################################### # 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 36273 _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 0.01 _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 NOESY' 1 $sample_1 isotropic 36273 1 2 '2D 1H-1H TOCSY' 1 $sample_1 isotropic 36273 1 3 '2D 1H-1H ROESY' 1 $sample_1 isotropic 36273 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 1 1 CYS H H 1 7.891 0.00 . 1 . . . . A 1 CYS H1 . 36273 1 2 . 1 . 1 1 1 CYS HA H 1 4.444 0.00 . 1 . . . . A 1 CYS HA . 36273 1 3 . 1 . 1 1 1 CYS HB2 H 1 1.833 0.00 . 1 . . . . A 1 CYS HB2 . 36273 1 4 . 1 . 1 1 1 CYS HB3 H 1 1.976 0.00 . 1 . . . . A 1 CYS HB3 . 36273 1 5 . 1 . 1 2 2 VAL H H 1 8.777 0.00 . 1 . . . . A 2 VAL H . 36273 1 6 . 1 . 1 2 2 VAL HA H 1 4.131 0.00 . 1 . . . . A 2 VAL HA . 36273 1 7 . 1 . 1 2 2 VAL HB H 1 1.961 0.00 . 1 . . . . A 2 VAL HB . 36273 1 8 . 1 . 1 2 2 VAL HG11 H 1 0.579 0.00 . 1 . . . . A 2 VAL HG11 . 36273 1 9 . 1 . 1 2 2 VAL HG12 H 1 0.579 0.00 . 1 . . . . A 2 VAL HG12 . 36273 1 10 . 1 . 1 2 2 VAL HG13 H 1 0.579 0.00 . 1 . . . . A 2 VAL HG13 . 36273 1 11 . 1 . 1 2 2 VAL HG21 H 1 0.901 0.00 . 1 . . . . A 2 VAL HG21 . 36273 1 12 . 1 . 1 2 2 VAL HG22 H 1 0.901 0.00 . 1 . . . . A 2 VAL HG22 . 36273 1 13 . 1 . 1 2 2 VAL HG23 H 1 0.901 0.00 . 1 . . . . A 2 VAL HG23 . 36273 1 14 . 1 . 1 3 3 SER H H 1 9.026 0.00 . 1 . . . . A 3 SER H . 36273 1 15 . 1 . 1 3 3 SER HA H 1 4.020 0.00 . 1 . . . . A 3 SER HA . 36273 1 16 . 1 . 1 3 3 SER HB2 H 1 3.802 0.00 . 1 . . . . A 3 SER HB2 . 36273 1 17 . 1 . 1 3 3 SER HB3 H 1 3.852 0.00 . 1 . . . . A 3 SER HB3 . 36273 1 18 . 1 . 1 4 4 SER H H 1 7.116 0.00 . 1 . . . . A 4 SER H . 36273 1 19 . 1 . 1 4 4 SER HA H 1 4.720 0.01 . 1 . . . . A 4 SER HA . 36273 1 20 . 1 . 1 4 4 SER HB2 H 1 3.679 0.00 . 1 . . . . A 4 SER HB2 . 36273 1 21 . 1 . 1 5 5 GLY H H 1 7.640 0.00 . 1 . . . . A 5 GLY H . 36273 1 22 . 1 . 1 5 5 GLY HA2 H 1 3.895 0.00 . 1 . . . . A 5 GLY HA2 . 36273 1 23 . 1 . 1 5 5 GLY HA3 H 1 4.420 0.00 . 1 . . . . A 5 GLY HA3 . 36273 1 24 . 1 . 1 6 6 ILE H H 1 8.202 0.00 . 1 . . . . A 6 ILE H . 36273 1 25 . 1 . 1 6 6 ILE HA H 1 4.983 0.00 . 1 . . . . A 6 ILE HA . 36273 1 26 . 1 . 1 6 6 ILE HB H 1 1.644 0.01 . 