################################### # 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 34401 _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 NOESY' . . . 34401 1 2 '2D 1H-1H TOCSY' . . . 34401 1 3 '2D 1H-13C HSQC' . . . 34401 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.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 PHE HA H 1 4.296 0.020 . 1 . . . . A 1 PHE HA . 34401 1 2 . 1 1 1 1 PHE HB2 H 1 3.220 0.020 . 1 . . . . A 1 PHE HB2 . 34401 1 3 . 1 1 1 1 PHE HB3 H 1 3.220 0.020 . 1 . . . . A 1 PHE HB3 . 34401 1 4 . 1 1 1 1 PHE HD1 H 1 7.260 0.020 . 1 . . . . A 1 PHE HD1 . 34401 1 5 . 1 1 1 1 PHE HD2 H 1 7.260 0.020 . 1 . . . . A 1 PHE HD2 . 34401 1 6 . 1 1 1 1 PHE HE1 H 1 7.168 0.020 . 1 . . . . A 1 PHE HE1 . 34401 1 7 . 1 1 1 1 PHE HE2 H 1 7.168 0.020 . 1 . . . . A 1 PHE HE2 . 34401 1 8 . 1 1 1 1 PHE CA C 13 56.893 0.3 . 1 . . . . A 1 PHE CA . 34401 1 9 . 1 1 1 1 PHE CB C 13 39.199 0.3 . 1 . . . . A 1 PHE CB . 34401 1 10 . 1 1 2 2 ARG H H 1 8.695 0.020 . 1 . . . . A 2 ARG H . 34401 1 11 . 1 1 2 2 ARG HA H 1 4.546 0.020 . 1 . . . . A 2 ARG HA . 34401 1 12 . 1 1 2 2 ARG HB2 H 1 1.748 0.020 . 2 . . . . A 2 ARG HB2 . 34401 1 13 . 1 1 2 2 ARG HB3 H 1 1.863 0.020 . 2 . . . . A 2 ARG HB3 . 34401 1 14 . 1 1 2 2 ARG HG2 H 1 1.689 0.020 . 2 . . . . A 2 ARG HG2 . 34401 1 15 . 1 1 2 2 ARG HG3 H 1 1.598 0.020 . 2 . . . . A 2 ARG HG3 . 34401 1 16 . 1 1 2 2 ARG HD2 H 1 3.206 0.020 . 1 . . . . A 2 ARG HD2 . 34401 1 17 . 1 1 2 2 ARG HD3 H 1 3.206 0.020 . 1 . . . . A 2 ARG HD3 . 34401 1 18 . 1 1 2 2 ARG HE H 1 7.381 0.020 . 1 . . . . A 2 ARG HE . 34401 1 19 . 1 1 2 2 ARG CA C 13 53.731 0.3 . 1 . . . . A 2 ARG CA . 34401 1 20 . 1 1 2 2 ARG CB C 13 30.315 0.3 . 1 . . . . A 2 ARG CB . 34401 1 21 . 1 1 2 2 ARG CG C 13 26.531 0.3 . 1 . . . . A 2 ARG CG . 34401 1 22 . 1 1 2 2 ARG CD C 13 42.916 0.3 . 1 . . . . A 2 ARG CD . 34401 1 23 . 1 1 3 3 ILE H H 1 8.570 0.020 . 1 . . . . A 3 ILE H . 34401 1 24 . 1 1 3 3 ILE HA H 1 3.903 0.020 . 1 . . . . A 3 ILE HA . 34401 1 25 . 1 1 3 3 ILE HB H 1 1.894 0.020 . 1 . . . . A 3 ILE HB . 34401 1 26 . 1 1 3 3 ILE HG12 H 1 1.571 0.020 . 