################################### # 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 15973 _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 0.01 _Assigned_chem_shift_list.Chem_shift_13C_err 0.2 _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 2 '2D DQF-COSY' . . . 15973 1 3 '2D 1H-1H TOCSY' . . . 15973 1 6 '2D 1H-13C HSQC' . . . 15973 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $SPARKY . . 15973 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 VAL HA H 1 4.000 0.01 . 1 . . . . 1 V HA . 15973 1 2 . 1 1 1 1 VAL HB H 1 2.052 0.01 . 1 . . . . 1 V HB . 15973 1 3 . 1 1 1 1 VAL HG11 H 1 0.790 0.01 . . . . . . 1 V HG1# . 15973 1 4 . 1 1 1 1 VAL HG12 H 1 0.790 0.01 . . . . . . 1 V HG1# . 15973 1 5 . 1 1 1 1 VAL HG13 H 1 0.790 0.01 . . . . . . 1 V HG1# . 15973 1 6 . 1 1 1 1 VAL HG21 H 1 0.820 0.01 . . . . . . 1 V HG2# . 15973 1 7 . 1 1 1 1 VAL HG22 H 1 0.820 0.01 . . . . . . 1 V HG2# . 15973 1 8 . 1 1 1 1 VAL HG23 H 1 0.820 0.01 . . . . . . 1 V HG2# . 15973 1 9 . 1 1 1 1 VAL CA C 13 58.192 0.2 . 1 . . . . 1 V CA . 15973 1 10 . 1 1 1 1 VAL CB C 13 30.850 0.2 . 1 . . . . 1 V CB . 15973 1 11 . 1 1 1 1 VAL CG1 C 13 17.433 0.2 . 2 . . . . 1 V CG1 . 15973 1 12 . 1 1 1 1 VAL CG2 C 13 18.220 0.2 . 2 . . . . 1 V CG2 . 15973 1 13 . 1 1 2 2 ASN H H 1 7.137 0.01 . 1 . . . . 2 N HN . 15973 1 14 . 1 1 2 2 ASN HA H 1 5.077 0.01 . 1 . . . . 2 N HA . 15973 1 15 . 1 1 2 2 ASN HB2 H 1 2.583 0.01 . . . . . . 2 N HB# . 15973 1 16 . 1 1 2 2 ASN HB3 H 1 2.583 0.01 . . . . . . 2 N HB# . 15973 1 17 . 1 1 2 2 ASN HD21 H 1 7.541 0.01 . 2 . . . . 2 N HD21 . 15973 1 18 . 1 1 2 2 ASN HD22 H 1 6.845 0.01 . 2 . . . . 2 N HD22 . 15973 1 19 . 1 1 2 2 ASN CA C 13 50.039 0.2 . 1 . . . . 2 N CA . 15973 1 20 . 1 1 2 2 ASN CB C 13 38.600 0.2 . 1 . . . . 2 N CB . 15973 1 21 . 1 1 3 3 TRP H H 1 8.538 0.01 . 1 . . . . 3 W HN . 15973 1 22 . 1 1 3 3 TRP HA H 1 4.523 0.01 . 1 . . . . 3 W HA . 15973 1 23 . 1 1 3 3 TRP HB2 H 1 2.320 0.01 . . . . . . 3 W HB1 . 15973 1 24 . 1 1 3 3 TRP HB3 H 1 2.875 0.01 . 2 . . . . 3 W HB2 . 15973 1 25 . 1 1 3 3 TRP HD1 H 1 6.765 0.01 . 1 . . . . 3 W HD1 . 15973 1 26 . 1 1 3 3 TRP HE1 H 1 9.754 0.01 . 1 . . . . 3 W HE1 . 15973 1 27 . 1 1 3 3 TRP HE3 H 1 5.769 0.01 . 1 . . . . 3 W HE3 . 15973 1 28 . 1 1 3 3 TRP HH2 H 1 6.856 0.01 . 1 . . . . 3 W HH2 . 