################################### # 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 31235 _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-TOCSY . . . 31235 1 2 '2D 1H-1H NOESY' . . . 31235 1 3 '2D 1H-1H NOESY' . . . 31235 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 2 2 GLY H H 1 8.085 0.020 . 1 . . . . A 2 GLY H . 31235 1 2 . 1 . 1 2 2 GLY HA2 H 1 4.070 0.020 . 2 . . . . A 2 GLY HA2 . 31235 1 3 . 1 . 1 2 2 GLY HA3 H 1 4.070 0.020 . 2 . . . . A 2 GLY HA3 . 31235 1 4 . 1 . 1 3 3 SER H H 1 8.423 0.020 . 1 . . . . A 3 SER H . 31235 1 5 . 1 . 1 3 3 SER HA H 1 4.564 0.020 . 1 . . . . A 3 SER HA . 31235 1 6 . 1 . 1 3 3 SER HB2 H 1 3.898 0.020 . 2 . . . . A 3 SER HB2 . 31235 1 7 . 1 . 1 3 3 SER HB3 H 1 3.898 0.020 . 2 . . . . A 3 SER HB3 . 31235 1 8 . 1 . 1 4 4 CYS H H 1 8.288 0.020 . 1 . . . . A 4 CYS H . 31235 1 9 . 1 . 1 4 4 CYS HA H 1 4.809 0.020 . 1 . . . . A 4 CYS HA . 31235 1 10 . 1 . 1 4 4 CYS HB2 H 1 2.876 0.020 . . . . . . A 4 CYS HB2 . 31235 1 11 . 1 . 1 4 4 CYS HB3 H 1 3.261 0.020 . . . . . . A 4 CYS HB3 . 31235 1 12 . 1 . 1 5 5 ARG H H 1 9.138 0.020 . 1 . . . . A 5 ARG H . 31235 1 13 . 1 . 1 5 5 ARG HA H 1 4.652 0.020 . 1 . . . . A 5 ARG HA . 31235 1 14 . 1 . 1 5 5 ARG HB2 H 1 1.924 0.020 . 2 . . . . A 5 ARG HB2 . 31235 1 15 . 1 . 1 5 5 ARG HB3 H 1 1.924 0.020 . 2 . . . . A 5 ARG HB3 . 31235 1 16 . 1 . 1 5 5 ARG HG2 H 1 1.748 0.020 . 2 . . . . A 5 ARG HG2 . 31235 1 17 . 1 . 1 5 5 ARG HG3 H 1 1.748 0.020 . 2 . . . . A 5 ARG HG3 . 31235 1 18 . 1 . 1 5 5 ARG HD2 H 1 3.364 0.020 . . . . . . A 5 ARG HD2 . 31235 1 19 . 1 . 1 5 5 ARG HD3 H 1 2.934 0.020 . . . . . . A 5 ARG HD3 . 31235 1 20 . 1 . 1 5 5 ARG HE H 1 7.328 0.020 . 1 . . . . A 5 ARG HE . 31235 1 21 . 1 . 1 6 6 THR H H 1 8.038 0.020 . 1 . . . . A 6 THR H . 31235 1 22 . 1 . 1 6 6 THR HA H 1 4.502 0.020 . 1 . . . . A 6 THR HA . 31235 1 23 . 1 . 1 6 6 THR HB H 1 4.096 0.020 . 1 . . . . A 6 THR HB . 31235 1 24 . 1 . 1 6 6 THR HG21 H 1 1.320 0.020 . 1 . . . . A 6 THR HG1 . 31235 1 25 . 1 . 1 6 6 THR HG22 H 1 1.320 0.020 . 1 . . . . A 6 THR HG1 . 31235 1 26 . 1 . 1 6 6 THR HG23 H 1 1.320 0.020 . 1 . . . . A 6 THR HG1 . 31235 1 27 . 1 . 1 7 7 GLU H H 1 7.984 0.020 . 1 . . . . A 7 GLU H . 31235 1 28 . 1 . 1 7 7 GLU HA H 1 4.118 0.020 . 1 . . . . A 7 GLU HA . 31235 1 29 . 1 . 1 7 7 GLU HB2 H 1 1.899 0.020 . 2 . . . . A 7 GLU HB2 . 31235 1 30 . 1 . 1 7 7 GLU HB3 H 1 1.899 0.020 . 