0.002 . . . . . . A 13 THR HG21 . 30232 1 88 . 1 . 1 13 13 THR HG22 H 1 1.225 0.002 . . . . . . A 13 THR HG22 . 30232 1 89 . 1 . 1 13 13 THR HG23 H 1 1.225 0.002 . . . . . . A 13 THR HG23 . 30232 1 90 . 1 . 1 13 13 THR CA C 13 57.738 0.000 . . . . . . A 13 THR CA . 30232 1 91 . 1 . 1 13 13 THR CB C 13 68.201 0.000 . . . . . . A 13 THR CB . 30232 1 92 . 1 . 1 13 13 THR CG2 C 13 18.733 0.000 . . . . . . A 13 THR CG2 . 30232 1 93 . 1 . 1 14 14 CYS H H 1 8.879 0.000 . . . . . . A 14 CYS H . 30232 1 94 . 1 . 1 14 14 CYS HA H 1 5.234 0.002 . . . . . . A 14 CYS HA . 30232 1 95 . 1 . 1 14 14 CYS HB2 H 1 3.337 0.000 . . . . . . A 14 CYS HB2 . 30232 1 96 . 1 . 1 14 14 CYS HB3 H 1 3.172 0.000 . . . . . . A 14 CYS HB3 . 30232 1 97 . 1 . 1 14 14 CYS CA C 13 53.952 0.000 . . . . . . A 14 CYS CA . 30232 1 98 . 1 . 1 15 15 CYS H H 1 8.897 0.000 . . . . . . A 15 CYS H . 30232 1 99 . 1 . 1 15 15 CYS HA H 1 5.014 0.000 . . . . . . A 15 CYS HA . 30232 1 100 . 1 . 1 15 15 CYS HB2 H 1 3.086 0.000 . . . . . . A 15 CYS HB2 . 30232 1 101 . 1 . 1 15 15 CYS HB3 H 1 3.210 0.000 . . . . . . A 15 CYS HB3 . 30232 1 102 . 1 . 1 16 16 ARG H H 1 8.905 0.001 . . . . . . A 16 ARG H . 30232 1 103 . 1 . 1 16 16 ARG HA H 1 3.961 0.000 . . . . . . A 16 ARG HA . 30232 1 104 . 1 . 1 16 16 ARG HB2 H 1 1.488 0.002 . . . . . . A 16 ARG HB2 . 30232 1 105 . 1 . 1 16 16 ARG HB3 H 1 1.719 0.000 . . . . . . A 16 ARG HB3 . 30232 1 106 . 1 . 1 16 16 ARG HG2 H 1 1.211 0.004 . . . . . . A 16 ARG HG2 . 30232 1 107 . 1 . 1 16 16 ARG HG3 H 1 1.404 0.001 . . . . . . A 16 ARG HG3 . 30232 1 108 . 1 . 1 16 16 ARG HD2 H 1 2.977 0.002 . . . . . . A 16 ARG HD2 . 30232 1 109 . 1 . 1 16 16 ARG HD3 H 1 2.977 0.002 . . . . . . A 16 ARG HD3 . 30232 1 110 . 1 . 1 16 16 ARG CG C 13 24.586 0.037 . . . . . . A 16 ARG CG . 30232 1 111 . 1 . 1 16 16 ARG CD C 13 40.634 0.000 . . . . . . A 16 ARG CD . 30232 1 112 . 1 . 1 17 17 GLY H H 1 8.008 0.001 . . . . . . A 17 GLY H . 30232 1 113 . 1 . 1 17 17 GLY HA2 H 1 4.363 0.003 . . . . . . A 17 GLY HA2 . 30232 1 114 . 1 . 1 17 17 GLY HA3 H 1 3.763 0.001 . . . . . . A 17 GLY HA3 . 30232 1 115 . 1 . 1 17 17 GLY CA C 13 41.815 0.004 . . . . . . A 17 GLY CA . 30232 1 116 . 1 . 1 18 18 LEU H H 1 8.083 0.001 . . . . . . A 18 LEU H . 30232 1 117 . 1 . 1 18 18 LEU HA H 1 3.981 0.004 . . . . . . A 18 LEU HA . 30232 1 118 . 1 . 1 18 18 LEU HG H 1 1.930 0.000 . . . . . . A 18 LEU HG . 30232 1 119 . 1 . 1 18 18 LEU HD11 H 1 0.849 0.000 . . . . . . A 18 LEU HD11 . 30232 1 120 . 1 . 1 18 18 LEU HD12 H 1 0.849 0.000 . . . . . . A 18 LEU HD12 . 30232 1 121 . 1 . 1 18 18 LEU HD13 H 1 0.849 0.000 . . . . . . A 18 LEU HD13 . 30232 1 122 . 1 . 1 18 18 LEU HD21 H 1 0.849 0.000 . . . . . . A 18 LEU HD21 . 30232 1 123 . 1 . 1 18 18 LEU HD22 H 1 0.849 0.000 . . . . . . A 18 LEU HD22 . 