################################### # 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 30181 _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-1H TOCSY' . . . 30181 1 2 '2D 1H-1H NOESY' . . . 30181 1 3 '2D 1H-15N HSQC' . . . 30181 1 4 '2D 1H-13C HSQC' . . . 30181 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 TYR H H 1 8.282 . . 1 . . . . A 3 TYR H . 30181 1 2 . 1 . 1 3 3 TYR HA H 1 4.644 . . 1 . . . . A 3 TYR HA . 30181 1 3 . 1 . 1 3 3 TYR HB2 H 1 3.052 . . 2 . . . . A 3 TYR HB2 . 30181 1 4 . 1 . 1 3 3 TYR HB3 H 1 2.943 . . 2 . . . . A 3 TYR HB3 . 30181 1 5 . 1 . 1 3 3 TYR N N 15 120.868 . . 1 . . . . A 3 TYR N . 30181 1 6 . 1 . 1 4 4 CYS H H 1 7.798 . . 1 . . . . A 4 CYS H . 30181 1 7 . 1 . 1 4 4 CYS HA H 1 4.896 . . 1 . . . . A 4 CYS HA . 30181 1 8 . 1 . 1 4 4 CYS HB2 H 1 3.075 . . 2 . . . . A 4 CYS HB2 . 30181 1 9 . 1 . 1 4 4 CYS HB3 H 1 2.889 . . 2 . . . . A 4 CYS HB3 . 30181 1 10 . 1 . 1 4 4 CYS N N 15 117.438 . . 1 . . . . A 4 CYS N . 30181 1 11 . 1 . 1 5 5 GLN H H 1 9.160 . . 1 . . . . A 5 GLN H . 30181 1 12 . 1 . 1 5 5 GLN HA H 1 4.335 . . 1 . . . . A 5 GLN HA . 30181 1 13 . 1 . 1 5 5 GLN HB2 H 1 1.957 . . 2 . . . . A 5 GLN HB2 . 30181 1 14 . 1 . 1 5 5 GLN HB3 H 1 1.815 . . 2 . . . . A 5 GLN HB3 . 30181 1 15 . 1 . 1 5 5 GLN HE21 H 1 8.269 . . 2 . . . . A 5 GLN HE21 . 30181 1 16 . 1 . 1 5 5 GLN HE22 H 1 6.732 . . 2 . . . . A 5 GLN HE22 . 30181 1 17 . 1 . 1 5 5 GLN N N 15 118.894 . . 1 . . . . A 5 GLN N . 30181 1 18 . 1 . 1 5 5 GLN NE2 N 15 111.676 . . 1 . . . . A 5 GLN NE2 . 30181 1 19 . 1 . 1 6 6 LYS H H 1 8.422 . . 1 . . . . A 6 LYS H . 30181 1 20 . 1 . 1 6 6 LYS HA H 1 4.116 . . 1 . . . . A 6 LYS HA . 30181 1 21 . 1 . 1 6 6 LYS HB2 H 1 2.039 . . 2 . . . . A 6 LYS HB2 . 30181 1 22 . 1 . 1 6 6 LYS HB3 H 1 1.683 . . 2 . . . . A 6 LYS HB3 . 30181 1 23 . 1 . 1 6 6 LYS HG2 H 1 1.521 . . 2 . . . . A 6 LYS HG2 . 30181 1 24 . 1 . 1 6 6 LYS HG3 H 1 1.401 . . 2 . . . . A 6 LYS HG3 . 30181 1 25 . 1 . 1 6 6 LYS HD2 H 1 1.637 . . 2 . . . . A 6 LYS HD2 . 30181 1 26 . 1 . 1 6 6 LYS HD3 H 1 1.578 . . 2 . . . . A 6 LYS HD3 . 30181 1 27 . 1 . 1 6 6 LYS N N 15 121.183 . . 1 . . . . A 6 LYS N . 30181 1 28 . 1 . 1 7 7 TRP H H 1 8.508 . . 1 . . . . A 7 TRP H . 