2 . . . . A 7 GLU HB3 . 31235 1 31 . 1 . 1 7 7 GLU HG2 H 1 2.077 0.020 . 2 . . . . A 7 GLU HG2 . 31235 1 32 . 1 . 1 7 7 GLU HG3 H 1 2.077 0.020 . 2 . . . . A 7 GLU HG3 . 31235 1 33 . 1 . 1 8 8 GLY H H 1 9.770 0.020 . 1 . . . . A 8 GLY H . 31235 1 34 . 1 . 1 8 8 GLY HA2 H 1 4.371 0.020 . . . . . . A 8 GLY HA2 . 31235 1 35 . 1 . 1 8 8 GLY HA3 H 1 3.634 0.020 . . . . . . A 8 GLY HA3 . 31235 1 36 . 1 . 1 9 9 MET H H 1 7.716 0.020 . 1 . . . . A 9 MET H . 31235 1 37 . 1 . 1 9 9 MET HA H 1 4.465 0.020 . 1 . . . . A 9 MET HA . 31235 1 38 . 1 . 1 9 9 MET HB2 H 1 2.158 0.020 . 2 . . . . A 9 MET HB2 . 31235 1 39 . 1 . 1 9 9 MET HB3 H 1 2.158 0.020 . 2 . . . . A 9 MET HB3 . 31235 1 40 . 1 . 1 9 9 MET HG2 H 1 2.696 0.020 . . . . . . A 9 MET HG2 . 31235 1 41 . 1 . 1 9 9 MET HG3 H 1 2.490 0.020 . . . . . . A 9 MET HG3 . 31235 1 42 . 1 . 1 10 10 SER H H 1 8.505 0.020 . 1 . . . . A 10 SER H . 31235 1 43 . 1 . 1 10 10 SER HA H 1 4.902 0.020 . 1 . . . . A 10 SER HA . 31235 1 44 . 1 . 1 10 10 SER HB2 H 1 3.964 0.020 . 2 . . . . A 10 SER HB2 . 31235 1 45 . 1 . 1 10 10 SER HB3 H 1 3.964 0.020 . 2 . . . . A 10 SER HB3 . 31235 1 46 . 1 . 1 11 11 CYS H H 1 8.175 0.020 . 1 . . . . A 11 CYS H . 31235 1 47 . 1 . 1 11 11 CYS HA H 1 4.604 0.020 . 1 . . . . A 11 CYS HA . 31235 1 48 . 1 . 1 11 11 CYS HB2 H 1 3.119 0.020 . . . . . . A 11 CYS HB2 . 31235 1 49 . 1 . 1 11 11 CYS HB3 H 1 3.044 0.020 . . . . . . A 11 CYS HB3 . 31235 1 50 . 1 . 1 12 12 GLU H H 1 9.488 0.020 . 1 . . . . A 12 GLU H . 31235 1 51 . 1 . 1 12 12 GLU HA H 1 4.535 0.020 . 1 . . . . A 12 GLU HA . 31235 1 52 . 1 . 1 12 12 GLU HB2 H 1 2.186 0.020 . . . . . . A 12 GLU HB2 . 31235 1 53 . 1 . 1 12 12 GLU HB3 H 1 1.998 0.020 . . . . . . A 12 GLU HB3 . 31235 1 54 . 1 . 1 12 12 GLU HG2 H 1 2.518 0.020 . . . . . . A 12 GLU HG2 . 31235 1 55 . 1 . 1 12 12 GLU HG3 H 1 2.396 0.020 . . . . . . A 12 GLU HG3 . 31235 1 56 . 1 . 1 13 13 GLU H H 1 7.849 0.020 . 1 . . . . A 13 GLU H . 31235 1 57 . 1 . 1 13 13 GLU HA H 1 4.808 0.020 . 1 . . . . A 13 GLU HA . 31235 1 58 . 1 . 1 13 13 GLU HB2 H 1 1.888 0.020 . 2 . . . . A 13 GLU HB2 . 31235 1 59 . 1 . 1 13 13 GLU HB3 H 1 1.888 0.020 . 2 . . . . A 13 GLU HB3 . 31235 1 60 . 1 . 1 13 13 GLU HG2 H 1 2.381 0.020 . . . . . . A 13 GLU HG2 . 31235 1 61 . 1 . 1 13 13 GLU HG3 H 1 2.287 0.020 . . . . . . A 13 GLU HG3 . 31235 1 62 . 1 . 1 14 14 ASN H H 1 9.223 0.020 . 1 . . . . A 14 ASN H . 31235 1 63 . 