Content for NMR-STAR saveframe, "chemical_shift_set_1"
save_chemical_shift_set_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chemical_shift_set_1
_Assigned_chem_shift_list.Entry_ID 4614
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_cond_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference
_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 $D2O_sample . 4614 1
. . 2 $H2O_sample . 4614 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 G H8 H 1 7.990 0.02 . 1 . . . . . . . . 4614 1
2 . 1 1 1 1 G H1' H 1 5.680 0.02 . 1 . . . . . . . . 4614 1
3 . 1 1 1 1 G H2' H 1 4.730 0.02 . 1 . . . . . . . . 4614 1
4 . 1 1 1 1 G H3' H 1 4.540 0.02 . 1 . . . . . . . . 4614 1
5 . 1 1 1 1 G H4' H 1 4.310 0.02 . 1 . . . . . . . . 4614 1
6 . 1 1 2 2 C H5 H 1 5.310 0.02 . 1 . . . . . . . . 4614 1
7 . 1 1 2 2 C H6 H 1 7.860 0.02 . 1 . . . . . . . . 4614 1
8 . 1 1 2 2 C H1' H 1 5.600 0.02 . 1 . . . . . . . . 4614 1
9 . 1 1 2 2 C H2' H 1 4.490 0.02 . 1 . . . . . . . . 4614 1
10 . 1 1 2 2 C H3' H 1 4.610 0.02 . 1 . . . . . . . . 4614 1
11 . 1 1 2 2 C H4' H 1 4.190 0.02 . 1 . . . . . . . . 4614 1
12 . 1 1 3 3 A H2 H 1 7.100 0.02 . 1 . . . . . . . . 4614 1
13 . 1 1 3 3 A H8 H 1 8.000 0.02 . 1 . . . . . . . . 4614 1
14 . 1 1 3 3 A H1' H 1 5.950 0.02 . 1 . . . . . . . . 4614 1
15 . 1 1 3 3 A H2' H 1 4.890 0.02 . 1 . . . . . . . . 4614 1
16 . 1 1 3 3 A H3' H 1 4.760 0.02 . 1 . . . . . . . . 4614 1
17 . 1 1 3 3 A H4' H 1 4.480 0.02 . 1 . . . . . . . . 4614 1
18 . 1 1 4 4 G H8 H 1 7.450 0.02 . 1 . . . . . . . . 4614 1
19 . 1 1 4 4 G H1' H 1 5.800 0.02 . 1 . . . . . . . . 4614 1
20 . 1 1 4 4 G H2' H 1 4.470 0.02 . 1 . . . . . . . . 4614 1
21 . 1 1 4 4 G H3' H 1 4.500 0.02 . 1 . . . . . . . . 4614 1
22 . 1 1 4 4 G H4' H 1 4.390 0.02 . 1 . . . . . . . . 4614 1
23 . 1 1 5 5 G H8 H 1 7.120 0.02 . 1 . . . . . . . . 4614 1
24 . 1 1 5 5 G H1' H 1 5.787 0.02 . 1 . . . . . . . . 4614 1
25 . 1 1 5 5 G H2' H 1 4.570 0.02 . 1 . . . . . . . . 4614 1
26 . 1 1 5 5 G H3' H 1 4.420 0.02 . 1 . . . . . . . . 4614 1
27 . 1 1 5 5 G H4' H 1 4.470 0.02 . 1 . . . . . . . . 4614 1
28 . 1 1 6 6 C H5 H 1 5.130 0.02 . 1 . . . . . . . . 4614 1
29 . 1 1 6 6 C H6 H 1 7.630 0.02 . 1 . . . . . . . . 4614 1
30 . 1 1 6 6 C H1' H 1 5.540 0.02 . 1 . . . . . . . . 4614 1
31 . 1 1 6 6 C H2' H 1 4.830 0.02 . 1 . . . . . . . . 4614 1
32 . 1 1 6 6 C H3' H 1 4.510 0.02 . 1 . . . . . . . . 4614 1
33 . 1 1 6 6 C H4' H 1 4.390 0.02 . 1 . . . . . . . . 4614 1
34 . 1 1 7 7 G H8 H 1 7.510 0.02 . 1 . . . . . . . . 4614 1
35 . 1 1 7 7 G H1' H 1 5.870 0.02 . 1 . . . . . . . . 4614 1
36 . 1 1 7 7 G H2' H 1 4.490 0.02 . 1 . . . . . . . . 4614 1
37 . 1 1 7 7 G H3' H 1 4.320 0.02 . 9 . . . . . . . . 4614 1
38 . 1 1 8 8 U H5 H 1 5.080 0.02 . 1 . . . . . . . . 4614 1
39 . 1 1 8 8 U H6 H 1 7.660 0.02 . 1 . . . . . . . . 4614 1
40 . 1 1 8 8 U H1' H 1 5.620 0.02 . 1 . . . . . . . . 4614 1
41 . 1 1 8 8 U H2' H 1 4.620 0.02 . 1 . . . . . . . . 4614 1
42 . 1 1 8 8 U H3' H 1 4.560 0.02 . 1 . . . . . . . . 4614 1
43 . 1 1 8 8 U H4' H 1 4.470 0.02 . 1 . . . . . . . . 4614 1
44 . 1 1 9 9 G H8 H 1 7.750 0.02 . 1 . . . . . . . . 4614 1
45 . 1 1 9 9 G H1' H 1 5.820 0.02 . 1 . . . . . . . . 4614 1
46 . 1 1 9 9 G H2' H 1 4.400 0.02 . 1 . . . . . . . . 4614 1
47 . 1 1 9 9 G H3' H 1 4.630 0.02 . 1 . . . . . . . . 4614 1
48 . 1 1 9 9 G H4' H 1 4.480 0.02 . 1 . . . . . . . . 4614 1
49 . 1 1 10 10 C H5 H 1 5.280 0.02 . 1 . . . . . . . . 4614 1
50 . 1 1 10 10 C H6 H 1 7.510 0.02 . 1 . . . . . . . . 4614 1
51 . 1 1 10 10 C H1' H 1 5.680 0.02 . 1 . . . . . . . . 4614 1
52 . 1 1 10 10 C H2' H 1 3.970 0.02 . 1 . . . . . . . . 4614 1
53 . 1 1 10 10 C H3' H 1 4.110 0.02 . 1 . . . . . . . . 4614 1
54 . 1 1 10 10 C H4' H 1 4.170 0.02 . 1 . . . . . . . . 4614 1
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