2 . . . . A 3 ILE HG12 . 34401 1 27 . 1 1 3 3 ILE HG13 H 1 1.277 0.020 . 2 . . . . A 3 ILE HG13 . 34401 1 28 . 1 1 3 3 ILE HG21 H 1 0.930 0.020 . 1 . . . . A 3 ILE HG21 . 34401 1 29 . 1 1 3 3 ILE HG22 H 1 0.930 0.020 . 1 . . . . A 3 ILE HG22 . 34401 1 30 . 1 1 3 3 ILE HG23 H 1 0.930 0.020 . 1 . . . . A 3 ILE HG23 . 34401 1 31 . 1 1 3 3 ILE HD11 H 1 0.932 0.020 . 1 . . . . A 3 ILE HD11 . 34401 1 32 . 1 1 3 3 ILE HD12 H 1 0.932 0.020 . 1 . . . . A 3 ILE HD12 . 34401 1 33 . 1 1 3 3 ILE HD13 H 1 0.932 0.020 . 1 . . . . A 3 ILE HD13 . 34401 1 34 . 1 1 3 3 ILE CA C 13 62.746 0.3 . 1 . . . . A 3 ILE CA . 34401 1 35 . 1 1 3 3 ILE CB C 13 37.949 0.3 . 1 . . . . A 3 ILE CB . 34401 1 36 . 1 1 3 3 ILE CG1 C 13 28.510 0.3 . 1 . . . . A 3 ILE CG1 . 34401 1 37 . 1 1 3 3 ILE CG2 C 13 17.589 0.3 . 1 . . . . A 3 ILE CG2 . 34401 1 38 . 1 1 3 3 ILE CD1 C 13 13.326 0.3 . 1 . . . . A 3 ILE CD1 . 34401 1 39 . 1 1 4 4 MET H H 1 8.593 0.020 . 1 . . . . A 4 MET H . 34401 1 40 . 1 1 4 4 MET HA H 1 4.293 0.020 . 1 . . . . A 4 MET HA . 34401 1 41 . 1 1 4 4 MET HB2 H 1 2.072 0.020 . 2 . . . . A 4 MET HB2 . 34401 1 42 . 1 1 4 4 MET HB3 H 1 2.039 0.020 . 2 . . . . A 4 MET HB3 . 34401 1 43 . 1 1 4 4 MET HG2 H 1 2.617 0.020 . 2 . . . . A 4 MET HG2 . 34401 1 44 . 1 1 4 4 MET HG3 H 1 2.710 0.020 . 2 . . . . A 4 MET HG3 . 34401 1 45 . 1 1 4 4 MET HE1 H 1 2.035 0.020 . 1 . . . . A 4 MET HE1 . 34401 1 46 . 1 1 4 4 MET HE2 H 1 2.035 0.020 . 1 . . . . A 4 MET HE2 . 34401 1 47 . 1 1 4 4 MET HE3 H 1 2.035 0.020 . 1 . . . . A 4 MET HE3 . 34401 1 48 . 1 1 4 4 MET CA C 13 56.317 0.3 . 1 . . . . A 4 MET CA . 34401 1 49 . 1 1 4 4 MET CB C 13 30.448 0.3 . 1 . . . . A 4 MET CB . 34401 1 50 . 1 1 4 4 MET CG C 13 32.061 0.3 . 1 . . . . A 4 MET CG . 34401 1 51 . 1 1 4 4 MET CE C 13 16.256 0.3 . 1 . . . . A 4 MET CE . 34401 1 52 . 1 1 5 5 ARG H H 1 7.781 0.020 . 1 . . . . A 5 ARG H . 34401 1 53 . 1 1 5 5 ARG HA H 1 4.031 0.020 . 1 . . . . A 5 ARG HA . 34401 1 54 . 1 1 5 5 ARG HB2 H 1 1.878 0.020 . 1 . . . . A 5 ARG HB2 . 34401 1 55 . 1 1 5 5 ARG HB3 H 1 1.878 0.020 . 1 . . . . A 5 ARG HB3 . 34401 1 56 . 1 1 5 5 ARG HG2 H 1 1.670 0.020 . 