1 . . . . A 6 ILE HB . 36273 1 27 . 1 . 1 6 6 ILE HG12 H 1 1.120 0.00 . 1 . . . . A 6 ILE HG12 . 36273 1 28 . 1 . 1 6 6 ILE HG21 H 1 0.837 0.01 . 1 . . . . A 6 ILE HG21 . 36273 1 29 . 1 . 1 6 6 ILE HG22 H 1 0.837 0.01 . 1 . . . . A 6 ILE HG22 . 36273 1 30 . 1 . 1 6 6 ILE HG23 H 1 0.837 0.01 . 1 . . . . A 6 ILE HG23 . 36273 1 31 . 1 . 1 6 6 ILE HD11 H 1 0.901 0.00 . 1 . . . . A 6 ILE HD11 . 36273 1 32 . 1 . 1 6 6 ILE HD12 H 1 0.901 0.00 . 1 . . . . A 6 ILE HD12 . 36273 1 33 . 1 . 1 6 6 ILE HD13 H 1 0.901 0.00 . 1 . . . . A 6 ILE HD13 . 36273 1 34 . 1 . 1 7 7 VAL H H 1 9.281 0.00 . 1 . . . . A 7 VAL H . 36273 1 35 . 1 . 1 7 7 VAL HA H 1 4.821 0.00 . 1 . . . . A 7 VAL HA . 36273 1 36 . 1 . 1 7 7 VAL HB H 1 2.351 0.00 . 1 . . . . A 7 VAL HB . 36273 1 37 . 1 . 1 7 7 VAL HG11 H 1 0.684 0.00 . 1 . . . . A 7 VAL HG11 . 36273 1 38 . 1 . 1 7 7 VAL HG12 H 1 0.684 0.00 . 1 . . . . A 7 VAL HG12 . 36273 1 39 . 1 . 1 7 7 VAL HG13 H 1 0.684 0.00 . 1 . . . . A 7 VAL HG13 . 36273 1 40 . 1 . 1 7 7 VAL HG21 H 1 0.846 0.00 . 1 . . . . A 7 VAL HG21 . 36273 1 41 . 1 . 1 7 7 VAL HG22 H 1 0.846 0.00 . 1 . . . . A 7 VAL HG22 . 36273 1 42 . 1 . 1 7 7 VAL HG23 H 1 0.846 0.00 . 1 . . . . A 7 VAL HG23 . 36273 1 43 . 1 . 1 8 8 ASP H H 1 8.124 0.00 . 1 . . . . A 8 ASP H . 36273 1 44 . 1 . 1 8 8 ASP HA H 1 4.909 0.00 . 1 . . . . A 8 ASP HA . 36273 1 45 . 1 . 1 8 8 ASP HB2 H 1 2.903 0.00 . 1 . . . . A 8 ASP HB2 . 36273 1 46 . 1 . 1 8 8 ASP HB3 H 1 2.965 0.00 . 1 . . . . A 8 ASP HB3 . 36273 1 47 . 1 . 1 9 9 ALA H H 1 7.140 0.00 . 1 . . . . A 9 ALA H . 36273 1 48 . 1 . 1 9 9 ALA HA H 1 4.125 0.00 . 1 . . . . A 9 ALA HA . 36273 1 49 . 1 . 1 9 9 ALA HB1 H 1 1.283 0.00 . 1 . . . . A 9 ALA HB1 . 36273 1 50 . 1 . 1 9 9 ALA HB2 H 1 1.283 0.00 . 1 . . . . A 9 ALA HB2 . 36273 1 51 . 1 . 1 9 9 ALA HB3 H 1 1.283 0.00 . 1 . . . . A 9 ALA HB3 . 36273 1 52 . 1 . 1 10 10 CYS H H 1 8.395 0.00 . 1 . . . . A 10 CYS H . 36273 1 53 . 1 . 1 10 10 CYS HA H 1 4.490 0.00 . 1 . . . . A 10 CYS HA . 36273 1 54 . 1 . 1 10 10 CYS HB2 H 1 2.560 0.00 . 1 . . . . A 10 CYS HB2 . 36273 1 55 . 1 . 1 10 10 CYS HB3 H 1 2.974 0.00 . 1 . . . . A 10 CYS HB3 . 36273 1 56 . 1 . 1 11 11 SER H H 1 7.900 0.00 . 