Content for NMR-STAR saveframe, "assigned_chemical_shifts_1"
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 30650
_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' . . . 30650 1
2 '2D 1H-1H NOESY' . . . 30650 1
3 '2D 1H-13C HSQC' . . . 30650 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 ILE H H 1 8.4870 0.0000 . 1 . . . . A 1 ILE H1 . 30650 1
2 . 1 . 1 1 1 ILE HA H 1 3.9690 0.0000 . 1 . . . . A 1 ILE HA . 30650 1
3 . 1 . 1 1 1 ILE HB H 1 2.0500 0.0000 . 1 . . . . A 1 ILE HB . 30650 1
4 . 1 . 1 1 1 ILE HG21 H 1 1.2200 0.0000 . 1 . . . . A 1 ILE HG21 . 30650 1
5 . 1 . 1 1 1 ILE HG22 H 1 1.2200 0.0000 . 1 . . . . A 1 ILE HG22 . 30650 1
6 . 1 . 1 1 1 ILE HG23 H 1 1.2200 0.0000 . 1 . . . . A 1 ILE HG23 . 30650 1
7 . 1 . 1 1 1 ILE HD11 H 1 1.2100 0.0000 . 1 . . . . A 1 ILE HD11 . 30650 1
8 . 1 . 1 1 1 ILE HD12 H 1 1.2100 0.0000 . 1 . . . . A 1 ILE HD12 . 30650 1
9 . 1 . 1 1 1 ILE HD13 H 1 1.2100 0.0000 . 1 . . . . A 1 ILE HD13 . 30650 1
10 . 1 . 1 1 1 ILE CA C 13 62.1500 0.0000 . 1 . . . . A 1 ILE CA . 30650 1
11 . 1 . 1 1 1 ILE CB C 13 38.5900 0.0000 . 1 . . . . A 1 ILE CB . 30650 1
12 . 1 . 1 2 2 ASN H H 1 7.7860 0.0000 . 1 . . . . A 2 ASN H . 30650 1
13 . 1 . 1 2 2 ASN HA H 1 5.2040 0.0000 . 1 . . . . A 2 ASN HA . 30650 1
14 . 1 . 1 2 2 ASN HB2 H 1 3.2800 0.0000 . 2 . . . . A 2 ASN HB2 . 30650 1
15 . 1 . 1 2 2 ASN HB3 H 1 2.9090 0.0000 . 2 . . . . A 2 ASN HB3 . 30650 1
16 . 1 . 1 2 2 ASN HD21 H 1 7.1090 0.0000 . 2 . . . . A 2 ASN HD21 . 30650 1
17 . 1 . 1 2 2 ASN HD22 H 1 7.2420 0.0000 . 2 . . . . A 2 ASN HD22 . 30650 1
18 . 1 . 1 2 2 ASN CB C 13 39.4400 0.0000 . 1 . . . . A 2 ASN CB . 30650 1
19 . 1 . 1 3 3 TRP H H 1 8.5220 0.0000 . 1 . . . . A 3 TRP H . 30650 1
20 . 1 . 1 3 3 TRP HA H 1 4.4000 0.0000 . 1 . . . . A 3 TRP HA . 30650 1
21 . 1 . 1 3 3 TRP HB2 H 1 3.5830 0.0000 . 1 . . . . A 3 TRP HB2 . 30650 1
22 . 1 . 1 3 3 TRP HB3 H 1 3.4300 0.0000 . 2 . . . . A 3 TRP HB3 . 30650 1
23 . 1 . 1 3 3 TRP HE1 H 1 10.1510 0.0000 . 1 . . . . A 3 TRP HE1 . 30650 1
24 . 1 . 1 3 3 TRP HE3 H 1 7.6310 0.0000 . 1 . . . . A 3 TRP HE3 . 30650 1
25 . 1 . 1 3 3 TRP HZ2 H 1 7.5300 0.0000 . 1 . . . . A 3 TRP HZ2 . 30650 1
26 . 1 . 1 3 3 TRP HH2 H 1 7.6310 0.0000 . 1 . . . . A 3 TRP HH2 . 30650 1
27 . 1 . 1 3 3 TRP CA C 13 55.9100 0.0000 . 1 . . . . A 3 TRP CA . 30650 1
28 . 1 . 1 3 3 TRP CZ2 C 13 111.0000 0.0000 . 1 . . . . A 3 TRP CZ2 . 30650 1