30232 1 124 . 1 . 1 18 18 LEU HD23 H 1 0.849 0.000 . . . . . . A 18 LEU HD23 . 30232 1 125 . 1 . 1 18 18 LEU CA C 13 54.614 0.000 . . . . . . A 18 LEU CA . 30232 1 126 . 1 . 1 18 18 LEU CD1 C 13 21.776 0.000 . . . . . . A 18 LEU CD1 . 30232 1 127 . 1 . 1 18 18 LEU CD2 C 13 21.776 0.000 . . . . . . A 18 LEU CD2 . 30232 1 128 . 1 . 1 19 19 HIS H H 1 8.649 0.001 . . . . . . A 19 HIS H . 30232 1 129 . 1 . 1 19 19 HIS HA H 1 4.873 0.000 . . . . . . A 19 HIS HA . 30232 1 130 . 1 . 1 19 19 HIS HB2 H 1 3.042 0.000 . . . . . . A 19 HIS HB2 . 30232 1 131 . 1 . 1 19 19 HIS HB3 H 1 3.421 0.000 . . . . . . A 19 HIS HB3 . 30232 1 132 . 1 . 1 19 19 HIS HD2 H 1 7.301 0.000 . . . . . . A 19 HIS HD2 . 30232 1 133 . 1 . 1 19 19 HIS HE1 H 1 8.631 0.000 . . . . . . A 19 HIS HE1 . 30232 1 134 . 1 . 1 19 19 HIS CB C 13 25.822 0.005 . . . . . . A 19 HIS CB . 30232 1 135 . 1 . 1 20 20 GLY H H 1 7.607 0.000 . . . . . . A 20 GLY H . 30232 1 136 . 1 . 1 20 20 GLY HA2 H 1 3.647 0.000 . . . . . . A 20 GLY HA2 . 30232 1 137 . 1 . 1 20 20 GLY HA3 H 1 4.271 0.001 . . . . . . A 20 GLY HA3 . 30232 1 138 . 1 . 1 20 20 GLY CA C 13 42.268 0.000 . . . . . . A 20 GLY CA . 30232 1 139 . 1 . 1 21 21 TYR H H 1 8.141 0.001 . . . . . . A 21 TYR H . 30232 1 140 . 1 . 1 21 21 TYR HA H 1 4.627 0.000 . . . . . . A 21 TYR HA . 30232 1 141 . 1 . 1 21 21 TYR HB2 H 1 2.766 0.000 . . . . . . A 21 TYR HB2 . 30232 1 142 . 1 . 1 21 21 TYR HB3 H 1 2.567 0.000 . . . . . . A 21 TYR HB3 . 30232 1 143 . 1 . 1 21 21 TYR HD1 H 1 6.950 0.000 . . . . . . A 21 TYR HD1 . 30232 1 144 . 1 . 1 21 21 TYR HD2 H 1 6.950 0.000 . . . . . . A 21 TYR HD2 . 30232 1 145 . 1 . 1 21 21 TYR HE1 H 1 6.799 0.000 . . . . . . A 21 TYR HE1 . 30232 1 146 . 1 . 1 21 21 TYR HE2 H 1 6.799 0.000 . . . . . . A 21 TYR HE2 . 30232 1 147 . 1 . 1 22 22 GLY H H 1 8.295 0.001 . . . . . . A 22 GLY H . 30232 1 148 . 1 . 1 22 22 GLY HA2 H 1 4.134 0.001 . . . . . . A 22 GLY HA2 . 30232 1 149 . 1 . 1 22 22 GLY HA3 H 1 3.798 0.000 . . . . . . A 22 GLY HA3 . 30232 1 150 . 1 . 1 22 22 GLY CA C 13 42.294 0.013 . . . . . . A 22 GLY CA . 30232 1 151 . 1 . 1 23 23 CYS H H 1 8.541 0.001 . . . . . . A 23 CYS H . 30232 1 152 . 1 . 1 23 23 CYS HA H 1 5.353 0.004 . . . . . . A 23 CYS HA . 30232 1 153 . 1 . 1 23 23 CYS HB2 H 1 2.847 0.000 . . . . . . A 23 CYS HB2 . 30232 1 154 . 1 . 1 23 23 CYS HB3 H 1 2.779 0.000 . . . . . . A 23 CYS HB3 . 30232 1 155 . 1 . 1 23 23 CYS CA C 13 52.179 0.000 . . . . . . A 23 CYS CA . 30232 1 156 . 1 . 1 24 24 CYS H H 1 9.446 0.000 . . . . . . A 24 CYS H . 30232 1 157 . 1 . 1 24 24 CYS HA H 1 4.757 0.000 . . . . . . A 24 CYS HA . 30232 1 158 . 1 . 1 24 24 CYS HB2 H 1 3.048 0.000 . . . . . . A 24 CYS HB2 . 30232 1 159 . 1 . 1 24 24 CYS HB3 H 1 3.048 0.000 . . . . . . A 24 CYS HB3 . 30232 1 stop_ save_