15973 1 29 . 1 1 3 3 TRP HZ2 H 1 7.105 0.01 . 1 . . . . 3 W HZ2 . 15973 1 30 . 1 1 3 3 TRP HZ3 H 1 6.380 0.01 . 1 . . . . 3 W HZ3 . 15973 1 31 . 1 1 3 3 TRP CA C 13 53.668 0.2 . 1 . . . . 3 W CA . 15973 1 32 . 1 1 3 3 TRP CB C 13 26.677 0.2 . 1 . . . . 3 W CB . 15973 1 33 . 1 1 3 3 TRP CD1 C 13 124.082 0.2 . 1 . . . . 3 W CD1 . 15973 1 34 . 1 1 3 3 TRP CE3 C 13 117.629 0.2 . 1 . . . . 3 W CE3 . 15973 1 35 . 1 1 3 3 TRP CH2 C 13 121.476 0.2 . 1 . . . . 3 W CH2 . 15973 1 36 . 1 1 3 3 TRP CZ2 C 13 111.621 0.2 . 1 . . . . 3 W CZ2 . 15973 1 37 . 1 1 3 3 TRP CZ3 C 13 118.480 0.2 . 1 . . . . 3 W CZ3 . 15973 1 38 . 1 1 4 4 VAL H H 1 8.162 0.01 . 1 . . . . 4 V HN . 15973 1 39 . 1 1 4 4 VAL HA H 1 3.925 0.01 . 1 . . . . 4 V HA . 15973 1 40 . 1 1 4 4 VAL HB H 1 1.590 0.01 . 1 . . . . 4 V HB . 15973 1 41 . 1 1 4 4 VAL HG11 H 1 0.644 0.01 . . . . . . 4 V HG1# . 15973 1 42 . 1 1 4 4 VAL HG12 H 1 0.644 0.01 . . . . . . 4 V HG1# . 15973 1 43 . 1 1 4 4 VAL HG13 H 1 0.644 0.01 . . . . . . 4 V HG1# . 15973 1 44 . 1 1 4 4 VAL HG21 H 1 0.439 0.01 . . . . . . 4 V HG2# . 15973 1 45 . 1 1 4 4 VAL HG22 H 1 0.439 0.01 . . . . . . 4 V HG2# . 15973 1 46 . 1 1 4 4 VAL HG23 H 1 0.439 0.01 . . . . . . 4 V HG2# . 15973 1 47 . 1 1 4 4 VAL CA C 13 58.544 0.2 . 1 . . . . 4 V CA . 15973 1 48 . 1 1 4 4 VAL CB C 13 31.896 0.2 . 1 . . . . 4 V CB . 15973 1 49 . 1 1 4 4 VAL CG1 C 13 18.507 0.2 . 2 . . . . 4 V CG1 . 15973 1 50 . 1 1 4 4 VAL CG2 C 13 18.655 0.2 . 2 . . . . 4 V CG2 . 15973 1 51 . 1 1 5 5 CYS H H 1 8.086 0.01 . 1 . . . . 5 C HN . 15973 1 52 . 1 1 5 5 CYS HA H 1 4.588 0.01 . 1 . . . . 5 C HA . 15973 1 53 . 1 1 5 5 CYS HB2 H 1 2.592 0.01 . . . . . . 5 C HB# . 15973 1 54 . 1 1 5 5 CYS HB3 H 1 2.592 0.01 . . . . . . 5 C HB# . 15973 1 55 . 1 1 5 5 CYS CA C 13 52.125 0.2 . 1 . . . . 5 C CA . 15973 1 56 . 1 1 5 5 CYS CB C 13 42.385 0.2 . 1 . . . . 5 C CB . 15973 1 57 . 1 1 6 6 PHE H H 1 8.249 0.01 . 1 . . . . 6 F HN . 15973 1 58 . 1 1 6 6 PHE HA H 1 4.605 0.01 . 1 . . . . 6 F HA . 15973 1 59 . 1 1 6 6 PHE HB2 H 1 3.070 0.01 . . . . . . 6 F HB1 . 15973 1 60 . 1 1 6 6 PHE HB3 H 1 2.686 0.01 . 2 . . . . 6 F HB2 . 15973 1 61 . 1 1 6 6 PHE HD1 H 1 7.090 0.01 . . . . . . 6 F HD# . 15973 1 62 . 1 1 6 6 PHE HD2 H 1 7.090 0.01 . . . . . . 6 F HD# . 15973 1 63 . 1 1 6 6 PHE HE1 H 1 6.860 0.01 . . . . . . 6 F HE# . 