29 . 1 . 1 4 4 LEU H H 1 8.0890 0.0000 . 1 . . . . A 4 LEU H . 30650 1
30 . 1 . 1 4 4 LEU HA H 1 4.3430 0.0000 . 1 . . . . A 4 LEU HA . 30650 1
31 . 1 . 1 4 4 LEU HB2 H 1 2.0300 0.0000 . 2 . . . . A 4 LEU HB2 . 30650 1
32 . 1 . 1 4 4 LEU HB3 H 1 1.9500 0.0000 . 2 . . . . A 4 LEU HB3 . 30650 1
33 . 1 . 1 4 4 LEU HD11 H 1 1.1300 0.0000 . 2 . . . . A 4 LEU HD11 . 30650 1
34 . 1 . 1 4 4 LEU HD12 H 1 1.1300 0.0000 . 2 . . . . A 4 LEU HD12 . 30650 1
35 . 1 . 1 4 4 LEU HD13 H 1 1.1300 0.0000 . 2 . . . . A 4 LEU HD13 . 30650 1
36 . 1 . 1 4 4 LEU HD21 H 1 1.1100 0.0000 . 2 . . . . A 4 LEU HD21 . 30650 1
37 . 1 . 1 4 4 LEU HD22 H 1 1.1100 0.0000 . 2 . . . . A 4 LEU HD22 . 30650 1
38 . 1 . 1 4 4 LEU HD23 H 1 1.1100 0.0000 . 2 . . . . A 4 LEU HD23 . 30650 1
39 . 1 . 1 4 4 LEU CA C 13 55.9000 0.0000 . 1 . . . . A 4 LEU CA . 30650 1
40 . 1 . 1 4 4 LEU CB C 13 38.8800 0.0000 . 1 . . . . A 4 LEU CB . 30650 1
41 . 1 . 1 4 4 LEU CD1 C 13 22.4400 0.0000 . 2 . . . . A 4 LEU CD1 . 30650 1
42 . 1 . 1 4 4 LEU CD2 C 13 21.8600 0.0000 . 2 . . . . A 4 LEU CD2 . 30650 1
43 . 1 . 1 5 5 LYS H H 1 7.7880 0.0000 . 1 . . . . A 5 LYS H . 30650 1
44 . 1 . 1 5 5 LYS HA H 1 4.1520 0.0000 . 1 . . . . A 5 LYS HA . 30650 1
45 . 1 . 1 5 5 LYS HB2 H 1 2.0500 0.0000 . 2 . . . . A 5 LYS HB2 . 30650 1
46 . 1 . 1 5 5 LYS HB3 H 1 2.0100 0.0000 . 2 . . . . A 5 LYS HB3 . 30650 1
47 . 1 . 1 5 5 LYS HG2 H 1 1.5400 0.0000 . 2 . . . . A 5 LYS HG2 . 30650 1
48 . 1 . 1 5 5 LYS HG3 H 1 1.5400 0.0000 . 2 . . . . A 5 LYS HG3 . 30650 1
49 . 1 . 1 5 5 LYS HD2 H 1 1.8110 0.0000 . 2 . . . . A 5 LYS HD2 . 30650 1
50 . 1 . 1 5 5 LYS HD3 H 1 1.8100 0.0000 . 2 . . . . A 5 LYS HD3 . 30650 1
51 . 1 . 1 5 5 LYS HE2 H 1 3.2000 0.0000 . 2 . . . . A 5 LYS HE2 . 30650 1
52 . 1 . 1 5 5 LYS HE3 H 1 3.2000 0.0000 . 2 . . . . A 5 LYS HE3 . 30650 1
53 . 1 . 1 5 5 LYS CA C 13 61.1500 0.0000 . 1 . . . . A 5 LYS CA . 30650 1
54 . 1 . 1 5 5 LYS CB C 13 29.8000 0.0000 . 1 . . . . A 5 LYS CB . 30650 1
55 . 1 . 1 5 5 LYS CG C 13 24.8500 0.0000 . 1 . . . . A 5 LYS CG . 30650 1
56 . 1 . 1 5 5 LYS CD C 13 28.3300 0.0000 . 1 . . . . A 5 LYS CD . 30650 1
57 . 1 . 1 5 5 LYS CE C 13 39.5100 0.0000 . 1 . . . . A 5 LYS CE . 30650 1
58 . 1 . 1 6 6 LEU H H 1 8.0810 0.0000 . 1 . . . . A 6 LEU H . 30650 1
59 . 1 . 1 6 6 LEU HA H 1 4.4050 0.0000 . 1 . . . . A 6 LEU HA . 30650 1
60 . 1 . 1 6 6 LEU HB2 H 1 2.0500 0.0000 . 1 . . . . A 6 LEU HB2 . 30650 1
61 . 1 . 1 6 6 LEU HB3 H 1 1.9400 0.0000 . 1 . . . . A 6 LEU HB3 . 30650 1