1 . . . . A 11 SER H . 36273 1 57 . 1 . 1 11 11 SER HA H 1 4.032 0.00 . 1 . . . . A 11 SER HA . 36273 1 58 . 1 . 1 11 11 SER HB2 H 1 3.943 0.00 . 1 . . . . A 11 SER HB2 . 36273 1 59 . 1 . 1 11 11 SER HB3 H 1 3.789 0.00 . 1 . . . . A 11 SER HB3 . 36273 1 60 . 1 . 1 12 12 GLU H H 1 7.805 0.00 . 1 . . . . A 12 GLU H . 36273 1 61 . 1 . 1 12 12 GLU HA H 1 4.236 0.00 . 1 . . . . A 12 GLU HA . 36273 1 62 . 1 . 1 12 12 GLU HB2 H 1 2.140 0.00 . 1 . . . . A 12 GLU HB2 . 36273 1 63 . 1 . 1 12 12 GLU HB3 H 1 2.250 0.00 . 1 . . . . A 12 GLU HB3 . 36273 1 64 . 1 . 1 12 12 GLU HG2 H 1 2.466 0.00 . 1 . . . . A 12 GLU HG2 . 36273 1 65 . 1 . 1 12 12 GLU HG3 H 1 2.514 0.00 . 1 . . . . A 12 GLU HG3 . 36273 1 66 . 1 . 1 13 13 CYS H H 1 7.892 0.00 . 1 . . . . A 13 CYS H . 36273 1 67 . 1 . 1 13 13 CYS HA H 1 5.293 0.00 . 1 . . . . A 13 CYS HA . 36273 1 68 . 1 . 1 13 13 CYS HB2 H 1 2.406 0.00 . 1 . . . . A 13 CYS HB2 . 36273 1 69 . 1 . 1 13 13 CYS HB3 H 1 3.606 0.00 . 1 . . . . A 13 CYS HB3 . 36273 1 70 . 1 . 1 14 14 CYS H H 1 8.825 0.00 . 1 . . . . A 14 CYS H . 36273 1 71 . 1 . 1 14 14 CYS HA H 1 4.483 0.00 . 1 . . . . A 14 CYS HA . 36273 1 72 . 1 . 1 14 14 CYS HB2 H 1 2.710 0.00 . 1 . . . . A 14 CYS HB2 . 36273 1 73 . 1 . 1 14 14 CYS HB3 H 1 3.268 0.00 . 1 . . . . A 14 CYS HB3 . 36273 1 74 . 1 . 1 15 15 GLU H H 1 8.275 0.00 . 1 . . . . A 15 GLU H . 36273 1 75 . 1 . 1 15 15 GLU HA H 1 4.889 0.00 . 1 . . . . A 15 GLU HA . 36273 1 76 . 1 . 1 15 15 GLU HB2 H 1 2.058 0.00 . 1 . . . . A 15 GLU HB2 . 36273 1 77 . 1 . 1 15 15 GLU HB3 H 1 2.139 0.00 . 1 . . . . A 15 GLU HB3 . 36273 1 78 . 1 . 1 15 15 GLU HG2 H 1 2.344 0.00 . 1 . . . . A 15 GLU HG2 . 36273 1 79 . 1 . 1 16 16 PRO HG2 H 1 1.770 0.00 . 1 . . . . A 16 PRO HG2 . 36273 1 80 . 1 . 1 16 16 PRO HD2 H 1 3.656 0.00 . 1 . . . . A 16 PRO HD2 . 36273 1 81 . 1 . 1 16 16 PRO HD3 H 1 3.565 0.00 . 1 . . . . A 16 PRO HD3 . 36273 1 82 . 1 . 1 17 17 ASP H H 1 8.571 0.00 . 1 . . . . A 17 ASP H . 36273 1 83 . 1 . 1 17 17 ASP HA H 1 4.550 0.00 . 1 . . . . A 17 ASP HA . 36273 1 84 . 1 . 1 17 17 ASP HB2 H 1 2.872 0.00 . 1 . . . . A 17 ASP HB2 . 36273 1 85 . 1 . 1 17 17 ASP HB3 H 1 2.915 0.00 . 1 . . . . A 17 ASP HB3 . 36273 1 86 . 