Content for NMR-STAR saveframe, "assigned_chemical_shifts_one"
save_assigned_chemical_shifts_one
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_one
_Assigned_chem_shift_list.Entry_ID 4180
_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_one
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_one
_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 $sample_one . 4180 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 ARG H H 1 8.33 . . 1 . . . . . . . . 4180 1
2 . 1 1 1 1 ARG HA H 1 4.27 . . 1 . . . . . . . . 4180 1
3 . 1 1 1 1 ARG HB2 H 1 1.84 . . 2 . . . . . . . . 4180 1
4 . 1 1 1 1 ARG HB3 H 1 1.77 . . 2 . . . . . . . . 4180 1
5 . 1 1 1 1 ARG HG2 H 1 1.67 . . 1 . . . . . . . . 4180 1
6 . 1 1 1 1 ARG HG3 H 1 1.67 . . 1 . . . . . . . . 4180 1
7 . 1 1 1 1 ARG HD2 H 1 3.23 . . 1 . . . . . . . . 4180 1
8 . 1 1 1 1 ARG HD3 H 1 3.23 . . 1 . . . . . . . . 4180 1
9 . 1 1 1 1 ARG HE H 1 7.25 . . 1 . . . . . . . . 4180 1
10 . 1 1 2 2 GLU H H 1 8.65 . . 1 . . . . . . . . 4180 1
11 . 1 1 2 2 GLU HA H 1 4.30 . . 1 . . . . . . . . 4180 1
12 . 1 1 2 2 GLU HB2 H 1 2.06 . . 2 . . . . . . . . 4180 1
13 . 1 1 2 2 GLU HB3 H 1 1.97 . . 2 . . . . . . . . 4180 1
14 . 1 1 2 2 GLU HG2 H 1 2.28 . . 1 . . . . . . . . 4180 1
15 . 1 1 2 2 GLU HG3 H 1 2.28 . . 1 . . . . . . . . 4180 1
16 . 1 1 3 3 LYS H H 1 8.36 . . 1 . . . . . . . . 4180 1
17 . 1 1 3 3 LYS HA H 1 4.36 . . 1 . . . . . . . . 4180 1
18 . 1 1 3 3 LYS HB2 H 1 1.87 . . 2 . . . . . . . . 4180 1
19 . 1 1 3 3 LYS HB3 H 1 1.81 . . 2 . . . . . . . . 4180 1
20 . 1 1 3 3 LYS HG2 H 1 1.46 . . 1 . . . . . . . . 4180 1
21 . 1 1 3 3 LYS HG3 H 1 1.46 . . 1 . . . . . . . . 4180 1
22 . 1 1 3 3 LYS HD2 H 1 1.70 . . 1 . . . . . . . . 4180 1
23 . 1 1 3 3 LYS HD3 H 1 1.70 . . 1 . . . . . . . . 4180 1
24 . 1 1 3 3 LYS HE2 H 1 3.03 . . 1 . . . . . . . . 4180 1
25 . 1 1 3 3 LYS HE3 H 1 3.03 . . 1 . . . . . . . . 4180 1
26 . 1 1 4 4 GLY H H 1 8.40 . . 1 . . . . . . . . 4180 1
27 . 1 1 4 4 GLY HA2 H 1 3.97 . . 1 . . . . . . . . 4180 1
28 . 1 1 4 4 GLY HA3 H 1 3.97 . . 1 . . . . . . . . 4180 1
29 . 1 1 5 5 VAL H H 1 7.92 . . 1 . . . . . . . . 4180 1
30 . 1 1 5 5 VAL HA H 1 4.13 . . 1 . . . . . . . . 4180 1
31 . 1 1 5 5 VAL HB H 1 2.07 . . 1 . . . . . . . . 4180 1
32 . 1 1 5 5 VAL HG11 H 1 0.97 . . 1 . . . . . . . . 4180 1
33 . 1 1 5 5 VAL HG12 H 1 0.97 . . 1 . . . . . . . . 4180 1
34 . 1 1 5 5 VAL HG13 H 1 0.97 . . 1 . . . . . . . . 4180 1
35 . 1 1 5 5 VAL HG21 H 1 0.97 . . 1 . . . . . . . . 4180 1
36 . 1 1 5 5 VAL HG22 H 1 0.97 . . 1 . . . . . . . . 4180 1
37 . 1 1 5 5 VAL HG23 H 1 0.97 . . 1 . . . . . . . . 4180 1
38 . 1 1 6 6 ASP H H 1 8.44 . . 1 . . . . . . . . 4180 1
39 . 1 1 6 6 ASP HA H 1 4.65 . . 1 . . . . . . . . 4180 1
40 . 1 1 6 6 ASP HB2 H 1 2.76 . . 2 . . . . . . . . 4180 1
41 . 1 1 6 6 ASP HB3 H 1 2.59 . . 2 . . . . . . . . 4180 1
42 . 1 1 7 7 ILE H H 1 8.14 . . 1 . . . . . . . . 4180 1