62 . 1 . 1 6 6 LEU HD11 H 1 1.2800 0.0000 . 2 . . . . A 6 LEU HD11 . 30650 1
63 . 1 . 1 6 6 LEU HD12 H 1 1.2800 0.0000 . 2 . . . . A 6 LEU HD12 . 30650 1
64 . 1 . 1 6 6 LEU HD13 H 1 1.2800 0.0000 . 2 . . . . A 6 LEU HD13 . 30650 1
65 . 1 . 1 6 6 LEU HD21 H 1 1.2100 0.0000 . 2 . . . . A 6 LEU HD21 . 30650 1
66 . 1 . 1 6 6 LEU HD22 H 1 1.2100 0.0000 . 2 . . . . A 6 LEU HD22 . 30650 1
67 . 1 . 1 6 6 LEU HD23 H 1 1.2100 0.0000 . 2 . . . . A 6 LEU HD23 . 30650 1
68 . 1 . 1 6 6 LEU CA C 13 57.2300 0.0000 . 1 . . . . A 6 LEU CA . 30650 1
69 . 1 . 1 6 6 LEU CB C 13 39.0000 0.0000 . 1 . . . . A 6 LEU CB . 30650 1
70 . 1 . 1 6 6 LEU CD2 C 13 21.8100 0.0000 . 2 . . . . A 6 LEU CD2 . 30650 1
71 . 1 . 1 7 7 GLY H H 1 9.2000 0.0000 . 1 . . . . A 7 GLY H . 30650 1
72 . 1 . 1 7 7 GLY HA2 H 1 3.9900 0.0000 . 2 . . . . A 7 GLY HA2 . 30650 1
73 . 1 . 1 7 7 GLY HA3 H 1 3.9800 0.0000 . 2 . . . . A 7 GLY HA3 . 30650 1
74 . 1 . 1 7 7 GLY CA C 13 45.4900 0.0000 . 1 . . . . A 7 GLY CA . 30650 1
75 . 1 . 1 8 8 LYS H H 1 8.0400 0.0000 . 1 . . . . A 8 LYS H . 30650 1
76 . 1 . 1 8 8 LYS HA H 1 4.3900 0.0000 . 1 . . . . A 8 LYS HA . 30650 1
77 . 1 . 1 8 8 LYS HB2 H 1 2.3500 0.0000 . 2 . . . . A 8 LYS HB2 . 30650 1
78 . 1 . 1 8 8 LYS HB3 H 1 2.3200 0.0000 . 2 . . . . A 8 LYS HB3 . 30650 1
79 . 1 . 1 8 8 LYS HD2 H 1 2.0500 0.0000 . 2 . . . . A 8 LYS HD2 . 30650 1
80 . 1 . 1 8 8 LYS HD3 H 1 1.9900 0.0000 . 2 . . . . A 8 LYS HD3 . 30650 1
81 . 1 . 1 8 8 LYS HE2 H 1 3.1900 0.0000 . 2 . . . . A 8 LYS HE2 . 30650 1
82 . 1 . 1 8 8 LYS HE3 H 1 3.1900 0.0000 . 2 . . . . A 8 LYS HE3 . 30650 1
83 . 1 . 1 8 8 LYS CA C 13 57.3600 0.0000 . 1 . . . . A 8 LYS CA . 30650 1
84 . 1 . 1 8 8 LYS CB C 13 29.7500 0.0000 . 1 . . . . A 8 LYS CB . 30650 1
85 . 1 . 1 8 8 LYS CD C 13 29.8500 0.0000 . 1 . . . . A 8 LYS CD . 30650 1
86 . 1 . 1 8 8 LYS CE C 13 39.4800 0.0000 . 1 . . . . A 8 LYS CE . 30650 1
87 . 1 . 1 9 9 LYS H H 1 8.6690 0.0000 . 1 . . . . A 9 LYS H . 30650 1
88 . 1 . 1 9 9 LYS HA H 1 4.1950 0.0000 . 1 . . . . A 9 LYS HA . 30650 1
89 . 1 . 1 9 9 LYS HB2 H 1 2.1880 0.0000 . 1 . . . . A 9 LYS HB2 . 30650 1
90 . 1 . 1 9 9 LYS HB3 H 1 2.1740 0.0000 . 1 . . . . A 9 LYS HB3 . 30650 1
91 . 1 . 1 9 9 LYS HG2 H 1 1.7300 0.0000 . 1 . . . . A 9 LYS HG2 . 30650 1
92 . 1 . 1 9 9 LYS HG3 H 1 1.7200 0.0000 . 1 . . . . A 9 LYS HG3 . 30650 1
93 . 1 . 1 9 9 LYS HD2 H 1 1.9300 0.0000 . 1 . . . . A 9 LYS HD2 . 30650 1