30181 1 29 . 1 . 1 7 7 TRP HA H 1 4.747 . . 1 . . . . A 7 TRP HA . 30181 1 30 . 1 . 1 7 7 TRP HB2 H 1 3.158 . . 2 . . . . A 7 TRP HB2 . 30181 1 31 . 1 . 1 7 7 TRP HB3 H 1 2.874 . . 2 . . . . A 7 TRP HB3 . 30181 1 32 . 1 . 1 7 7 TRP HE1 H 1 10.705 . . 1 . . . . A 7 TRP HE1 . 30181 1 33 . 1 . 1 7 7 TRP N N 15 121.304 . . 1 . . . . A 7 TRP N . 30181 1 34 . 1 . 1 7 7 TRP NE1 N 15 130.406 . . 1 . . . . A 7 TRP NE1 . 30181 1 35 . 1 . 1 8 8 MET H H 1 9.110 . . 1 . . . . A 8 MET H . 30181 1 36 . 1 . 1 8 8 MET HA H 1 3.772 . . 1 . . . . A 8 MET HA . 30181 1 37 . 1 . 1 8 8 MET HB2 H 1 1.242 . . 2 . . . . A 8 MET HB2 . 30181 1 38 . 1 . 1 8 8 MET HG2 H 1 1.674 . . 2 . . . . A 8 MET HG2 . 30181 1 39 . 1 . 1 8 8 MET HG3 H 1 1.591 . . 2 . . . . A 8 MET HG3 . 30181 1 40 . 1 . 1 8 8 MET N N 15 119.089 . . 1 . . . . A 8 MET N . 30181 1 41 . 1 . 1 9 9 GLN H H 1 8.289 . . 1 . . . . A 9 GLN H . 30181 1 42 . 1 . 1 9 9 GLN HA H 1 4.542 . . 1 . . . . A 9 GLN HA . 30181 1 43 . 1 . 1 9 9 GLN HB2 H 1 2.092 . . 2 . . . . A 9 GLN HB2 . 30181 1 44 . 1 . 1 9 9 GLN HG2 H 1 2.330 . . 2 . . . . A 9 GLN HG2 . 30181 1 45 . 1 . 1 9 9 GLN HG3 H 1 2.200 . . 2 . . . . A 9 GLN HG3 . 30181 1 46 . 1 . 1 9 9 GLN HE21 H 1 7.529 . . 2 . . . . A 9 GLN HE21 . 30181 1 47 . 1 . 1 9 9 GLN HE22 H 1 6.820 . . 2 . . . . A 9 GLN HE22 . 30181 1 48 . 1 . 1 9 9 GLN N N 15 118.471 . . 1 . . . . A 9 GLN N . 30181 1 49 . 1 . 1 9 9 GLN NE2 N 15 112.663 . . 1 . . . . A 9 GLN NE2 . 30181 1 50 . 1 . 1 10 10 THR H H 1 8.325 . . 1 . . . . A 10 THR H . 30181 1 51 . 1 . 1 10 10 THR HA H 1 4.408 . . 1 . . . . A 10 THR HA . 30181 1 52 . 1 . 1 10 10 THR HB H 1 4.201 . . 1 . . . . A 10 THR HB . 30181 1 53 . 1 . 1 10 10 THR N N 15 113.183 . . 1 . . . . A 10 THR N . 30181 1 54 . 1 . 1 11 11 CYS H H 1 7.691 . . 1 . . . . A 11 CYS H . 30181 1 55 . 1 . 1 11 11 CYS HA H 1 5.053 . . 1 . . . . A 11 CYS HA . 30181 1 56 . 1 . 1 11 11 CYS HB2 H 1 3.311 . . 2 . . . . A 11 CYS HB2 . 30181 1 57 . 1 . 1 11 11 CYS HB3 H 1 3.136 . . 2 . . . . A 11 CYS HB3 . 30181 1 58 . 1 . 1 11 11 CYS N N 15 117.784 . . 1 . . . . A 11 CYS N . 30181 1 59 . 1 . 1 12 12 ASP H H 1 8.635 . . 1 . . . . A 12 ASP H . 30181 1 60 . 1 . 1 12 12 ASP HA H 1 4.319 . . 