2 . . . . A 5 ARG HG2 . 34401 1 57 . 1 1 5 5 ARG HG3 H 1 1.624 0.020 . 2 . . . . A 5 ARG HG3 . 34401 1 58 . 1 1 5 5 ARG HD2 H 1 3.109 0.020 . 2 . . . . A 5 ARG HD2 . 34401 1 59 . 1 1 5 5 ARG HD3 H 1 3.193 0.020 . 2 . . . . A 5 ARG HD3 . 34401 1 60 . 1 1 5 5 ARG HE H 1 7.475 0.020 . 1 . . . . A 5 ARG HE . 34401 1 61 . 1 1 5 5 ARG CA C 13 58.239 0.3 . 1 . . . . A 5 ARG CA . 34401 1 62 . 1 1 5 5 ARG CB C 13 29.592 0.3 . 1 . . . . A 5 ARG CB . 34401 1 63 . 1 1 5 5 ARG CG C 13 26.967 0.3 . 1 . . . . A 5 ARG CG . 34401 1 64 . 1 1 5 5 ARG CD C 13 42.933 0.3 . 1 . . . . A 5 ARG CD . 34401 1 65 . 1 1 6 6 ILE H H 1 7.525 0.020 . 1 . . . . A 6 ILE H . 34401 1 66 . 1 1 6 6 ILE HA H 1 3.873 0.020 . 1 . . . . A 6 ILE HA . 34401 1 67 . 1 1 6 6 ILE HB H 1 2.032 0.020 . 1 . . . . A 6 ILE HB . 34401 1 68 . 1 1 6 6 ILE HG12 H 1 1.619 0.020 . 2 . . . . A 6 ILE HG12 . 34401 1 69 . 1 1 6 6 ILE HG13 H 1 1.272 0.020 . 2 . . . . A 6 ILE HG13 . 34401 1 70 . 1 1 6 6 ILE HG21 H 1 0.910 0.020 . 1 . . . . A 6 ILE HG21 . 34401 1 71 . 1 1 6 6 ILE HG22 H 1 0.910 0.020 . 1 . . . . A 6 ILE HG22 . 34401 1 72 . 1 1 6 6 ILE HG23 H 1 0.910 0.020 . 1 . . . . A 6 ILE HG23 . 34401 1 73 . 1 1 6 6 ILE HD11 H 1 0.879 0.020 . 1 . . . . A 6 ILE HD11 . 34401 1 74 . 1 1 6 6 ILE HD12 H 1 0.879 0.020 . 1 . . . . A 6 ILE HD12 . 34401 1 75 . 1 1 6 6 ILE HD13 H 1 0.879 0.020 . 1 . . . . A 6 ILE HD13 . 34401 1 76 . 1 1 6 6 ILE CA C 13 62.848 0.3 . 1 . . . . A 6 ILE CA . 34401 1 77 . 1 1 6 6 ILE CB C 13 37.595 0.3 . 1 . . . . A 6 ILE CB . 34401 1 78 . 1 1 6 6 ILE CG1 C 13 28.374 0.3 . 1 . . . . A 6 ILE CG1 . 34401 1 79 . 1 1 6 6 ILE CG2 C 13 17.363 0.3 . 1 . . . . A 6 ILE CG2 . 34401 1 80 . 1 1 6 6 ILE CD1 C 13 12.935 0.3 . 1 . . . . A 6 ILE CD1 . 34401 1 81 . 1 1 7 7 LEU H H 1 7.716 0.020 . 1 . . . . A 7 LEU H . 34401 1 82 . 1 1 7 7 LEU HA H 1 3.973 0.020 . 1 . . . . A 7 LEU HA . 34401 1 83 . 1 1 7 7 LEU HB2 H 1 1.861 0.020 . 2 . . . . A 7 LEU HB2 . 34401 1 84 . 1 1 7 7 LEU HB3 H 1 1.541 0.020 . 2 . . . . A 7 LEU HB3 . 34401 1 85 . 1 1 7 7 LEU HG H 1 1.828 0.020 . 1 . . . . A 7 LEU HG . 34401 1 86 . 1 1 7 7 LEU HD11 H 1 0.928 0.020 . 