15973 1 64 . 1 1 6 6 PHE HE2 H 1 6.860 0.01 . . . . . . 6 F HE# . 15973 1 65 . 1 1 6 6 PHE HZ H 1 6.380 0.01 . 1 . . . . 6 F HZ . 15973 1 66 . 1 1 6 6 PHE CA C 13 53.930 0.2 . 1 . . . . 6 F CA . 15973 1 67 . 1 1 6 6 PHE CB C 13 38.201 0.2 . 1 . . . . 6 F CB . 15973 1 68 . 1 1 6 6 PHE CD1 C 13 129.144 0.2 . . . . . . 6 F CD . 15973 1 69 . 1 1 6 6 PHE CD2 C 13 129.144 0.2 . . . . . . 6 F CD . 15973 1 70 . 1 1 6 6 PHE CE1 C 13 128.605 0.2 . . . . . . 6 F CE . 15973 1 71 . 1 1 6 6 PHE CE2 C 13 128.605 0.2 . . . . . . 6 F CE . 15973 1 72 . 1 1 6 6 PHE CZ C 13 127.143 0.2 . 1 . . . . 6 F CZ . 15973 1 73 . 1 1 7 7 ARG H H 1 7.090 0.01 . 1 . . . . 7 R HN . 15973 1 74 . 1 1 7 7 ARG HA H 1 3.869 0.01 . 1 . . . . 7 R HA . 15973 1 75 . 1 1 7 7 ARG HB2 H 1 1.650 0.01 . . . . . . 7 R HB# . 15973 1 76 . 1 1 7 7 ARG HB3 H 1 1.650 0.01 . . . . . . 7 R HB# . 15973 1 77 . 1 1 7 7 ARG HD2 H 1 3.030 0.01 . . . . . . 7 R HD# . 15973 1 78 . 1 1 7 7 ARG HD3 H 1 3.030 0.01 . . . . . . 7 R HD# . 15973 1 79 . 1 1 7 7 ARG HG2 H 1 1.403 0.01 . . . . . . 7 R HG# . 15973 1 80 . 1 1 7 7 ARG HG3 H 1 1.403 0.01 . . . . . . 7 R HG# . 15973 1 81 . 1 1 7 7 ARG CA C 13 55.083 0.2 . 1 . . . . 7 R CA . 15973 1 82 . 1 1 7 7 ARG CB C 13 27.344 0.2 . 1 . . . . 7 R CB . 15973 1 83 . 1 1 7 7 ARG CD C 13 40.500 0.2 . 1 . . . . 7 R CD . 15973 1 84 . 1 1 7 7 ARG CG C 13 24.105 0.2 . 1 . . . . 7 R CG . 15973 1 85 . 1 1 8 8 ASP H H 1 8.615 0.01 . 1 . . . . 8 D HN . 15973 1 86 . 1 1 8 8 ASP HA H 1 4.310 0.01 . 1 . . . . 8 D HA . 15973 1 87 . 1 1 8 8 ASP HB2 H 1 2.690 0.01 . . . . . . 8 D HB1 . 15973 1 88 . 1 1 8 8 ASP HB3 H 1 2.760 0.01 . 2 . . . . 8 D HB2 . 15973 1 89 . 1 1 8 8 ASP CA C 13 53.550 0.2 . 1 . . . . 8 D CA . 15973 1 90 . 1 1 8 8 ASP CB C 13 37.401 0.2 . 1 . . . . 8 D CB . 15973 1 91 . 1 1 9 9 VAL H H 1 7.801 0.01 . 1 . . . . 9 V HN . 15973 1 92 . 1 1 9 9 VAL HA H 1 4.119 0.01 . 1 . . . . 9 V HA . 15973 1 93 . 1 1 9 9 VAL HB H 1 2.050 0.01 . 1 . . . . 9 V HB . 15973 1 94 . 1 1 9 9 VAL HG11 H 1 0.790 0.01 . . . . . . 9 V HG1# . 15973 1 95 . 1 1 9 9 VAL HG12 H 1 0.790 0.01 . . . . . . 9 V HG1# . 15973 1 96 . 1 1 9 9 VAL HG13 H 1 0.790 0.01 . . . . . . 9 V HG1# . 15973 1 97 . 1 1 9 9 VAL HG21 H 1 0.784 0.01 . . . . . . 9 V HG2# . 15973 1 98 . 1 1 9 9 VAL HG22 H 1 0.784 0.01 . . . . . . 9 V HG2# . 15973 1 99 . 