1 . . . . A 12 ASP HA . 30181 1 61 . 1 . 1 12 12 ASP HB2 H 1 3.068 . . 2 . . . . A 12 ASP HB2 . 30181 1 62 . 1 . 1 12 12 ASP N N 15 118.978 . . 1 . . . . A 12 ASP N . 30181 1 63 . 1 . 1 13 13 SER H H 1 8.274 . . 1 . . . . A 13 SER H . 30181 1 64 . 1 . 1 13 13 SER HA H 1 4.017 . . 1 . . . . A 13 SER HA . 30181 1 65 . 1 . 1 13 13 SER HB2 H 1 3.890 . . 2 . . . . A 13 SER HB2 . 30181 1 66 . 1 . 1 13 13 SER HB3 H 1 3.835 . . 2 . . . . A 13 SER HB3 . 30181 1 67 . 1 . 1 14 14 GLU H H 1 8.225 . . 1 . . . . A 14 GLU H . 30181 1 68 . 1 . 1 14 14 GLU HA H 1 4.352 . . 1 . . . . A 14 GLU HA . 30181 1 69 . 1 . 1 14 14 GLU HB2 H 1 1.909 . . 2 . . . . A 14 GLU HB2 . 30181 1 70 . 1 . 1 14 14 GLU HB3 H 1 2.036 . . 2 . . . . A 14 GLU HB3 . 30181 1 71 . 1 . 1 14 14 GLU HG2 H 1 2.190 . . 2 . . . . A 14 GLU HG2 . 30181 1 72 . 1 . 1 14 14 GLU HG3 H 1 2.134 . . 2 . . . . A 14 GLU HG3 . 30181 1 73 . 1 . 1 14 14 GLU N N 15 119.104 . . 1 . . . . A 14 GLU N . 30181 1 74 . 1 . 1 15 15 ARG H H 1 8.162 . . 1 . . . . A 15 ARG H . 30181 1 75 . 1 . 1 15 15 ARG HA H 1 4.424 . . 1 . . . . A 15 ARG HA . 30181 1 76 . 1 . 1 15 15 ARG HB2 H 1 1.668 . . 2 . . . . A 15 ARG HB2 . 30181 1 77 . 1 . 1 15 15 ARG HB3 H 1 1.503 . . 2 . . . . A 15 ARG HB3 . 30181 1 78 . 1 . 1 15 15 ARG HG2 H 1 1.484 . . 2 . . . . A 15 ARG HG2 . 30181 1 79 . 1 . 1 15 15 ARG HG3 H 1 1.291 . . 2 . . . . A 15 ARG HG3 . 30181 1 80 . 1 . 1 15 15 ARG HD2 H 1 3.111 . . 2 . . . . A 15 ARG HD2 . 30181 1 81 . 1 . 1 15 15 ARG HD3 H 1 2.950 . . 2 . . . . A 15 ARG HD3 . 30181 1 82 . 1 . 1 15 15 ARG HH11 H 1 6.945 . . 2 . . . . A 15 ARG HH11 . 30181 1 83 . 1 . 1 15 15 ARG N N 15 124.661 . . 1 . . . . A 15 ARG N . 30181 1 84 . 1 . 1 16 16 LYS H H 1 7.812 . . 1 . . . . A 16 LYS H . 30181 1 85 . 1 . 1 16 16 LYS HA H 1 4.302 . . 1 . . . . A 16 LYS HA . 30181 1 86 . 1 . 1 16 16 LYS HB2 H 1 1.829 . . 2 . . . . A 16 LYS HB2 . 30181 1 87 . 1 . 1 16 16 LYS HB3 H 1 1.668 . . 2 . . . . A 16 LYS HB3 . 30181 1 88 . 1 . 1 16 16 LYS HG2 H 1 1.609 . . 2 . . . . A 16 LYS HG2 . 30181 1 89 . 1 . 1 16 16 LYS HG3 H 1 1.359 . . 2 . . . . A 16 LYS HG3 . 30181 1 90 . 1 . 1 16 16 LYS N N 15 121.141 . . 1 . . . . A 16 LYS N . 30181 1 91 . 1 . 1 17 17 CYS H H 1 9.040 . . 