1 . 1 14 14 ASN HA H 1 4.019 0.020 . 1 . . . . A 14 ASN HA . 31235 1 64 . 1 . 1 14 14 ASN HB2 H 1 2.788 0.020 . . . . . . A 14 ASN HB2 . 31235 1 65 . 1 . 1 14 14 ASN HB3 H 1 2.870 0.020 . . . . . . A 14 ASN HB3 . 31235 1 66 . 1 . 1 14 14 ASN HD21 H 1 7.769 0.020 . . . . . . A 14 ASN HD21 . 31235 1 67 . 1 . 1 14 14 ASN HD22 H 1 7.254 0.020 . . . . . . A 14 ASN HD22 . 31235 1 68 . 1 . 1 15 15 GLN H H 1 8.997 0.020 . 1 . . . . A 15 GLN H . 31235 1 69 . 1 . 1 15 15 GLN HA H 1 3.990 0.020 . 1 . . . . A 15 GLN HA . 31235 1 70 . 1 . 1 15 15 GLN HB2 H 1 2.132 0.020 . 2 . . . . A 15 GLN HB2 . 31235 1 71 . 1 . 1 15 15 GLN HB3 H 1 2.132 0.020 . 2 . . . . A 15 GLN HB3 . 31235 1 72 . 1 . 1 15 15 GLN HG2 H 1 2.432 0.020 . 2 . . . . A 15 GLN HG2 . 31235 1 73 . 1 . 1 15 15 GLN HG3 H 1 2.432 0.020 . 2 . . . . A 15 GLN HG3 . 31235 1 74 . 1 . 1 15 15 GLN HE21 H 1 7.528 0.020 . . . . . . A 15 GLN HE21 . 31235 1 75 . 1 . 1 15 15 GLN HE22 H 1 6.878 0.020 . . . . . . A 15 GLN HE22 . 31235 1 76 . 1 . 1 16 16 GLN H H 1 7.410 0.020 . 1 . . . . A 16 GLN H . 31235 1 77 . 1 . 1 16 16 GLN HA H 1 4.202 0.020 . 1 . . . . A 16 GLN HA . 31235 1 78 . 1 . 1 16 16 GLN HB2 H 1 1.903 0.020 . . . . . . A 16 GLN HB2 . 31235 1 79 . 1 . 1 16 16 GLN HB3 H 1 2.341 0.020 . . . . . . A 16 GLN HB3 . 31235 1 80 . 1 . 1 16 16 GLN HG2 H 1 2.508 0.020 . 2 . . . . A 16 GLN HG2 . 31235 1 81 . 1 . 1 16 16 GLN HG3 H 1 2.508 0.020 . 2 . . . . A 16 GLN HG3 . 31235 1 82 . 1 . 1 16 16 GLN HE21 H 1 7.698 0.020 . . . . . . A 16 GLN HE21 . 31235 1 83 . 1 . 1 16 16 GLN HE22 H 1 7.028 0.020 . . . . . . A 16 GLN HE22 . 31235 1 84 . 1 . 1 17 17 CYS H H 1 7.760 0.020 . 1 . . . . A 17 CYS H . 31235 1 85 . 1 . 1 17 17 CYS HA H 1 5.078 0.020 . 1 . . . . A 17 CYS HA . 31235 1 86 . 1 . 1 17 17 CYS HB2 H 1 2.636 0.020 . . . . . . A 17 CYS HB2 . 31235 1 87 . 1 . 1 17 17 CYS HB3 H 1 3.748 0.020 . . . . . . A 17 CYS HB3 . 31235 1 88 . 1 . 1 18 18 CYS H H 1 10.020 0.020 . 1 . . . . A 18 CYS H . 31235 1 89 . 1 . 1 18 18 CYS HA H 1 4.383 0.020 . 1 . . . . A 18 CYS HA . 31235 1 90 . 1 . 1 18 18 CYS HB2 H 1 2.674 0.020 . . . . . . A 18 CYS HB2 . 31235 1 91 . 1 . 1 18 18 CYS HB3 H 1 3.077 0.020 . . . . . . A 18 CYS HB3 . 31235 1 92 . 1 . 1 19 19 TRP H H 1 8.875 0.020 . 1 . . . . A 19 TRP H . 31235 1 93 . 1 . 1 19 19 TRP HA H 1 4.811 0.020 . 1 . . . . A 19 TRP HA . 31235 1 94 . 1 . 1 19 19 TRP HB2 H 1 2.923 0.020 . . . . . . A 19 TRP HB2 . 