1 1 9 9 VAL HG23 H 1 0.784 0.01 . . . . . . 9 V HG2# . 15973 1 100 . 1 1 9 9 VAL CA C 13 59.984 0.2 . 1 . . . . 9 V CA . 15973 1 101 . 1 1 9 9 VAL CB C 13 30.350 0.2 . 1 . . . . 9 V CB . 15973 1 102 . 1 1 9 9 VAL CG1 C 13 16.973 0.2 . 2 . . . . 9 V CG1 . 15973 1 103 . 1 1 9 9 VAL CG2 C 13 17.950 0.2 . 2 . . . . 9 V CG2 . 15973 1 104 . 1 1 10 10 GLY H H 1 7.875 0.01 . 1 . . . . 10 G HN . 15973 1 105 . 1 1 10 10 GLY HA2 H 1 4.196 0.01 . . . . . . 10 G HA1 . 15973 1 106 . 1 1 10 10 GLY HA3 H 1 3.702 0.01 . 2 . . . . 10 G HA2 . 15973 1 107 . 1 1 10 10 GLY CA C 13 41.802 0.2 . 1 . . . . 10 G CA . 15973 1 108 . 1 1 11 11 CYS H H 1 8.204 0.01 . 1 . . . . 11 C HN . 15973 1 109 . 1 1 11 11 CYS HA H 1 4.948 0.01 . 1 . . . . 11 C HA . 15973 1 110 . 1 1 11 11 CYS HB2 H 1 1.565 0.01 . . . . . . 11 C HB1 . 15973 1 111 . 1 1 11 11 CYS HB3 H 1 2.540 0.01 . 2 . . . . 11 C HB2 . 15973 1 112 . 1 1 11 11 CYS CA C 13 52.573 0.2 . 1 . . . . 11 C CA . 15973 1 113 . 1 1 12 12 ASP H H 1 8.049 0.01 . 1 . . . . 12 D HN . 15973 1 114 . 1 1 12 12 ASP HA H 1 4.180 0.01 . 1 . . . . 12 D HA . 15973 1 115 . 1 1 12 12 ASP HB2 H 1 2.365 0.01 . . . . . . 12 D HB# . 15973 1 116 . 1 1 12 12 ASP HB3 H 1 2.365 0.01 . . . . . . 12 D HB# . 15973 1 117 . 1 1 12 12 ASP CA C 13 50.343 0.2 . 1 . . . . 12 D CA . 15973 1 118 . 1 1 12 12 ASP CB C 13 40.437 0.2 . 1 . . . . 12 D CB . 15973 1 119 . 1 1 13 13 TRP H H 1 8.434 0.01 . 1 . . . . 13 W HN . 15973 1 120 . 1 1 13 13 TRP HA H 1 4.980 0.01 . 1 . . . . 13 W HA . 15973 1 121 . 1 1 13 13 TRP HB2 H 1 2.984 0.01 . . . . . . 13 W HB# . 15973 1 122 . 1 1 13 13 TRP HB3 H 1 2.984 0.01 . . . . . . 13 W HB# . 15973 1 123 . 1 1 13 13 TRP HD1 H 1 7.301 0.01 . 1 . . . . 13 W HD1 . 15973 1 124 . 1 1 13 13 TRP HE1 H 1 10.013 0.01 . 1 . . . . 13 W HE1 . 15973 1 125 . 1 1 13 13 TRP HE3 H 1 7.343 0.01 . 1 . . . . 13 W HE3 . 15973 1 126 . 1 1 13 13 TRP HH2 H 1 7.002 0.01 . 1 . . . . 13 W HH2 . 15973 1 127 . 1 1 13 13 TRP HZ2 H 1 7.161 0.01 . 1 . . . . 13 W HZ2 . 15973 1 128 . 1 1 13 13 TRP HZ3 H 1 7.030 0.01 . 1 . . . . 13 W HZ3 . 15973 1 129 . 1 1 13 13 TRP CA C 13 53.564 0.2 . 1 . . . . 13 W CA . 15973 1 130 . 1 1 13 13 TRP CB C 13 27.460 0.2 . 1 . . . . 13 W CB . 15973 1 131 . 1 1 13 13 TRP CD1 C 13 124.884 0.2 . 1 . . . . 13 W CD1 . 15973 1 132 . 1 1 13 13 TRP CE3 C 13 117.848 0.2 . 