################################### # 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 15221 _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 1 '2D 1H-1H TOCSY' . . . 15221 1 2 '2D 1H-1H NOESY' . . . 15221 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 GLY HA2 H 1 3.857 0.02 . 2 . . . . 1 GLY HA1 . 15221 1 2 . 1 1 1 1 GLY HA3 H 1 4.196 0.02 . 2 . . . . 1 GLY HA2 . 15221 1 3 . 1 1 2 2 SER H H 1 8.842 0.02 . 1 . . . . 2 SER HN . 15221 1 4 . 1 1 2 2 SER HA H 1 4.655 0.02 . 1 . . . . 2 SER HA . 15221 1 5 . 1 1 2 2 SER HB2 H 1 3.945 0.02 . 2 . . . . 2 SER HB2 . 15221 1 6 . 1 1 3 3 THR H H 1 8.441 0.02 . 1 . . . . 3 THR HN . 15221 1 7 . 1 1 3 3 THR HA H 1 4.490 0.02 . 1 . . . . 3 THR HA . 15221 1 8 . 1 1 3 3 THR HB H 1 4.158 0.02 . 1 . . . . 3 THR HB . 15221 1 9 . 1 1 3 3 THR HG21 H 1 1.178 0.02 . 1 . . . . 3 THR HG2 . 15221 1 10 . 1 1 3 3 THR HG22 H 1 1.178 0.02 . 1 . . . . 3 THR HG2 . 15221 1 11 . 1 1 3 3 THR HG23 H 1 1.178 0.02 . 1 . . . . 3 THR HG2 . 15221 1 12 . 1 1 4 4 GLY H H 1 8.560 0.02 . 1 . . . . 4 GLY HN . 15221 1 13 . 1 1 4 4 GLY HA2 H 1 3.992 0.02 . 2 . . . . 4 GLY HA2 . 15221 1 14 . 1 1 5 5 PRO HA H 1 4.476 0.02 . 1 . . . . 5 PRO HA . 15221 1 15 . 1 1 5 5 PRO HB2 H 1 2.057 0.02 . 2 . . . . 5 PRO HB1 . 15221 1 16 . 1 1 5 5 PRO HB3 H 1 2.326 0.02 . 2 . . . . 5 PRO HB2 . 15221 1 17 . 1 1 5 5 PRO HG2 H 1 1.974 0.02 . 2 . . . . 5 PRO HG2 . 15221 1 18 . 1 1 5 5 PRO HD2 H 1 3.678 0.02 . 2 . . . . 5 PRO HD2 . 15221 1 19 . 1 1 6 6 GLN H H 1 8.724 0.02 . 1 . . . . 6 GLN HN . 15221 1 20 . 1 1 6 6 GLN HA H 1 4.465 0.02 . 1 . . . . 6 GLN HA . 15221 1 21 . 1 1 6 6 GLN HB2 H 1 2.040 0.02 . 2 . . . . 6 GLN HB1 . 15221 1 22 . 1 1 6 6 GLN HB3 H 1 2.193 0.02 . 2 . . . . 6 GLN HB2 . 15221 1 23 . 1 1 6 6 GLN HG2 H 1 2.443 0.02 . 2 . . . . 6 GLN HG1 . 15221 1 24 . 1 1 6 6 GLN HG3 H 1 2.588 0.02 . 2 . . . . 6 GLN HG2 . 15221 1 25 . 1 1 6 6 GLN HE21 H 1 6.933 0.02 . 2 . . . . 6 GLN HE21 . 15221 1 26 . 1 1 6 6 GLN HE22 H 1 7.583 0.02 . 2 . . . . 6 GLN HE22 . 15221 1 27 . 1 1 7 7 THR H H 1 8.379 0.02 . 1 . . . . 7 THR HN . 15221 1 28 . 1 1 7 7 THR HA H 1 4.462 0.02 . 1 . . . . 7 THR HA . 15221 1 29 . 1 1 7 7 THR HB H 1 4.278 0.02 . 1 . . . . 7 THR HB . 15221 1 30 . 1 1 7 7 THR HG21 H 1 1.229 0.02 . 1 . . . . 7 THR HG2 . 15221 1 31 . 1 1 7 7 THR HG22 H 1 1.229 0.02 . 1 . . . . 7 THR HG2 . 15221 1 32 . 