43 . 1 1 7 7 ILE HA H 1 4.14 . . 1 . . . . . . . . 4180 1
44 . 1 1 7 7 ILE HB H 1 1.82 . . 1 . . . . . . . . 4180 1
45 . 1 1 7 7 ILE HG12 H 1 1.44 . . 2 . . . . . . . . 4180 1
46 . 1 1 7 7 ILE HG13 H 1 1.24 . . 2 . . . . . . . . 4180 1
47 . 1 1 7 7 ILE HG21 H 1 0.93 . . 1 . . . . . . . . 4180 1
48 . 1 1 7 7 ILE HG22 H 1 0.93 . . 1 . . . . . . . . 4180 1
49 . 1 1 7 7 ILE HG23 H 1 0.93 . . 1 . . . . . . . . 4180 1
50 . 1 1 7 7 ILE HD11 H 1 0.93 . . 1 . . . . . . . . 4180 1
51 . 1 1 7 7 ILE HD12 H 1 0.93 . . 1 . . . . . . . . 4180 1
52 . 1 1 7 7 ILE HD13 H 1 0.93 . . 1 . . . . . . . . 4180 1
53 . 1 1 8 8 ARG H H 1 8.37 . . 1 . . . . . . . . 4180 1
54 . 1 1 8 8 ARG HA H 1 4.29 . . 1 . . . . . . . . 4180 1
55 . 1 1 8 8 ARG HB2 H 1 1.82 . . 1 . . . . . . . . 4180 1
56 . 1 1 8 8 ARG HB3 H 1 1.82 . . 1 . . . . . . . . 4180 1
57 . 1 1 8 8 ARG HG2 H 1 1.66 . . 1 . . . . . . . . 4180 1
58 . 1 1 8 8 ARG HG3 H 1 1.66 . . 1 . . . . . . . . 4180 1
59 . 1 1 8 8 ARG HD2 H 1 3.22 . . 1 . . . . . . . . 4180 1
60 . 1 1 8 8 ARG HD3 H 1 3.22 . . 1 . . . . . . . . 4180 1
61 . 1 1 8 8 ARG HE H 1 7.45 . . 1 . . . . . . . . 4180 1
62 . 1 1 9 9 LEU H H 1 8.11 . . 1 . . . . . . . . 4180 1
63 . 1 1 9 9 LEU HA H 1 4.37 . . 1 . . . . . . . . 4180 1
64 . 1 1 9 9 LEU HB2 H 1 1.69 . . 1 . . . . . . . . 4180 1
65 . 1 1 9 9 LEU HB3 H 1 1.69 . . 1 . . . . . . . . 4180 1
66 . 1 1 9 9 LEU HG H 1 1.60 . . 1 . . . . . . . . 4180 1
67 . 1 1 9 9 LEU HD11 H 1 0.94 . . 2 . . . . . . . . 4180 1
68 . 1 1 9 9 LEU HD12 H 1 0.94 . . 2 . . . . . . . . 4180 1
69 . 1 1 9 9 LEU HD13 H 1 0.94 . . 2 . . . . . . . . 4180 1
70 . 1 1 9 9 LEU HD21 H 1 0.88 . . 2 . . . . . . . . 4180 1
71 . 1 1 9 9 LEU HD22 H 1 0.88 . . 2 . . . . . . . . 4180 1
72 . 1 1 9 9 LEU HD23 H 1 0.88 . . 2 . . . . . . . . 4180 1
73 . 1 1 10 10 VAL H H 1 7.99 . . 1 . . . . . . . . 4180 1
74 . 1 1 10 10 VAL HA H 1 4.09 . . 1 . . . . . . . . 4180 1
75 . 1 1 10 10 VAL HB H 1 2.09 . . 1 . . . . . . . . 4180 1
76 . 1 1 10 10 VAL HG11 H 1 0.95 . . 1 . . . . . . . . 4180 1
77 . 1 1 10 10 VAL HG12 H 1 0.95 . . 1 . . . . . . . . 4180 1
78 . 1 1 10 10 VAL HG13 H 1 0.95 . . 1 . . . . . . . . 4180 1
79 . 1 1 10 10 VAL HG21 H 1 0.95 . . 1 . . . . . . . . 4180 1
80 . 1 1 10 10 VAL HG22 H 1 0.95 . . 1 . . . . . . . . 4180 1
81 . 1 1 10 10 VAL HG23 H 1 0.95 . . 1 . . . . . . . . 4180 1
82 . 1 1 11 11 GLN H H 1 8.49 . . 1 . . . . . . . . 4180 1
83 . 1 1 11 11 GLN HA H 1 4.35 . . 1 . . . . . . . . 4180 1
84 . 1 1 11 11 GLN HB2 H 1 2.14 . . 2 . . . . . . . . 4180 1
85 . 1 1 11 11 GLN HB3 H 1 2.02 . . 2 . . . . . . . . 4180 1
86 . 1 1 11 11 GLN HG2 H 1 2.28 . . 1 . . . . . . . . 4180 1
87 . 1 1 11 11 GLN HG3 H 1 2.28 . . 1 . . . . . . . . 4180 1
88 . 1 1 12 12 GLY H H 1 8.42 . . 1 . . . . . . . . 4180 1
89 . 1 1 12 12 GLY HA2 H 1 3.94 . . 1 . . . . . . . . 4180 1
90 . 1 1 12 12 GLY HA3 H 1 3.94 . . 1 . . . . . . . . 4180 1
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save_