94 . 1 . 1 9 9 LYS HD3 H 1 1.9300 0.0000 . 1 . . . . A 9 LYS HD3 . 30650 1
95 . 1 . 1 9 9 LYS HE2 H 1 3.2150 0.0000 . 1 . . . . A 9 LYS HE2 . 30650 1
96 . 1 . 1 9 9 LYS HE3 H 1 3.2150 0.0000 . 1 . . . . A 9 LYS HE3 . 30650 1
97 . 1 . 1 9 9 LYS CA C 13 57.6500 0.0000 . 1 . . . . A 9 LYS CA . 30650 1
98 . 1 . 1 9 9 LYS CB C 13 29.7500 0.0000 . 1 . . . . A 9 LYS CB . 30650 1
99 . 1 . 1 9 9 LYS CG C 13 23.0000 0.0000 . 1 . . . . A 9 LYS CG . 30650 1
100 . 1 . 1 9 9 LYS CD C 13 26.6700 0.0000 . 1 . . . . A 9 LYS CD . 30650 1
101 . 1 . 1 9 9 LYS CE C 13 39.5100 0.0000 . 1 . . . . A 9 LYS CE . 30650 1
102 . 1 . 1 10 10 ILE H H 1 8.4900 0.0000 . 1 . . . . A 10 ILE H . 30650 1
103 . 1 . 1 10 10 ILE HA H 1 3.8900 0.0000 . 1 . . . . A 10 ILE HA . 30650 1
104 . 1 . 1 10 10 ILE HB H 1 2.3400 0.0000 . 1 . . . . A 10 ILE HB . 30650 1
105 . 1 . 1 10 10 ILE HG21 H 1 1.1600 0.0000 . 1 . . . . A 10 ILE HG21 . 30650 1
106 . 1 . 1 10 10 ILE HG22 H 1 1.1600 0.0000 . 1 . . . . A 10 ILE HG22 . 30650 1
107 . 1 . 1 10 10 ILE HG23 H 1 1.1600 0.0000 . 1 . . . . A 10 ILE HG23 . 30650 1
108 . 1 . 1 10 10 ILE HD11 H 1 1.1300 0.0000 . 1 . . . . A 10 ILE HD11 . 30650 1
109 . 1 . 1 10 10 ILE HD12 H 1 1.1300 0.0000 . 1 . . . . A 10 ILE HD12 . 30650 1
110 . 1 . 1 10 10 ILE HD13 H 1 1.1300 0.0000 . 1 . . . . A 10 ILE HD13 . 30650 1
111 . 1 . 1 10 10 ILE CA C 13 62.7600 0.0000 . 1 . . . . A 10 ILE CA . 30650 1
112 . 1 . 1 10 10 ILE CB C 13 38.8900 0.0000 . 1 . . . . A 10 ILE CB . 30650 1
113 . 1 . 1 10 10 ILE CG2 C 13 15.0500 0.0000 . 1 . . . . A 10 ILE CG2 . 30650 1
114 . 1 . 1 10 10 ILE CD1 C 13 10.7600 0.0000 . 1 . . . . A 10 ILE CD1 . 30650 1
115 . 1 . 1 11 11 ILE H H 1 8.4500 0.0000 . 1 . . . . A 11 ILE H . 30650 1
116 . 1 . 1 11 11 ILE HA H 1 3.9690 0.0000 . 1 . . . . A 11 ILE HA . 30650 1
117 . 1 . 1 11 11 ILE HB H 1 2.2110 0.0000 . 1 . . . . A 11 ILE HB . 30650 1
118 . 1 . 1 11 11 ILE HG21 H 1 1.2200 0.0000 . 1 . . . . A 11 ILE HG21 . 30650 1
119 . 1 . 1 11 11 ILE HG22 H 1 1.2200 0.0000 . 1 . . . . A 11 ILE HG22 . 30650 1
120 . 1 . 1 11 11 ILE HG23 H 1 1.2200 0.0000 . 1 . . . . A 11 ILE HG23 . 30650 1
121 . 1 . 1 11 11 ILE HD11 H 1 1.2100 0.0000 . 1 . . . . A 11 ILE HD11 . 30650 1
122 . 1 . 1 11 11 ILE HD12 H 1 1.2100 0.0000 . 1 . . . . A 11 ILE HD12 . 30650 1
123 . 1 . 1 11 11 ILE HD13 H 1 1.2100 0.0000 . 1 . . . . A 11 ILE HD13 . 30650 1
124 . 1 . 1 11 11 ILE CA C 13 62.1500 0.0000 . 1 . . . . A 11 ILE CA . 30650 1