1 1 7 7 THR HG23 H 1 1.229 0.02 . 1 . . . . 7 THR HG2 . 15221 1 33 . 1 1 8 8 THR H H 1 8.080 0.02 . 1 . . . . 8 THR HN . 15221 1 34 . 1 1 8 8 THR HA H 1 4.294 0.02 . 1 . . . . 8 THR HA . 15221 1 35 . 1 1 8 8 THR HB H 1 4.099 0.02 . 1 . . . . 8 THR HB . 15221 1 36 . 1 1 8 8 THR HG21 H 1 1.248 0.02 . 1 . . . . 8 THR HG2 . 15221 1 37 . 1 1 8 8 THR HG22 H 1 1.248 0.02 . 1 . . . . 8 THR HG2 . 15221 1 38 . 1 1 8 8 THR HG23 H 1 1.248 0.02 . 1 . . . . 8 THR HG2 . 15221 1 39 . 1 1 9 9 CYS H H 1 8.958 0.02 . 1 . . . . 9 CYS HN . 15221 1 40 . 1 1 9 9 CYS HA H 1 4.307 0.02 . 1 . . . . 9 CYS HA . 15221 1 41 . 1 1 9 9 CYS HB2 H 1 2.664 0.02 . 2 . . . . 9 CYS HB1 . 15221 1 42 . 1 1 9 9 CYS HB3 H 1 2.819 0.02 . 2 . . . . 9 CYS HB2 . 15221 1 43 . 1 1 10 10 GLN H H 1 8.785 0.02 . 1 . . . . 10 GLN HN . 15221 1 44 . 1 1 10 10 GLN HA H 1 4.641 0.02 . 1 . . . . 10 GLN HA . 15221 1 45 . 1 1 10 10 GLN HB2 H 1 2.011 0.02 . 2 . . . . 10 GLN HB1 . 15221 1 46 . 1 1 10 10 GLN HB3 H 1 2.274 0.02 . 2 . . . . 10 GLN HB2 . 15221 1 47 . 1 1 10 10 GLN HG2 H 1 2.432 0.02 . 2 . . . . 10 GLN HG1 . 15221 1 48 . 1 1 10 10 GLN HG3 H 1 2.508 0.02 . 2 . . . . 10 GLN HG2 . 15221 1 49 . 1 1 10 10 GLN HE21 H 1 6.955 0.02 . 2 . . . . 10 GLN HE21 . 15221 1 50 . 1 1 10 10 GLN HE22 H 1 7.529 0.02 . 2 . . . . 10 GLN HE22 . 15221 1 51 . 1 1 11 11 ALA H H 1 8.944 0.02 . 1 . . . . 11 ALA HN . 15221 1 52 . 1 1 11 11 ALA HA H 1 4.199 0.02 . 1 . . . . 11 ALA HA . 15221 1 53 . 1 1 11 11 ALA HB1 H 1 1.492 0.02 . 1 . . . . 11 ALA HB . 15221 1 54 . 1 1 11 11 ALA HB2 H 1 1.492 0.02 . 1 . . . . 11 ALA HB . 15221 1 55 . 1 1 11 11 ALA HB3 H 1 1.492 0.02 . 1 . . . . 11 ALA HB . 15221 1 56 . 1 1 12 12 ALA H H 1 8.409 0.02 . 1 . . . . 12 ALA HN . 15221 1 57 . 1 1 12 12 ALA HA H 1 4.176 0.02 . 1 . . . . 12 ALA HA . 15221 1 58 . 1 1 12 12 ALA HB1 H 1 1.467 0.02 . 1 . . . . 12 ALA HB . 15221 1 59 . 1 1 12 12 ALA HB2 H 1 1.467 0.02 . 1 . . . . 12 ALA HB . 15221 1 60 . 1 1 12 12 ALA HB3 H 1 1.467 0.02 . 1 . . . . 12 ALA HB . 15221 1 61 . 1 1 13 13 MET H H 1 7.394 0.02 . 1 . . . . 13 MET HN . 15221 1 62 . 1 1 13 13 MET HA H 1 4.404 0.02 . 1 . . . . 13 MET HA . 15221 1 63 . 1 1 13 13 MET HB2 H 1 2.276 0.02 . 2 . . . . 13 MET HB2 . 15221 1 64 . 1 1 13 13 MET HG2 H 1 2.635 0.02 . 2 . . . . 13 MET HG1 . 15221 1 65 . 1 1 13 13 MET HG3 H 1 2.773 0.02 . 2 . . . . 13 MET HG2 . 