31235 1 95 . 1 . 1 19 19 TRP HB3 H 1 3.445 0.020 . . . . . . A 19 TRP HB3 . 31235 1 96 . 1 . 1 19 19 TRP HD1 H 1 6.992 0.020 . 1 . . . . A 19 TRP HD1 . 31235 1 97 . 1 . 1 19 19 TRP HE1 H 1 10.005 0.020 . 1 . . . . A 19 TRP HE1 . 31235 1 98 . 1 . 1 19 19 TRP HE3 H 1 7.617 0.020 . 1 . . . . A 19 TRP HE3 . 31235 1 99 . 1 . 1 20 20 ARG H H 1 7.628 0.020 . 1 . . . . A 20 ARG H . 31235 1 100 . 1 . 1 20 20 ARG HA H 1 4.028 0.020 . 1 . . . . A 20 ARG HA . 31235 1 101 . 1 . 1 20 20 ARG HB2 H 1 1.979 0.020 . 2 . . . . A 20 ARG HB2 . 31235 1 102 . 1 . 1 20 20 ARG HB3 H 1 1.979 0.020 . 2 . . . . A 20 ARG HB3 . 31235 1 103 . 1 . 1 20 20 ARG HG2 H 1 1.525 0.020 . 2 . . . . A 20 ARG HG2 . 31235 1 104 . 1 . 1 20 20 ARG HG3 H 1 1.525 0.020 . 2 . . . . A 20 ARG HG3 . 31235 1 105 . 1 . 1 20 20 ARG HD2 H 1 3.305 0.020 . . . . . . A 20 ARG HD2 . 31235 1 106 . 1 . 1 20 20 ARG HD3 H 1 3.134 0.020 . . . . . . A 20 ARG HD3 . 31235 1 107 . 1 . 1 20 20 ARG HE H 1 7.188 0.020 . 1 . . . . A 20 ARG HE . 31235 1 108 . 1 . 1 21 21 SER H H 1 7.316 0.020 . 1 . . . . A 21 SER H . 31235 1 109 . 1 . 1 21 21 SER HA H 1 4.687 0.020 . 1 . . . . A 21 SER HA . 31235 1 110 . 1 . 1 21 21 SER HB2 H 1 3.764 0.020 . . . . . . A 21 SER HB2 . 31235 1 111 . 1 . 1 21 21 SER HB3 H 1 3.538 0.020 . . . . . . A 21 SER HB3 . 31235 1 112 . 1 . 1 22 22 CYS H H 1 9.764 0.020 . 1 . . . . A 22 CYS H . 31235 1 113 . 1 . 1 22 22 CYS HA H 1 4.881 0.020 . 1 . . . . A 22 CYS HA . 31235 1 114 . 1 . 1 22 22 CYS HB2 H 1 2.840 0.020 . . . . . . A 22 CYS HB2 . 31235 1 115 . 1 . 1 22 22 CYS HB3 H 1 2.629 0.020 . . . . . . A 22 CYS HB3 . 31235 1 116 . 1 . 1 23 23 CYS H H 1 9.433 0.020 . 1 . . . . A 23 CYS H . 31235 1 117 . 1 . 1 23 23 CYS HA H 1 5.031 0.020 . 1 . . . . A 23 CYS HA . 31235 1 118 . 1 . 1 23 23 CYS HB2 H 1 3.390 0.020 . . . . . . A 23 CYS HB2 . 31235 1 119 . 1 . 1 23 23 CYS HB3 H 1 2.953 0.020 . . . . . . A 23 CYS HB3 . 31235 1 120 . 1 . 1 24 24 ARG H H 1 9.542 0.020 . 1 . . . . A 24 ARG H . 31235 1 121 . 1 . 1 24 24 ARG HA H 1 3.866 0.020 . 1 . . . . A 24 ARG HA . 31235 1 122 . 1 . 1 24 24 ARG HB2 H 1 1.884 0.020 . 2 . . . . A 24 ARG HB2 . 31235 1 123 . 1 . 1 24 24 ARG HB3 H 1 1.884 0.020 . 2 . . . . A 24 ARG HB3 . 31235 1 124 . 1 . 1 24 24 ARG HG2 H 1 1.527 0.020 . 2 . . . . A 24 ARG HG2 . 31235 1 125 . 1 . 1 24 24 ARG HG3 H 1 1.527 0.020 . 2 . . . . A 24 ARG HG3 . 31235 1 126 . 1 . 