1 . 1 18 18 LYS H H 1 7.912 0.00 . 1 . . . . A 18 LYS H . 36273 1 87 . 1 . 1 18 18 LYS HA H 1 4.466 0.00 . 1 . . . . A 18 LYS HA . 36273 1 88 . 1 . 1 18 18 LYS HB2 H 1 1.852 0.00 . 1 . . . . A 18 LYS HB2 . 36273 1 89 . 1 . 1 18 18 LYS HB3 H 1 1.948 0.00 . 1 . . . . A 18 LYS HB3 . 36273 1 90 . 1 . 1 19 19 CYS H H 1 7.108 0.00 . 1 . . . . A 19 CYS H . 36273 1 91 . 1 . 1 19 19 CYS HA H 1 5.105 0.00 . 1 . . . . A 19 CYS HA . 36273 1 92 . 1 . 1 19 19 CYS HB2 H 1 3.003 0.00 . 1 . . . . A 19 CYS HB2 . 36273 1 93 . 1 . 1 19 19 CYS HB3 H 1 3.490 0.00 . 1 . . . . A 19 CYS HB3 . 36273 1 94 . 1 . 1 20 20 ILE H H 1 8.416 0.00 . 1 . . . . A 20 ILE H . 36273 1 95 . 1 . 1 20 20 ILE HA H 1 4.829 0.00 . 1 . . . . A 20 ILE HA . 36273 1 96 . 1 . 1 20 20 ILE HB H 1 1.900 0.00 . 1 . . . . A 20 ILE HB . 36273 1 97 . 1 . 1 20 20 ILE HG12 H 1 1.205 0.00 . 1 . . . . A 20 ILE HG12 . 36273 1 98 . 1 . 1 20 20 ILE HG21 H 1 0.981 0.00 . 1 . . . . A 20 ILE HG21 . 36273 1 99 . 1 . 1 20 20 ILE HG22 H 1 0.981 0.00 . 1 . . . . A 20 ILE HG22 . 36273 1 100 . 1 . 1 20 20 ILE HG23 H 1 0.981 0.00 . 1 . . . . A 20 ILE HG23 . 36273 1 101 . 1 . 1 21 21 ILE H H 1 8.363 0.00 . 1 . . . . A 21 ILE H . 36273 1 102 . 1 . 1 21 21 ILE HA H 1 4.028 0.00 . 1 . . . . A 21 ILE HA . 36273 1 103 . 1 . 1 21 21 ILE HB H 1 1.741 0.00 . 1 . . . . A 21 ILE HB . 36273 1 104 . 1 . 1 21 21 ILE HG13 H 1 1.141 0.06 . 1 . . . . A 21 ILE HG13 . 36273 1 105 . 1 . 1 21 21 ILE HD11 H 1 0.853 0.00 . 1 . . . . A 21 ILE HD11 . 36273 1 106 . 1 . 1 21 21 ILE HD12 H 1 0.853 0.00 . 1 . . . . A 21 ILE HD12 . 36273 1 107 . 1 . 1 21 21 ILE HD13 H 1 0.853 0.00 . 1 . . . . A 21 ILE HD13 . 36273 1 108 . 1 . 1 22 22 MET H H 1 8.120 0.00 . 1 . . . . A 22 MET H . 36273 1 109 . 1 . 1 22 22 MET HA H 1 4.463 0.00 . 1 . . . . A 22 MET HA . 36273 1 110 . 1 . 1 22 22 MET HB3 H 1 1.824 0.00 . 1 . . . . A 22 MET HB3 . 36273 1 111 . 1 . 1 22 22 MET HG2 H 1 2.296 0.00 . 1 . . . . A 22 MET HG2 . 36273 1 112 . 1 . 1 23 23 LEU H H 1 8.092 0.00 . 1 . . . . A 23 LEU H . 36273 1 113 . 1 . 1 23 23 LEU HA H 1 4.371 0.00 . 1 . . . . A 23 LEU HA . 36273 1 114 . 1 . 1 23 23 LEU HB2 H 1 1.603 0.00 . 1 . . . . A 23 LEU HB2 . 36273 1 115 . 1 . 