15221 1 66 . 1 1 14 14 CYS H H 1 8.659 0.02 . 1 . . . . 14 CYS HN . 15221 1 67 . 1 1 14 14 CYS HA H 1 4.763 0.02 . 1 . . . . 14 CYS HA . 15221 1 68 . 1 1 14 14 CYS HB2 H 1 3.121 0.02 . 2 . . . . 14 CYS HB1 . 15221 1 69 . 1 1 14 14 CYS HB3 H 1 3.446 0.02 . 2 . . . . 14 CYS HB2 . 15221 1 70 . 1 1 15 15 GLU H H 1 9.019 0.02 . 1 . . . . 15 GLU HN . 15221 1 71 . 1 1 15 15 GLU HA H 1 3.890 0.02 . 1 . . . . 15 GLU HA . 15221 1 72 . 1 1 15 15 GLU HB2 H 1 2.090 0.02 . 2 . . . . 15 GLU HB2 . 15221 1 73 . 1 1 15 15 GLU HG2 H 1 2.284 0.02 . 2 . . . . 15 GLU HG1 . 15221 1 74 . 1 1 15 15 GLU HG3 H 1 2.533 0.02 . 2 . . . . 15 GLU HG2 . 15221 1 75 . 1 1 16 16 ALA H H 1 7.747 0.02 . 1 . . . . 16 ALA HN . 15221 1 76 . 1 1 16 16 ALA HA H 1 4.195 0.02 . 1 . . . . 16 ALA HA . 15221 1 77 . 1 1 16 16 ALA HB1 H 1 1.570 0.02 . 1 . . . . 16 ALA HB . 15221 1 78 . 1 1 16 16 ALA HB2 H 1 1.570 0.02 . 1 . . . . 16 ALA HB . 15221 1 79 . 1 1 16 16 ALA HB3 H 1 1.570 0.02 . 1 . . . . 16 ALA HB . 15221 1 80 . 1 1 17 17 GLY H H 1 8.519 0.02 . 1 . . . . 17 GLY HN . 15221 1 81 . 1 1 17 17 GLY HA2 H 1 3.890 0.02 . 2 . . . . 17 GLY HA1 . 15221 1 82 . 1 1 17 17 GLY HA3 H 1 4.148 0.02 . 2 . . . . 17 GLY HA2 . 15221 1 83 . 1 1 18 18 CYS H H 1 8.762 0.02 . 1 . . . . 18 CYS HN . 15221 1 84 . 1 1 18 18 CYS HA H 1 4.513 0.02 . 1 . . . . 18 CYS HA . 15221 1 85 . 1 1 19 19 LYS H H 1 8.762 0.02 . 1 . . . . 19 LYS HN . 15221 1 86 . 1 1 19 19 LYS HA H 1 4.385 0.02 . 1 . . . . 19 LYS HA . 15221 1 87 . 1 1 19 19 LYS HB2 H 1 1.753 0.02 . 2 . . . . 19 LYS HB1 . 15221 1 88 . 1 1 19 19 LYS HB3 H 1 1.975 0.02 . 2 . . . . 19 LYS HB2 . 15221 1 89 . 1 1 19 19 LYS HG2 H 1 1.282 0.02 . 2 . . . . 19 LYS HG2 . 15221 1 90 . 1 1 19 19 LYS HD2 H 1 1.521 0.02 . 2 . . . . 19 LYS HD1 . 15221 1 91 . 1 1 19 19 LYS HD3 H 1 1.638 0.02 . 2 . . . . 19 LYS HD2 . 15221 1 92 . 1 1 19 19 LYS HE2 H 1 3.270 0.02 . 2 . . . . 19 LYS HE2 . 15221 1 93 . 1 1 19 19 LYS HZ1 H 1 7.606 0.02 . 1 . . . . 19 LYS HZ . 15221 1 94 . 1 1 19 19 LYS HZ2 H 1 7.606 0.02 . 1 . . . . 19 LYS HZ . 15221 1 95 . 1 1 19 19 LYS HZ3 H 1 7.606 0.02 . 1 . . . . 19 LYS HZ . 15221 1 96 . 1 1 20 20 GLY H H 1 8.153 0.02 . 1 . . . . 20 GLY HN . 15221 1 97 . 1 1 20 20 GLY HA2 H 1 4.071 0.02 . 2 . . . . 20 GLY HA2 . 15221 1 98 . 1 1 21 21 LEU H H 1 7.393 0.02 . 1 . . . . 21 LEU HN . 15221 1 99 . 1 1 21 21 LEU HA H 1 4.593 0.02 . 