1 . . . . 13 W CE3 . 15973 1 133 . 1 1 13 13 TRP CH2 C 13 121.768 0.2 . 1 . . . . 13 W CH2 . 15973 1 134 . 1 1 13 13 TRP CZ2 C 13 112.215 0.2 . 1 . . . . 13 W CZ2 . 15973 1 135 . 1 1 13 13 TRP CZ3 C 13 119.419 0.2 . 1 . . . . 13 W CZ3 . 15973 1 136 . 1 1 14 14 VAL H H 1 8.812 0.01 . 1 . . . . 14 V HN . 15973 1 137 . 1 1 14 14 VAL HA H 1 4.235 0.01 . 1 . . . . 14 V HA . 15973 1 138 . 1 1 14 14 VAL HB H 1 1.960 0.01 . 1 . . . . 14 V HB . 15973 1 139 . 1 1 14 14 VAL HG11 H 1 0.840 0.01 . . . . . . 14 V HG1# . 15973 1 140 . 1 1 14 14 VAL HG12 H 1 0.840 0.01 . . . . . . 14 V HG1# . 15973 1 141 . 1 1 14 14 VAL HG13 H 1 0.840 0.01 . . . . . . 14 V HG1# . 15973 1 142 . 1 1 14 14 VAL HG21 H 1 0.785 0.01 . . . . . . 14 V HG2# . 15973 1 143 . 1 1 14 14 VAL HG22 H 1 0.785 0.01 . . . . . . 14 V HG2# . 15973 1 144 . 1 1 14 14 VAL HG23 H 1 0.785 0.01 . . . . . . 14 V HG2# . 15973 1 145 . 1 1 14 14 VAL CA C 13 58.677 0.2 . 1 . . . . 14 V CA . 15973 1 146 . 1 1 14 14 VAL CB C 13 31.494 0.2 . 1 . . . . 14 V CB . 15973 1 147 . 1 1 14 14 VAL CG1 C 13 18.260 0.2 . 2 . . . . 14 V CG1 . 15973 1 148 . 1 1 14 14 VAL CG2 C 13 18.510 0.2 . 2 . . . . 14 V CG2 . 15973 1 149 . 1 1 15 15 LEU H H 1 8.036 0.01 . 1 . . . . 15 L HN . 15973 1 150 . 1 1 15 15 LEU HA H 1 4.035 0.01 . 1 . . . . 15 L HA . 15973 1 151 . 1 1 15 15 LEU HB2 H 1 1.494 0.01 . . . . . . 15 L HB# . 15973 1 152 . 1 1 15 15 LEU HB3 H 1 1.494 0.01 . . . . . . 15 L HB# . 15973 1 153 . 1 1 15 15 LEU HD11 H 1 0.849 0.01 . . . . . . 15 L HD1# . 15973 1 154 . 1 1 15 15 LEU HD12 H 1 0.849 0.01 . . . . . . 15 L HD1# . 15973 1 155 . 1 1 15 15 LEU HD13 H 1 0.849 0.01 . . . . . . 15 L HD1# . 15973 1 156 . 1 1 15 15 LEU HD21 H 1 0.802 0.01 . . . . . . 15 L HD2# . 15973 1 157 . 1 1 15 15 LEU HD22 H 1 0.802 0.01 . . . . . . 15 L HD2# . 15973 1 158 . 1 1 15 15 LEU HD23 H 1 0.802 0.01 . . . . . . 15 L HD2# . 15973 1 159 . 1 1 15 15 LEU HG H 1 1.558 0.01 . 1 . . . . 15 L HG . 15973 1 160 . 1 1 15 15 LEU CA C 13 54.752 0.2 . 1 . . . . 15 L CA . 15973 1 161 . 1 1 15 15 LEU CB C 13 40.222 0.2 . 1 . . . . 15 L CB . 15973 1 162 . 1 1 15 15 LEU CD1 C 13 22.337 0.2 . 2 . . . . 15 L CD1 . 15973 1 163 . 1 1 15 15 LEU CD2 C 13 21.132 0.2 . 2 . . . . 15 L CD2 . 15973 1 164 . 1 1 15 15 LEU CG C 13 24.800 0.2 . 1 . . . . 15 L CG . 15973 1 stop_ save_