1 23 23 LEU HG H 1 1.389 0.00 . 1 . . . . A 23 LEU HG . 36273 1 116 . 1 . 1 23 23 LEU HD11 H 1 0.870 0.00 . 1 . . . . A 23 LEU HD11 . 36273 1 117 . 1 . 1 23 23 LEU HD12 H 1 0.870 0.00 . 1 . . . . A 23 LEU HD12 . 36273 1 118 . 1 . 1 23 23 LEU HD13 H 1 0.870 0.00 . 1 . . . . A 23 LEU HD13 . 36273 1 119 . 1 . 1 24 24 PRO HA H 1 4.680 0.00 . 1 . . . . A 24 PRO HA . 36273 1 120 . 1 . 1 25 25 THR H H 1 8.252 0.00 . 1 . . . . A 25 THR H . 36273 1 121 . 1 . 1 25 25 THR HA H 1 4.097 0.00 . 1 . . . . A 25 THR HA . 36273 1 122 . 1 . 1 25 25 THR HB H 1 4.274 0.00 . 1 . . . . A 25 THR HB . 36273 1 123 . 1 . 1 25 25 THR HG21 H 1 1.227 0.00 . 1 . . . . A 25 THR HG21 . 36273 1 124 . 1 . 1 25 25 THR HG22 H 1 1.227 0.00 . 1 . . . . A 25 THR HG22 . 36273 1 125 . 1 . 1 25 25 THR HG23 H 1 1.227 0.00 . 1 . . . . A 25 THR HG23 . 36273 1 126 . 1 . 1 26 26 TRP H H 1 7.540 0.00 . 1 . . . . A 26 TRP H . 36273 1 127 . 1 . 1 26 26 TRP HA H 1 4.508 0.00 . 1 . . . . A 26 TRP HA . 36273 1 128 . 1 . 1 26 26 TRP HB3 H 1 3.132 0.00 . 1 . . . . A 26 TRP HB3 . 36273 1 129 . 1 . 1 26 26 TRP HD1 H 1 7.232 0.00 . 1 . . . . A 26 TRP HD1 . 36273 1 130 . 1 . 1 26 26 TRP HE1 H 1 10.201 0.00 . 1 . . . . A 26 TRP HE1 . 36273 1 131 . 1 . 1 26 26 TRP HE3 H 1 7.685 0.00 . 1 . . . . A 26 TRP HE3 . 36273 1 132 . 1 . 1 26 26 TRP HZ2 H 1 7.549 0.00 . 1 . . . . A 26 TRP HZ2 . 36273 1 133 . 1 . 1 26 26 TRP HZ3 H 1 7.217 0.00 . 1 . . . . A 26 TRP HZ3 . 36273 1 134 . 1 . 1 26 26 TRP HH2 H 1 7.279 0.00 . 1 . . . . A 26 TRP HH2 . 36273 1 135 . 1 . 1 28 28 PRO HA H 1 4.270 0.00 . 1 . . . . A 28 PRO HA . 36273 1 136 . 1 . 1 29 29 ARG H H 1 8.674 0.00 . 1 . . . . A 29 ARG H . 36273 1 137 . 1 . 1 29 29 ARG HA H 1 4.571 0.00 . 1 . . . . A 29 ARG HA . 36273 1 138 . 1 . 1 29 29 ARG HB3 H 1 1.650 0.00 . 1 . . . . A 29 ARG HB3 . 36273 1 139 . 1 . 1 29 29 ARG HG2 H 1 1.452 0.00 . 1 . . . . A 29 ARG HG2 . 36273 1 140 . 1 . 1 29 29 ARG HG3 H 1 1.584 0.00 . 1 . . . . A 29 ARG HG3 . 36273 1 141 . 1 . 1 29 29 ARG HD2 H 1 2.892 0.00 . 1 . . . . A 29 ARG HD2 . 36273 1 142 . 1 . 1 29 29 ARG HD3 H 1 3.136 0.00 . 1 . . . . A 29 ARG HD3 . 36273 1 143 . 1 . 1 29 29 ARG HE H 1 7.016 0.00 . 1 . . . . A 29 ARG HE . 36273 1 144 . 1 . 