1 . . . . 21 LEU HA . 15221 1 100 . 1 1 21 21 LEU HB2 H 1 1.886 0.02 . 2 . . . . 21 LEU HB1 . 15221 1 101 . 1 1 21 21 LEU HB3 H 1 1.959 0.02 . 2 . . . . 21 LEU HB2 . 15221 1 102 . 1 1 21 21 LEU HG H 1 1.776 0.02 . 1 . . . . 21 LEU HG . 15221 1 103 . 1 1 21 21 LEU HD11 H 1 0.924 0.02 . 2 . . . . 21 LEU HD1 . 15221 1 104 . 1 1 21 21 LEU HD12 H 1 0.924 0.02 . 2 . . . . 21 LEU HD1 . 15221 1 105 . 1 1 21 21 LEU HD13 H 1 0.924 0.02 . 2 . . . . 21 LEU HD1 . 15221 1 106 . 1 1 21 21 LEU HD21 H 1 0.971 0.02 . 2 . . . . 21 LEU HD2 . 15221 1 107 . 1 1 21 21 LEU HD22 H 1 0.971 0.02 . 2 . . . . 21 LEU HD2 . 15221 1 108 . 1 1 21 21 LEU HD23 H 1 0.971 0.02 . 2 . . . . 21 LEU HD2 . 15221 1 109 . 1 1 22 22 GLY H H 1 8.278 0.02 . 1 . . . . 22 GLY HN . 15221 1 110 . 1 1 22 22 GLY HA2 H 1 3.945 0.02 . 2 . . . . 22 GLY HA1 . 15221 1 111 . 1 1 22 22 GLY HA3 H 1 4.205 0.02 . 2 . . . . 22 GLY HA2 . 15221 1 112 . 1 1 23 23 LYS H H 1 8.072 0.02 . 1 . . . . 23 LYS HN . 15221 1 113 . 1 1 23 23 LYS HA H 1 4.833 0.02 . 1 . . . . 23 LYS HA . 15221 1 114 . 1 1 23 23 LYS HB2 H 1 2.246 0.02 . 2 . . . . 23 LYS HB2 . 15221 1 115 . 1 1 23 23 LYS HG2 H 1 1.360 0.02 . 2 . . . . 23 LYS HG2 . 15221 1 116 . 1 1 23 23 LYS HD2 H 1 1.545 0.02 . 2 . . . . 23 LYS HD1 . 15221 1 117 . 1 1 23 23 LYS HD3 H 1 1.576 0.02 . 2 . . . . 23 LYS HD2 . 15221 1 118 . 1 1 23 23 LYS HE2 H 1 2.947 0.02 . 2 . . . . 23 LYS HE1 . 15221 1 119 . 1 1 23 23 LYS HE3 H 1 2.995 0.02 . 2 . . . . 23 LYS HE2 . 15221 1 120 . 1 1 23 23 LYS HZ1 H 1 7.717 0.02 . 1 . . . . 23 LYS HZ . 15221 1 121 . 1 1 23 23 LYS HZ2 H 1 7.717 0.02 . 1 . . . . 23 LYS HZ . 15221 1 122 . 1 1 23 23 LYS HZ3 H 1 7.717 0.02 . 1 . . . . 23 LYS HZ . 15221 1 123 . 1 1 24 24 SER H H 1 8.352 0.02 . 1 . . . . 24 SER HN . 15221 1 124 . 1 1 24 24 SER HA H 1 4.741 0.02 . 1 . . . . 24 SER HA . 15221 1 125 . 1 1 24 24 SER HB2 H 1 3.781 0.02 . 2 . . . . 24 SER HB1 . 15221 1 126 . 1 1 24 24 SER HB3 H 1 3.914 0.02 . 2 . . . . 24 SER HB2 . 15221 1 127 . 1 1 25 25 MET H H 1 9.179 0.02 . 1 . . . . 25 MET HN . 15221 1 128 . 1 1 25 25 MET HA H 1 4.652 0.02 . 1 . . . . 25 MET HA . 15221 1 129 . 1 1 25 25 MET HB2 H 1 1.622 0.02 . 2 . . . . 25 MET HB1 . 15221 1 130 . 1 1 25 25 MET HB3 H 1 1.962 0.02 . 2 . . . . 25 MET HB2 . 15221 1 131 . 1 1 25 25 MET HG2 H 1 2.246 0.02 . 2 . . . . 25 MET HG1 . 15221 1 132 . 