1 24 24 ARG HD2 H 1 3.057 0.020 . . . . . . A 24 ARG HD2 . 31235 1 127 . 1 . 1 24 24 ARG HD3 H 1 2.903 0.020 . . . . . . A 24 ARG HD3 . 31235 1 128 . 1 . 1 24 24 ARG HE H 1 7.063 0.020 . 1 . . . . A 24 ARG HE . 31235 1 129 . 1 . 1 25 25 GLY H H 1 7.798 0.020 . 1 . . . . A 25 GLY H . 31235 1 130 . 1 . 1 25 25 GLY HA2 H 1 4.033 0.020 . . . . . . A 25 GLY HA2 . 31235 1 131 . 1 . 1 25 25 GLY HA3 H 1 4.228 0.020 . . . . . . A 25 GLY HA3 . 31235 1 132 . 1 . 1 26 26 GLU H H 1 7.595 0.020 . 1 . . . . A 26 GLU H . 31235 1 133 . 1 . 1 26 26 GLU HA H 1 5.177 0.020 . 1 . . . . A 26 GLU HA . 31235 1 134 . 1 . 1 26 26 GLU HB2 H 1 1.808 0.020 . 2 . . . . A 26 GLU HB2 . 31235 1 135 . 1 . 1 26 26 GLU HB3 H 1 1.808 0.020 . 2 . . . . A 26 GLU HB3 . 31235 1 136 . 1 . 1 26 26 GLU HG2 H 1 2.282 0.020 . 2 . . . . A 26 GLU HG2 . 31235 1 137 . 1 . 1 26 26 GLU HG3 H 1 2.282 0.020 . 2 . . . . A 26 GLU HG3 . 31235 1 138 . 1 . 1 27 27 CYS H H 1 9.345 0.020 . 1 . . . . A 27 CYS H . 31235 1 139 . 1 . 1 27 27 CYS HA H 1 5.141 0.020 . 1 . . . . A 27 CYS HA . 31235 1 140 . 1 . 1 27 27 CYS HB2 H 1 2.969 0.020 . . . . . . A 27 CYS HB2 . 31235 1 141 . 1 . 1 27 27 CYS HB3 H 1 3.106 0.020 . . . . . . A 27 CYS HB3 . 31235 1 142 . 1 . 1 28 28 GLU H H 1 8.255 0.020 . 1 . . . . A 28 GLU H . 31235 1 143 . 1 . 1 28 28 GLU HA H 1 4.786 0.020 . 1 . . . . A 28 GLU HA . 31235 1 144 . 1 . 1 28 28 GLU HB2 H 1 1.987 0.020 . . . . . . A 28 GLU HB2 . 31235 1 145 . 1 . 1 28 28 GLU HB3 H 1 1.868 0.020 . . . . . . A 28 GLU HB3 . 31235 1 146 . 1 . 1 28 28 GLU HG2 H 1 2.403 0.020 . . . . . . A 28 GLU HG2 . 31235 1 147 . 1 . 1 28 28 GLU HG3 H 1 2.296 0.020 . . . . . . A 28 GLU HG3 . 31235 1 148 . 1 . 1 29 29 ALA H H 1 8.970 0.020 . 1 . . . . A 29 ALA H . 31235 1 149 . 1 . 1 29 29 ALA HA H 1 4.617 0.020 . 1 . . . . A 29 ALA HA . 31235 1 150 . 1 . 1 29 29 ALA HB1 H 1 1.503 0.020 . 1 . . . . A 29 ALA HB1 . 31235 1 151 . 1 . 1 29 29 ALA HB2 H 1 1.503 0.020 . 1 . . . . A 29 ALA HB2 . 31235 1 152 . 1 . 1 29 29 ALA HB3 H 1 1.503 0.020 . 1 . . . . A 29 ALA HB3 . 31235 1 153 . 1 . 1 30 30 PRO HB2 H 1 1.934 0.020 . . . . . . A 30 PRO HB2 . 31235 1 154 . 1 . 1 30 30 PRO HB3 H 1 2.379 0.020 . . . . . . A 30 PRO HB3 . 31235 1 155 . 1 . 1 30 30 PRO HG2 H 1 1.733 0.020 . 2 . . . . A 30 PRO HG2 . 31235 1 156 . 1 . 1 30 30 PRO HG3 H 1 1.733 0.020 . 2 . . . . A 30 PRO HG3 . 31235 1 157 . 1 . 1 30 30 PRO HD2 H 1 3.596 0.020 . . . . . . A 30 PRO HD2 . 