125 . 1 . 1 11 11 ILE CG2 C 13 21.7000 0.0000 . 1 . . . . A 11 ILE CG2 . 30650 1
126 . 1 . 1 11 11 ILE CD1 C 13 15.0000 0.0000 . 1 . . . . A 11 ILE CD1 . 30650 1
127 . 1 . 1 12 12 ALA H H 1 8.3520 0.0000 . 1 . . . . A 12 ALA H . 30650 1
128 . 1 . 1 12 12 ALA HA H 1 4.4110 0.0000 . 1 . . . . A 12 ALA HA . 30650 1
129 . 1 . 1 12 12 ALA HB1 H 1 1.7810 0.0000 . 1 . . . . A 12 ALA HB1 . 30650 1
130 . 1 . 1 12 12 ALA HB2 H 1 1.7810 0.0000 . 1 . . . . A 12 ALA HB2 . 30650 1
131 . 1 . 1 12 12 ALA HB3 H 1 1.7810 0.0000 . 1 . . . . A 12 ALA HB3 . 30650 1
132 . 1 . 1 12 12 ALA CA C 13 51.9500 0.0000 . 1 . . . . A 12 ALA CA . 30650 1
133 . 1 . 1 12 12 ALA CB C 13 16.0700 0.0000 . 1 . . . . A 12 ALA CB . 30650 1
134 . 1 . 1 13 13 SER H H 1 8.0600 0.0000 . 1 . . . . A 13 SER H . 30650 1
135 . 1 . 1 13 13 SER HA H 1 4.6200 0.0000 . 1 . . . . A 13 SER HA . 30650 1
136 . 1 . 1 13 13 SER HB2 H 1 4.2800 0.0000 . 2 . . . . A 13 SER HB2 . 30650 1
137 . 1 . 1 13 13 SER HB3 H 1 4.2090 0.0000 . 2 . . . . A 13 SER HB3 . 30650 1
138 . 1 . 1 13 13 SER CA C 13 58.2900 0.0000 . 1 . . . . A 13 SER CA . 30650 1
139 . 1 . 1 13 13 SER CB C 13 61.0000 0.0000 . 1 . . . . A 13 SER CB . 30650 1
140 . 1 . 1 14 14 LEU H H 1 8.0200 0.0000 . 1 . . . . A 14 LEU H . 30650 1
141 . 1 . 1 14 14 LEU HA H 1 4.5210 0.0000 . 1 . . . . A 14 LEU HA . 30650 1
142 . 1 . 1 14 14 LEU HB2 H 1 2.1500 0.0000 . 2 . . . . A 14 LEU HB2 . 30650 1
143 . 1 . 1 14 14 LEU HB3 H 1 2.0600 0.0000 . 2 . . . . A 14 LEU HB3 . 30650 1
144 . 1 . 1 14 14 LEU HG H 1 1.8100 0.0000 . 1 . . . . A 14 LEU HG . 30650 1
145 . 1 . 1 14 14 LEU HD11 H 1 1.1300 0.0000 . 2 . . . . A 14 LEU HD11 . 30650 1
146 . 1 . 1 14 14 LEU HD12 H 1 1.1300 0.0000 . 2 . . . . A 14 LEU HD12 . 30650 1
147 . 1 . 1 14 14 LEU HD13 H 1 1.1300 0.0000 . 2 . . . . A 14 LEU HD13 . 30650 1
148 . 1 . 1 14 14 LEU HD21 H 1 1.1200 0.0000 . 2 . . . . A 14 LEU HD21 . 30650 1
149 . 1 . 1 14 14 LEU HD22 H 1 1.1200 0.0000 . 2 . . . . A 14 LEU HD22 . 30650 1
150 . 1 . 1 14 14 LEU HD23 H 1 1.1200 0.0000 . 2 . . . . A 14 LEU HD23 . 30650 1
151 . 1 . 1 14 14 LEU CA C 13 53.0600 0.0000 . 1 . . . . A 14 LEU CA . 30650 1
152 . 1 . 1 14 14 LEU CB C 13 39.2100 0.0000 . 1 . . . . A 14 LEU CB . 30650 1
153 . 1 . 1 14 14 LEU CD1 C 13 23.3000 0.0000 . 2 . . . . A 14 LEU CD1 . 30650 1
154 . 1 . 1 14 14 LEU CD2 C 13 22.4400 0.0000 . 2 . . . . A 14 LEU CD2 . 30650 1
stop_
save_