1 1 25 25 MET HG3 H 1 2.610 0.02 . 2 . . . . 25 MET HG2 . 15221 1 133 . 1 1 26 26 GLU H H 1 9.752 0.02 . 1 . . . . 26 GLU HN . 15221 1 134 . 1 1 26 26 GLU HA H 1 4.440 0.02 . 1 . . . . 26 GLU HA . 15221 1 135 . 1 1 26 26 GLU HB2 H 1 1.738 0.02 . 2 . . . . 26 GLU HB2 . 15221 1 136 . 1 1 26 26 GLU HG2 H 1 2.200 0.02 . 2 . . . . 26 GLU HG2 . 15221 1 137 . 1 1 27 27 SER H H 1 8.106 0.02 . 1 . . . . 27 SER HN . 15221 1 138 . 1 1 27 27 SER HA H 1 4.542 0.02 . 1 . . . . 27 SER HA . 15221 1 139 . 1 1 27 27 SER HB2 H 1 3.837 0.02 . 2 . . . . 27 SER HB1 . 15221 1 140 . 1 1 27 27 SER HB3 H 1 3.937 0.02 . 2 . . . . 27 SER HB2 . 15221 1 141 . 1 1 28 28 CYS H H 1 8.974 0.02 . 1 . . . . 28 CYS HN . 15221 1 142 . 1 1 28 28 CYS HA H 1 5.586 0.02 . 1 . . . . 28 CYS HA . 15221 1 143 . 1 1 28 28 CYS HB2 H 1 2.899 0.02 . 2 . . . . 28 CYS HB1 . 15221 1 144 . 1 1 28 28 CYS HB3 H 1 3.424 0.02 . 2 . . . . 28 CYS HB2 . 15221 1 145 . 1 1 29 29 GLN H H 1 8.393 0.02 . 1 . . . . 29 GLN HN . 15221 1 146 . 1 1 29 29 GLN HA H 1 4.713 0.02 . 1 . . . . 29 GLN HA . 15221 1 147 . 1 1 29 29 GLN HB2 H 1 2.060 0.02 . 2 . . . . 29 GLN HB1 . 15221 1 148 . 1 1 29 29 GLN HB3 H 1 2.167 0.02 . 2 . . . . 29 GLN HB2 . 15221 1 149 . 1 1 29 29 GLN HG2 H 1 2.413 0.02 . 2 . . . . 29 GLN HG2 . 15221 1 150 . 1 1 29 29 GLN HE21 H 1 6.979 0.02 . 2 . . . . 29 GLN HE21 . 15221 1 151 . 1 1 29 29 GLN HE22 H 1 7.591 0.02 . 2 . . . . 29 GLN HE22 . 15221 1 152 . 1 1 30 30 GLY H H 1 9.213 0.02 . 1 . . . . 30 GLY HN . 15221 1 153 . 1 1 30 30 GLY HA2 H 1 3.814 0.02 . 2 . . . . 30 GLY HA1 . 15221 1 154 . 1 1 30 30 GLY HA3 H 1 4.020 0.02 . 2 . . . . 30 GLY HA2 . 15221 1 155 . 1 1 31 31 ASP H H 1 8.856 0.02 . 1 . . . . 31 ASP HN . 15221 1 156 . 1 1 31 31 ASP HA H 1 4.654 0.02 . 1 . . . . 31 ASP HA . 15221 1 157 . 1 1 31 31 ASP HB2 H 1 2.866 0.02 . 2 . . . . 31 ASP HB1 . 15221 1 158 . 1 1 31 31 ASP HB3 H 1 2.864 0.02 . 2 . . . . 31 ASP HB2 . 15221 1 159 . 1 1 32 32 THR H H 1 8.419 0.02 . 1 . . . . 32 THR HN . 15221 1 160 . 1 1 32 32 THR HA H 1 4.501 0.02 . 1 . . . . 32 THR HA . 15221 1 161 . 1 1 32 32 THR HB H 1 4.339 0.02 . 1 . . . . 32 THR HB . 15221 1 162 . 1 1 32 32 THR HG21 H 1 1.258 0.02 . 1 . . . . 32 THR HG2 . 15221 1 163 . 1 1 32 32 THR HG22 H 1 1.258 0.02 . 1 . . . . 32 THR HG2 . 15221 1 164 . 1 1 32 32 THR HG23 H 1 1.258 0.02 . 1 . . . . 32 THR HG2 . 15221 1 165 . 