1 . . . . A 17 CYS H . 30181 1 92 . 1 . 1 17 17 CYS HA H 1 4.864 . . 1 . . . . A 17 CYS HA . 30181 1 93 . 1 . 1 17 17 CYS HB2 H 1 2.459 . . 2 . . . . A 17 CYS HB2 . 30181 1 94 . 1 . 1 17 17 CYS N N 15 119.294 . . 1 . . . . A 17 CYS N . 30181 1 95 . 1 . 1 18 18 CYS H H 1 9.376 . . 1 . . . . A 18 CYS H . 30181 1 96 . 1 . 1 18 18 CYS HA H 1 4.507 . . 1 . . . . A 18 CYS HA . 30181 1 97 . 1 . 1 18 18 CYS HB2 H 1 2.421 . . 2 . . . . A 18 CYS HB2 . 30181 1 98 . 1 . 1 18 18 CYS N N 15 121.462 . . 1 . . . . A 18 CYS N . 30181 1 99 . 1 . 1 19 19 GLU H H 1 7.948 . . 1 . . . . A 19 GLU H . 30181 1 100 . 1 . 1 19 19 GLU HA H 1 4.930 . . 1 . . . . A 19 GLU HA . 30181 1 101 . 1 . 1 19 19 GLU HG2 H 1 2.916 . . 2 . . . . A 19 GLU HG2 . 30181 1 102 . 1 . 1 19 19 GLU HG3 H 1 2.552 . . 2 . . . . A 19 GLU HG3 . 30181 1 103 . 1 . 1 20 20 GLY H H 1 8.809 . . 1 . . . . A 20 GLY H . 30181 1 104 . 1 . 1 20 20 GLY HA2 H 1 4.255 . . 2 . . . . A 20 GLY HA2 . 30181 1 105 . 1 . 1 20 20 GLY HA3 H 1 3.653 . . 2 . . . . A 20 GLY HA3 . 30181 1 106 . 1 . 1 20 20 GLY N N 15 111.350 . . 1 . . . . A 20 GLY N . 30181 1 107 . 1 . 1 21 21 MET H H 1 7.501 . . 1 . . . . A 21 MET H . 30181 1 108 . 1 . 1 21 21 MET HA H 1 5.046 . . 1 . . . . A 21 MET HA . 30181 1 109 . 1 . 1 21 21 MET HB2 H 1 2.339 . . 2 . . . . A 21 MET HB2 . 30181 1 110 . 1 . 1 21 21 MET HB3 H 1 2.120 . . 2 . . . . A 21 MET HB3 . 30181 1 111 . 1 . 1 21 21 MET HG2 H 1 1.867 . . 2 . . . . A 21 MET HG2 . 30181 1 112 . 1 . 1 21 21 MET N N 15 118.138 . . 1 . . . . A 21 MET N . 30181 1 113 . 1 . 1 22 22 VAL H H 1 9.052 . . 1 . . . . A 22 VAL H . 30181 1 114 . 1 . 1 22 22 VAL HA H 1 4.408 . . 1 . . . . A 22 VAL HA . 30181 1 115 . 1 . 1 22 22 VAL HB H 1 1.841 . . 1 . . . . A 22 VAL HB . 30181 1 116 . 1 . 1 22 22 VAL N N 15 116.753 . . 1 . . . . A 22 VAL N . 30181 1 117 . 1 . 1 23 23 CYS H H 1 8.861 . . 1 . . . . A 23 CYS H . 30181 1 118 . 1 . 1 23 23 CYS HA H 1 4.685 . . 1 . . . . A 23 CYS HA . 30181 1 119 . 1 . 1 23 23 CYS HB2 H 1 2.750 . . 2 . . . . A 23 CYS HB2 . 30181 1 120 . 1 . 1 23 23 CYS N N 15 122.863 . . 1 . . . . A 23 CYS N . 30181 1 121 . 1 . 1 24 24 ARG H H 1 8.120 . . 1 . . . . A 24 ARG H . 30181 1 122 . 1 . 