1 30 30 TYR H H 1 8.509 0.00 . 1 . . . . A 30 TYR H . 36273 1 145 . 1 . 1 30 30 TYR HA H 1 5.020 0.00 . 1 . . . . A 30 TYR HA . 36273 1 146 . 1 . 1 30 30 TYR HB2 H 1 2.192 0.00 . 1 . . . . A 30 TYR HB2 . 36273 1 147 . 1 . 1 30 30 TYR HB3 H 1 2.886 0.00 . 1 . . . . A 30 TYR HB3 . 36273 1 148 . 1 . 1 30 30 TYR HD1 H 1 6.654 0.00 . 1 . . . . A 30 TYR HD1 . 36273 1 149 . 1 . 1 30 30 TYR HE1 H 1 6.683 0.00 . 1 . . . . A 30 TYR HE1 . 36273 1 150 . 1 . 1 31 31 VAL H H 1 9.262 0.00 . 1 . . . . A 31 VAL H . 36273 1 151 . 1 . 1 31 31 VAL HA H 1 4.739 0.01 . 1 . . . . A 31 VAL HA . 36273 1 152 . 1 . 1 31 31 VAL HB H 1 1.953 0.00 . 1 . . . . A 31 VAL HB . 36273 1 153 . 1 . 1 31 31 VAL HG11 H 1 0.867 0.00 . 1 . . . . A 31 VAL HG11 . 36273 1 154 . 1 . 1 31 31 VAL HG12 H 1 0.867 0.00 . 1 . . . . A 31 VAL HG12 . 36273 1 155 . 1 . 1 31 31 VAL HG13 H 1 0.867 0.00 . 1 . . . . A 31 VAL HG13 . 36273 1 156 . 1 . 1 32 32 CYS H H 1 9.176 0.00 . 1 . . . . A 32 CYS H . 36273 1 157 . 1 . 1 32 32 CYS HA H 1 5.059 0.00 . 1 . . . . A 32 CYS HA . 36273 1 158 . 1 . 1 32 32 CYS HB2 H 1 2.240 0.00 . 1 . . . . A 32 CYS HB2 . 36273 1 159 . 1 . 1 32 32 CYS HB3 H 1 3.347 0.00 . 1 . . . . A 32 CYS HB3 . 36273 1 160 . 1 . 1 33 33 SER H H 1 8.302 0.00 . 1 . . . . A 33 SER H . 36273 1 161 . 1 . 1 33 33 SER HA H 1 4.777 0.00 . 1 . . . . A 33 SER HA . 36273 1 162 . 1 . 1 33 33 SER HB2 H 1 3.813 0.00 . 1 . . . . A 33 SER HB2 . 36273 1 163 . 1 . 1 33 33 SER HB3 H 1 3.880 0.00 . 1 . . . . A 33 SER HB3 . 36273 1 164 . 1 . 1 34 34 VAL H H 1 7.936 0.00 . 1 . . . . A 34 VAL H . 36273 1 165 . 1 . 1 34 34 VAL HA H 1 4.273 0.00 . 1 . . . . A 34 VAL HA . 36273 1 166 . 1 . 1 34 34 VAL HB H 1 2.098 0.00 . 1 . . . . A 34 VAL HB . 36273 1 167 . 1 . 1 34 34 VAL HG11 H 1 0.855 0.00 . 1 . . . . A 34 VAL HG11 . 36273 1 168 . 1 . 1 34 34 VAL HG12 H 1 0.855 0.00 . 1 . . . . A 34 VAL HG12 . 36273 1 169 . 1 . 1 34 34 VAL HG13 H 1 0.855 0.00 . 1 . . . . A 34 VAL HG13 . 36273 1 170 . 1 . 1 34 34 VAL HG21 H 1 0.918 0.00 . 1 . . . . A 34 VAL HG21 . 36273 1 171 . 1 . 1 34 34 VAL HG22 H 1 0.918 0.00 . 1 . . . . A 34 VAL HG22 . 36273 1 172 . 1 . 1 34 34 VAL HG23 H 1 0.918 0.00 . 1 . . . . A 34 VAL HG23 . 36273 1 stop_ save_