2 . . . . A 7 LEU HD11 . 34401 1 87 . 1 1 7 7 LEU HD12 H 1 0.928 0.020 . 2 . . . . A 7 LEU HD12 . 34401 1 88 . 1 1 7 7 LEU HD13 H 1 0.928 0.020 . 2 . . . . A 7 LEU HD13 . 34401 1 89 . 1 1 7 7 LEU HD21 H 1 0.830 0.020 . 2 . . . . A 7 LEU HD21 . 34401 1 90 . 1 1 7 7 LEU HD22 H 1 0.830 0.020 . 2 . . . . A 7 LEU HD22 . 34401 1 91 . 1 1 7 7 LEU HD23 H 1 0.830 0.020 . 2 . . . . A 7 LEU HD23 . 34401 1 92 . 1 1 7 7 LEU CA C 13 57.276 0.3 . 1 . . . . A 7 LEU CA . 34401 1 93 . 1 1 7 7 LEU CB C 13 40.681 0.3 . 1 . . . . A 7 LEU CB . 34401 1 94 . 1 1 7 7 LEU CG C 13 26.733 0.3 . 1 . . . . A 7 LEU CG . 34401 1 95 . 1 1 7 7 LEU CD1 C 13 25.380 0.3 . 1 . . . . A 7 LEU CD1 . 34401 1 96 . 1 1 7 7 LEU CD2 C 13 22.704 0.3 . 1 . . . . A 7 LEU CD2 . 34401 1 97 . 1 1 8 8 ARG H H 1 7.723 0.020 . 1 . . . . A 8 ARG H . 34401 1 98 . 1 1 8 8 ARG HA H 1 4.131 0.020 . 1 . . . . A 8 ARG HA . 34401 1 99 . 1 1 8 8 ARG HB2 H 1 1.907 0.020 . 1 . . . . A 8 ARG HB2 . 34401 1 100 . 1 1 8 8 ARG HB3 H 1 1.907 0.020 . 1 . . . . A 8 ARG HB3 . 34401 1 101 . 1 1 8 8 ARG HG2 H 1 1.744 0.020 . 2 . . . . A 8 ARG HG2 . 34401 1 102 . 1 1 8 8 ARG HG3 H 1 1.688 0.020 . 2 . . . . A 8 ARG HG3 . 34401 1 103 . 1 1 8 8 ARG HD2 H 1 3.164 0.020 . 1 . . . . A 8 ARG HD2 . 34401 1 104 . 1 1 8 8 ARG HD3 H 1 3.164 0.020 . 1 . . . . A 8 ARG HD3 . 34401 1 105 . 1 1 8 8 ARG HE H 1 7.394 0.020 . 1 . . . . A 8 ARG HE . 34401 1 106 . 1 1 8 8 ARG CA C 13 57.913 0.3 . 1 . . . . A 8 ARG CA . 34401 1 107 . 1 1 8 8 ARG CB C 13 29.731 0.3 . 1 . . . . A 8 ARG CB . 34401 1 108 . 1 1 8 8 ARG CG C 13 27.277 0.3 . 1 . . . . A 8 ARG CG . 34401 1 109 . 1 1 8 8 ARG CD C 13 42.920 0.3 . 1 . . . . A 8 ARG CD . 34401 1 110 . 1 1 9 9 VAL H H 1 7.535 0.020 . 1 . . . . A 9 VAL H . 34401 1 111 . 1 1 9 9 VAL HA H 1 4.034 0.020 . 1 . . . . A 9 VAL HA . 34401 1 112 . 1 1 9 9 VAL HB H 1 2.295 0.020 . 1 . . . . A 9 VAL HB . 34401 1 113 . 1 1 9 9 VAL HG11 H 1 0.981 0.020 . 2 . . . . A 9 VAL HG11 . 34401 1 114 . 1 1 9 9 VAL HG12 H 1 0.981 0.020 . 2 . . . . A 9 VAL HG12 . 34401 1 115 . 1 1 9 9 VAL HG13 H 1 0.981 0.020 . 2 . . . . A 9 VAL HG13 . 34401 1 116 . 