1 24 24 ARG HA H 1 4.440 . . 1 . . . . A 24 ARG HA . 30181 1 123 . 1 . 1 24 24 ARG HB2 H 1 1.613 . . 2 . . . . A 24 ARG HB2 . 30181 1 124 . 1 . 1 24 24 ARG HB3 H 1 1.474 . . 2 . . . . A 24 ARG HB3 . 30181 1 125 . 1 . 1 24 24 ARG HG2 H 1 1.364 . . 2 . . . . A 24 ARG HG2 . 30181 1 126 . 1 . 1 24 24 ARG HG3 H 1 1.244 . . 2 . . . . A 24 ARG HG3 . 30181 1 127 . 1 . 1 24 24 ARG HD2 H 1 3.194 . . 2 . . . . A 24 ARG HD2 . 30181 1 128 . 1 . 1 24 24 ARG HD3 H 1 3.033 . . 2 . . . . A 24 ARG HD3 . 30181 1 129 . 1 . 1 24 24 ARG HH11 H 1 7.181 . . 2 . . . . A 24 ARG HH11 . 30181 1 130 . 1 . 1 24 24 ARG N N 15 103.215 . . 1 . . . . A 24 ARG N . 30181 1 131 . 1 . 1 25 25 LEU H H 1 7.997 . . 1 . . . . A 25 LEU H . 30181 1 132 . 1 . 1 25 25 LEU HA H 1 3.627 . . 1 . . . . A 25 LEU HA . 30181 1 133 . 1 . 1 25 25 LEU HB2 H 1 2.039 . . 2 . . . . A 25 LEU HB2 . 30181 1 134 . 1 . 1 25 25 LEU HB3 H 1 1.288 . . 2 . . . . A 25 LEU HB3 . 30181 1 135 . 1 . 1 25 25 LEU HG H 1 0.954 . . 1 . . . . A 25 LEU HG . 30181 1 136 . 1 . 1 25 25 LEU N N 15 123.742 . . 1 . . . . A 25 LEU N . 30181 1 137 . 1 . 1 26 26 TRP H H 1 7.977 . . 1 . . . . A 26 TRP H . 30181 1 138 . 1 . 1 26 26 TRP HA H 1 5.148 . . 1 . . . . A 26 TRP HA . 30181 1 139 . 1 . 1 26 26 TRP HB2 H 1 2.846 . . 2 . . . . A 26 TRP HB2 . 30181 1 140 . 1 . 1 26 26 TRP HB3 H 1 2.547 . . 2 . . . . A 26 TRP HB3 . 30181 1 141 . 1 . 1 26 26 TRP HE1 H 1 10.144 . . 1 . . . . A 26 TRP HE1 . 30181 1 142 . 1 . 1 26 26 TRP N N 15 116.152 . . 1 . . . . A 26 TRP N . 30181 1 143 . 1 . 1 26 26 TRP NE1 N 15 129.625 . . 1 . . . . A 26 TRP NE1 . 30181 1 144 . 1 . 1 27 27 CYS H H 1 8.449 . . 1 . . . . A 27 CYS H . 30181 1 145 . 1 . 1 27 27 CYS HA H 1 4.810 . . 1 . . . . A 27 CYS HA . 30181 1 146 . 1 . 1 27 27 CYS HB2 H 1 3.224 . . 2 . . . . A 27 CYS HB2 . 30181 1 147 . 1 . 1 27 27 CYS HB3 H 1 3.116 . . 2 . . . . A 27 CYS HB3 . 30181 1 148 . 1 . 1 27 27 CYS N N 15 118.551 . . 1 . . . . A 27 CYS N . 30181 1 149 . 1 . 1 28 28 LYS H H 1 9.239 . . 1 . . . . A 28 LYS H . 30181 1 150 . 1 . 1 28 28 LYS HA H 1 4.912 . . 1 . . . . A 28 LYS HA . 30181 1 151 . 1 . 1 28 28 LYS HB2 H 1 1.958 . . 2 . . . . A 28 LYS HB2 . 30181 1 152 . 1 . 1 28 28 LYS HB3 H 1 1.649 . . 