31235 1 158 . 1 . 1 30 30 PRO HD3 H 1 3.429 0.020 . . . . . . A 30 PRO HD3 . 31235 1 159 . 1 . 1 31 31 CYS H H 1 8.963 0.020 . 1 . . . . A 31 CYS H . 31235 1 160 . 1 . 1 31 31 CYS HA H 1 4.878 0.020 . 1 . . . . A 31 CYS HA . 31235 1 161 . 1 . 1 31 31 CYS HB2 H 1 2.922 0.020 . 2 . . . . A 31 CYS HB2 . 31235 1 162 . 1 . 1 31 31 CYS HB3 H 1 2.922 0.020 . 2 . . . . A 31 CYS HB3 . 31235 1 163 . 1 . 1 32 32 ARG H H 1 8.407 0.020 . 1 . . . . A 32 ARG H . 31235 1 164 . 1 . 1 32 32 ARG HA H 1 4.337 0.020 . 1 . . . . A 32 ARG HA . 31235 1 165 . 1 . 1 32 32 ARG HB2 H 1 1.662 0.020 . . . . . . A 32 ARG HB2 . 31235 1 166 . 1 . 1 32 32 ARG HB3 H 1 1.567 0.020 . . . . . . A 32 ARG HB3 . 31235 1 167 . 1 . 1 32 32 ARG HG2 H 1 1.367 0.020 . . . . . . A 32 ARG HG2 . 31235 1 168 . 1 . 1 32 32 ARG HG3 H 1 1.297 0.020 . . . . . . A 32 ARG HG3 . 31235 1 169 . 1 . 1 32 32 ARG HD2 H 1 3.066 0.020 . 2 . . . . A 32 ARG HD2 . 31235 1 170 . 1 . 1 32 32 ARG HD3 H 1 3.066 0.020 . 2 . . . . A 32 ARG HD3 . 31235 1 171 . 1 . 1 32 32 ARG HE H 1 7.100 0.020 . 1 . . . . A 32 ARG HE . 31235 1 172 . 1 . 1 33 33 PHE H H 1 8.011 0.020 . 1 . . . . A 33 PHE H . 31235 1 173 . 1 . 1 33 33 PHE HA H 1 4.656 0.020 . 1 . . . . A 33 PHE HA . 31235 1 174 . 1 . 1 33 33 PHE HB2 H 1 3.240 0.020 . . . . . . A 33 PHE HB2 . 31235 1 175 . 1 . 1 33 33 PHE HB3 H 1 2.899 0.020 . . . . . . A 33 PHE HB3 . 31235 1 176 . 1 . 1 33 33 PHE HD1 H 1 7.230 0.020 . 3 . . . . A 33 PHE HD1 . 31235 1 177 . 1 . 1 33 33 PHE HD2 H 1 7.230 0.020 . 3 . . . . A 33 PHE HD2 . 31235 1 178 . 1 . 1 33 33 PHE HE1 H 1 7.349 0.020 . 3 . . . . A 33 PHE HE1 . 31235 1 179 . 1 . 1 33 33 PHE HE2 H 1 7.349 0.020 . 3 . . . . A 33 PHE HE2 . 31235 1 180 . 1 . 1 34 34 GLY H H 1 8.027 0.020 . 1 . . . . A 34 GLY H . 31235 1 181 . 1 . 1 34 34 GLY HA2 H 1 4.027 0.020 . . . . . . A 34 GLY HA2 . 31235 1 182 . 1 . 1 34 34 GLY HA3 H 1 3.749 0.020 . . . . . . A 34 GLY HA3 . 31235 1 183 . 1 . 1 35 35 PRO HB2 H 1 2.261 0.020 . 2 . . . . A 35 PRO HB2 . 31235 1 184 . 1 . 1 35 35 PRO HB3 H 1 2.261 0.020 . 2 . . . . A 35 PRO HB3 . 31235 1 185 . 1 . 1 35 35 PRO HG2 H 1 2.018 0.020 . 2 . . . . A 35 PRO HG2 . 31235 1 186 . 1 . 1 35 35 PRO HG3 H 1 2.018 0.020 . 2 . . . . A 35 PRO HG3 . 31235 1 187 . 1 . 1 35 35 PRO HD2 H 1 3.616 0.020 . . . . . . A 35 PRO HD2 . 31235 1 188 . 1 . 1 35 35 PRO HD3 H 1 3.568 0.020 . . . . . . A 35 PRO HD3 . 31235 1 stop_ save_