1 1 9 9 VAL HG21 H 1 1.063 0.020 . 2 . . . . A 9 VAL HG21 . 34401 1 117 . 1 1 9 9 VAL HG22 H 1 1.063 0.020 . 2 . . . . A 9 VAL HG22 . 34401 1 118 . 1 1 9 9 VAL HG23 H 1 1.063 0.020 . 2 . . . . A 9 VAL HG23 . 34401 1 119 . 1 1 9 9 VAL CA C 13 63.377 0.3 . 1 . . . . A 9 VAL CA . 34401 1 120 . 1 1 9 9 VAL CB C 13 31.492 0.3 . 1 . . . . A 9 VAL CB . 34401 1 121 . 1 1 9 9 VAL CG1 C 13 21.038 0.3 . 1 . . . . A 9 VAL CG1 . 34401 1 122 . 1 1 9 9 VAL CG2 C 13 20.974 0.3 . 1 . . . . A 9 VAL CG2 . 34401 1 123 . 1 1 10 10 LEU H H 1 7.376 0.020 . 1 . . . . A 10 LEU H . 34401 1 124 . 1 1 10 10 LEU HA H 1 4.202 0.020 . 1 . . . . A 10 LEU HA . 34401 1 125 . 1 1 10 10 LEU HB2 H 1 1.750 0.020 . 2 . . . . A 10 LEU HB2 . 34401 1 126 . 1 1 10 10 LEU HB3 H 1 1.550 0.020 . 2 . . . . A 10 LEU HB3 . 34401 1 127 . 1 1 10 10 LEU HG H 1 1.819 0.020 . 1 . . . . A 10 LEU HG . 34401 1 128 . 1 1 10 10 LEU HD11 H 1 0.858 0.020 . 2 . . . . A 10 LEU HD11 . 34401 1 129 . 1 1 10 10 LEU HD12 H 1 0.858 0.020 . 2 . . . . A 10 LEU HD12 . 34401 1 130 . 1 1 10 10 LEU HD13 H 1 0.858 0.020 . 2 . . . . A 10 LEU HD13 . 34401 1 131 . 1 1 10 10 LEU HD21 H 1 0.823 0.020 . 2 . . . . A 10 LEU HD21 . 34401 1 132 . 1 1 10 10 LEU HD22 H 1 0.823 0.020 . 2 . . . . A 10 LEU HD22 . 34401 1 133 . 1 1 10 10 LEU HD23 H 1 0.823 0.020 . 2 . . . . A 10 LEU HD23 . 34401 1 134 . 1 1 10 10 LEU CA C 13 54.741 0.3 . 1 . . . . A 10 LEU CA . 34401 1 135 . 1 1 10 10 LEU CB C 13 41.897 0.3 . 1 . . . . A 10 LEU CB . 34401 1 136 . 1 1 10 10 LEU CG C 13 26.308 0.3 . 1 . . . . A 10 LEU CG . 34401 1 137 . 1 1 10 10 LEU CD1 C 13 25.535 0.3 . 1 . . . . A 10 LEU CD1 . 34401 1 138 . 1 1 10 10 LEU CD2 C 13 22.590 0.3 . 1 . . . . A 10 LEU CD2 . 34401 1 139 . 1 1 11 11 LYS H H 1 7.690 0.020 . 1 . . . . A 11 LYS H . 34401 1 140 . 1 1 11 11 LYS HA H 1 4.149 0.020 . 1 . . . . A 11 LYS HA . 34401 1 141 . 1 1 11 11 LYS HB2 H 1 1.867 0.020 . 1 . . . . A 11 LYS HB2 . 34401 1 142 . 1 1 11 11 LYS HB3 H 1 1.867 0.020 . 1 . . . . A 11 LYS HB3 . 34401 1 143 . 1 1 11 11 LYS HG2 H 1 1.675 0.020 . 1 . . . . A 11 LYS HG2 . 34401 1 144 . 1 1 11 11 LYS HG3 H 1 1.675 0.020 . 1 . . . . A 11 LYS HG3 . 