1 1 33 33 CYS H H 1 9.088 0.02 . 1 . . . . 33 CYS HN . 15221 1 166 . 1 1 33 33 CYS HA H 1 5.270 0.02 . 1 . . . . 33 CYS HA . 15221 1 167 . 1 1 33 33 CYS HB2 H 1 2.772 0.02 . 2 . . . . 33 CYS HB1 . 15221 1 168 . 1 1 33 33 CYS HB3 H 1 3.287 0.02 . 2 . . . . 33 CYS HB2 . 15221 1 169 . 1 1 34 34 LYS H H 1 9.237 0.02 . 1 . . . . 34 LYS HN . 15221 1 170 . 1 1 34 34 LYS HA H 1 4.863 0.02 . 1 . . . . 34 LYS HA . 15221 1 171 . 1 1 34 34 LYS HB2 H 1 1.724 0.02 . 2 . . . . 34 LYS HB1 . 15221 1 172 . 1 1 34 34 LYS HB3 H 1 1.986 0.02 . 2 . . . . 34 LYS HB2 . 15221 1 173 . 1 1 34 34 LYS HG2 H 1 1.413 0.02 . 2 . . . . 34 LYS HG2 . 15221 1 174 . 1 1 34 34 LYS HD2 H 1 1.669 0.02 . 2 . . . . 34 LYS HD2 . 15221 1 175 . 1 1 34 34 LYS HE2 H 1 2.998 0.02 . 2 . . . . 34 LYS HE2 . 15221 1 176 . 1 1 34 34 LYS HZ1 H 1 7.606 0.02 . 1 . . . . 34 LYS HZ . 15221 1 177 . 1 1 34 34 LYS HZ2 H 1 7.606 0.02 . 1 . . . . 34 LYS HZ . 15221 1 178 . 1 1 34 34 LYS HZ3 H 1 7.606 0.02 . 1 . . . . 34 LYS HZ . 15221 1 179 . 1 1 35 35 CYS H H 1 9.324 0.02 . 1 . . . . 35 CYS HN . 15221 1 180 . 1 1 35 35 CYS HA H 1 5.321 0.02 . 1 . . . . 35 CYS HA . 15221 1 181 . 1 1 35 35 CYS HB2 H 1 2.661 0.02 . 2 . . . . 35 CYS HB1 . 15221 1 182 . 1 1 35 35 CYS HB3 H 1 3.185 0.02 . 2 . . . . 35 CYS HB2 . 15221 1 183 . 1 1 36 36 LYS H H 1 9.084 0.02 . 1 . . . . 36 LYS HN . 15221 1 184 . 1 1 36 36 LYS HA H 1 4.434 0.02 . 1 . . . . 36 LYS HA . 15221 1 185 . 1 1 36 36 LYS HB2 H 1 1.735 0.02 . 2 . . . . 36 LYS HB1 . 15221 1 186 . 1 1 36 36 LYS HB3 H 1 1.894 0.02 . 2 . . . . 36 LYS HB2 . 15221 1 187 . 1 1 36 36 LYS HG2 H 1 1.337 0.02 . 2 . . . . 36 LYS HG2 . 15221 1 188 . 1 1 36 36 LYS HD2 H 1 1.660 0.02 . 2 . . . . 36 LYS HD2 . 15221 1 189 . 1 1 36 36 LYS HE2 H 1 3.270 0.02 . 2 . . . . 36 LYS HE2 . 15221 1 190 . 1 1 36 36 LYS HZ1 H 1 7.604 0.02 . 1 . . . . 36 LYS HZ . 15221 1 191 . 1 1 36 36 LYS HZ2 H 1 7.604 0.02 . 1 . . . . 36 LYS HZ . 15221 1 192 . 1 1 36 36 LYS HZ3 H 1 7.604 0.02 . 1 . . . . 36 LYS HZ . 15221 1 193 . 1 1 37 37 ALA H H 1 8.344 0.02 . 1 . . . . 37 ALA HN . 15221 1 194 . 1 1 37 37 ALA HA H 1 4.095 0.02 . 1 . . . . 37 ALA HA . 15221 1 195 . 1 1 37 37 ALA HB1 H 1 1.401 0.02 . 1 . . . . 37 ALA HB1 . 15221 1 196 . 1 1 37 37 ALA HB2 H 1 1.401 0.02 . 1 . . . . 37 ALA HB1 . 15221 1 197 . 1 1 37 37 ALA HB3 H 1 1.401 0.02 . 1 . . . . 37 ALA HB1 . 15221 1 stop_ save_