2 . . . . A 28 LYS HB3 . 30181 1 153 . 1 . 1 28 28 LYS HG2 H 1 1.326 . . 2 . . . . A 28 LYS HG2 . 30181 1 154 . 1 . 1 28 28 LYS HD2 H 1 1.483 . . 2 . . . . A 28 LYS HD2 . 30181 1 155 . 1 . 1 28 28 LYS HD3 H 1 1.392 . . 2 . . . . A 28 LYS HD3 . 30181 1 156 . 1 . 1 28 28 LYS N N 15 125.126 . . 1 . . . . A 28 LYS N . 30181 1 157 . 1 . 1 29 29 LYS H H 1 8.458 . . 1 . . . . A 29 LYS H . 30181 1 158 . 1 . 1 29 29 LYS HA H 1 4.238 . . 1 . . . . A 29 LYS HA . 30181 1 159 . 1 . 1 29 29 LYS HB2 H 1 1.731 . . 2 . . . . A 29 LYS HB2 . 30181 1 160 . 1 . 1 29 29 LYS HB3 H 1 1.581 . . 2 . . . . A 29 LYS HB3 . 30181 1 161 . 1 . 1 29 29 LYS HG2 H 1 1.195 . . 2 . . . . A 29 LYS HG2 . 30181 1 162 . 1 . 1 29 29 LYS HG3 H 1 1.113 . . 2 . . . . A 29 LYS HG3 . 30181 1 163 . 1 . 1 29 29 LYS HD3 H 1 1.288 . . 2 . . . . A 29 LYS HD3 . 30181 1 164 . 1 . 1 29 29 LYS N N 15 120.094 . . 1 . . . . A 29 LYS N . 30181 1 165 . 1 . 1 30 30 LYS H H 1 8.075 . . 1 . . . . A 30 LYS H . 30181 1 166 . 1 . 1 30 30 LYS HA H 1 4.127 . . 1 . . . . A 30 LYS HA . 30181 1 167 . 1 . 1 30 30 LYS HB2 H 1 1.691 . . 2 . . . . A 30 LYS HB2 . 30181 1 168 . 1 . 1 30 30 LYS HB3 H 1 1.526 . . 2 . . . . A 30 LYS HB3 . 30181 1 169 . 1 . 1 30 30 LYS HG2 H 1 1.261 . . 2 . . . . A 30 LYS HG2 . 30181 1 170 . 1 . 1 30 30 LYS HG3 H 1 1.155 . . 2 . . . . A 30 LYS HG3 . 30181 1 171 . 1 . 1 30 30 LYS HD2 H 1 1.447 . . 2 . . . . A 30 LYS HD2 . 30181 1 172 . 1 . 1 30 30 LYS N N 15 122.321 . . 1 . . . . A 30 LYS N . 30181 1 173 . 1 . 1 31 31 LEU H H 1 8.263 . . 1 . . . . A 31 LEU H . 30181 1 174 . 1 . 1 31 31 LEU HA H 1 4.295 . . 1 . . . . A 31 LEU HA . 30181 1 175 . 1 . 1 31 31 LEU HB2 H 1 1.550 . . 2 . . . . A 31 LEU HB2 . 30181 1 176 . 1 . 1 31 31 LEU HB3 H 1 1.239 . . 2 . . . . A 31 LEU HB3 . 30181 1 177 . 1 . 1 31 31 LEU HG H 1 1.326 . . 1 . . . . A 31 LEU HG . 30181 1 178 . 1 . 1 31 31 LEU N N 15 124.706 . . 1 . . . . A 31 LEU N . 30181 1 179 . 1 . 1 32 32 LEU H H 1 7.668 . . 1 . . . . A 32 LEU H . 30181 1 180 . 1 . 1 32 32 LEU HA H 1 4.109 . . 1 . . . . A 32 LEU HA . 30181 1 181 . 1 . 1 32 32 LEU HG H 1 1.506 . . 1 . . . . A 32 LEU HG . 30181 1 182 . 1 . 1 32 32 LEU N N 15 128.072 . . 1 . . . . A 32 LEU N . 30181 1 stop_ save_