34401 1 145 . 1 1 11 11 LYS HD2 H 1 1.365 0.020 . 2 . . . . A 11 LYS HD2 . 34401 1 146 . 1 1 11 11 LYS HD3 H 1 1.409 0.020 . 2 . . . . A 11 LYS HD3 . 34401 1 147 . 1 1 11 11 LYS HE2 H 1 2.976 0.020 . 1 . . . . A 11 LYS HE2 . 34401 1 148 . 1 1 11 11 LYS HE3 H 1 2.976 0.020 . 1 . . . . A 11 LYS HE3 . 34401 1 149 . 1 1 11 11 LYS HZ1 H 1 7.584 0.020 . 1 . . . . A 11 LYS HZ1 . 34401 1 150 . 1 1 11 11 LYS HZ2 H 1 7.584 0.020 . 1 . . . . A 11 LYS HZ2 . 34401 1 151 . 1 1 11 11 LYS HZ3 H 1 7.584 0.020 . 1 . . . . A 11 LYS HZ3 . 34401 1 152 . 1 1 11 11 LYS CA C 13 55.758 0.3 . 1 . . . . A 11 LYS CA . 34401 1 153 . 1 1 11 11 LYS CB C 13 30.975 0.3 . 1 . . . . A 11 LYS CB . 34401 1 154 . 1 1 11 11 LYS CG C 13 28.701 0.3 . 1 . . . . A 11 LYS CG . 34401 1 155 . 1 1 11 11 LYS CD C 13 24.307 0.3 . 1 . . . . A 11 LYS CD . 34401 1 156 . 1 1 11 11 LYS CE C 13 41.795 0.3 . 1 . . . . A 11 LYS CE . 34401 1 157 . 1 1 12 12 LEU H H 1 7.892 0.020 . 1 . . . . A 12 LEU H . 34401 1 158 . 1 1 12 12 LEU HA H 1 4.288 0.020 . 1 . . . . A 12 LEU HA . 34401 1 159 . 1 1 12 12 LEU HB2 H 1 1.634 0.020 . 2 . . . . A 12 LEU HB2 . 34401 1 160 . 1 1 12 12 LEU HB3 H 1 1.556 0.020 . 2 . . . . A 12 LEU HB3 . 34401 1 161 . 1 1 12 12 LEU HG H 1 1.671 0.020 . 1 . . . . A 12 LEU HG . 34401 1 162 . 1 1 12 12 LEU HD11 H 1 0.896 0.020 . 2 . . . . A 12 LEU HD11 . 34401 1 163 . 1 1 12 12 LEU HD12 H 1 0.896 0.020 . 2 . . . . A 12 LEU HD12 . 34401 1 164 . 1 1 12 12 LEU HD13 H 1 0.896 0.020 . 2 . . . . A 12 LEU HD13 . 34401 1 165 . 1 1 12 12 LEU HD21 H 1 0.854 0.020 . 2 . . . . A 12 LEU HD21 . 34401 1 166 . 1 1 12 12 LEU HD22 H 1 0.854 0.020 . 2 . . . . A 12 LEU HD22 . 34401 1 167 . 1 1 12 12 LEU HD23 H 1 0.854 0.020 . 2 . . . . A 12 LEU HD23 . 34401 1 168 . 1 1 12 12 LEU CA C 13 54.018 0.3 . 1 . . . . A 12 LEU CA . 34401 1 169 . 1 1 12 12 LEU CB C 13 42.470 0.3 . 1 . . . . A 12 LEU CB . 34401 1 170 . 1 1 12 12 LEU CG C 13 26.545 0.3 . 1 . . . . A 12 LEU CG . 34401 1 171 . 1 1 12 12 LEU CD1 C 13 25.472 0.3 . 1 . . . . A 12 LEU CD1 . 34401 1 172 . 1 1 12 12 LEU CD2 C 13 23.078 0.3 . 1 . . . . A 12 LEU CD2 . 34401 1 stop_ save_