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 52123
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name r(CpG)3
_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' . . . 52123 1
2 '2D 1H-13C HSQC' . . . 52123 1
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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 $software_1 . . 52123 1
2 $software_2 . . 52123 1
3 $software_3 . . 52123 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 C H1' H 1 5.617 0.032 . 1 . . . . . 1 C H1' . 52123 1
2 . 1 . 1 1 1 C H2' H 1 4.364 0.001 . 1 . . . . . 1 C H2' . 52123 1
3 . 1 . 1 1 1 C H3' H 1 4.607 0.002 . 1 . . . . . 1 C H3' . 52123 1
4 . 1 . 1 1 1 C H4' H 1 4.366 0.000 . 1 . . . . . 1 C H4' . 52123 1
5 . 1 . 1 1 1 C H5 H 1 6.037 0.009 . 1 . . . . . 1 C H5 . 52123 1
6 . 1 . 1 1 1 C H5' H 1 4.066 0.003 . 1 . . . . . 1 C H5' . 52123 1
7 . 1 . 1 1 1 C H5'' H 1 3.971 0.003 . 1 . . . . . 1 C H5'' . 52123 1
8 . 1 . 1 1 1 C H6 H 1 8.077 0.031 . 1 . . . . . 1 C H6 . 52123 1
9 . 1 . 1 1 1 C C1' C 13 93.759 0.189 . 1 . . . . . 1 C C1' . 52123 1
10 . 1 . 1 1 1 C C2' C 13 75.538 0.000 . 1 . . . . . 1 C C2' . 52123 1
11 . 1 . 1 1 1 C C3' C 13 75.486 0.000 . 1 . . . . . 1 C C3' . 52123 1
12 . 1 . 1 1 1 C C4' C 13 84.337 0.000 . 1 . . . . . 1 C C4' . 52123 1
13 . 1 . 1 1 1 C C5 C 13 99.019 0.136 . 1 . . . . . 1 C C5 . 52123 1
14 . 1 . 1 1 1 C C5' C 13 61.997 0.003 . 1 . . . . . 1 C C5' . 52123 1
15 . 1 . 1 1 1 C C6 C 13 143.014 0.310 . 1 . . . . . 1 C C6 . 52123 1
16 . 1 . 1 2 2 G H1 H 1 13.161 0.004 . 1 . . . . . 2 G H1 . 52123 1
17 . 1 . 1 2 2 G H1' H 1 5.823 0.005 . 1 . . . . . 2 G H1' . 52123 1
18 . 1 . 1 2 2 G H2' H 1 4.633 0.001 . 1 . . . . . 2 G H2' . 52123 1
19 . 1 . 1 2 2 G H3' H 1 4.604 0.004 . 1 . . . . . 2 G H3' . 52123 1
20 . 1 . 1 2 2 G H4' H 1 4.539 0.000 . 1 . . . . . 2 G H4' . 52123 1
21 . 1 . 1 2 2 G H5' H 1 4.541 0.003 . 1 . . . . . 2 G H5' . 52123 1
22 . 1 . 1 2 2 G H5'' H 1 4.226 0.002 . 1 . . . . . 2 G H5'' . 52123 1
23 . 1 . 1 2 2 G H8 H 1 7.851 0.022 . 1 . . . . . 2 G H8 . 52123 1
24 . 1 . 1 2 2 G C1' C 13 92.378 0.220 . 1 . . . . . 2 G C1' . 52123 1
25 . 1 . 1 2 2 G C2' C 13 75.474 0.000 . 1 . . . . . 2 G C2' . 52123 1
26 . 1 . 1 2 2 G C3' C 13 73.640 0.000 . 1 . . . . . 2 G C3' . 52123 1
27 . 1 . 1 2 2 G C4' C 13 82.280 0.000 . 1 . . . . . 2 G C4' . 52123 1
28 . 1 . 1 2 2 G C5' C 13 65.458 0.002 . 1 . . . . . 2 G C5' . 52123 1
29 . 1 . 1 2 2 G C8 C 13 136.894 0.549 . 1 . . . . . 2 G C8 . 52123 1
30 . 1 . 1 3 3 C H1' H 1 5.591 0.034 . 1 . . . . . 3 C H1' . 52123 1
31 . 1 . 1 3 3 C H3' H 1 4.479 0.004 . 1 . . . . . 3 C H3' . 52123 1
32 . 1 . 1 3 3 C H4' H 1 4.479 0.000 . 1 . . . . . 3 C H4' . 52123 1
33 . 1 . 1 3 3 C H5 H 1 5.351 0.026 . 1 . . . . . 3 C H5 . 52123 1
34 . 1 . 1 3 3 C H5' H 1 4.581 0.003 . 1 . . . . . 3 C H5' . 52123 1
35 . 1 . 1 3 3 C H5'' H 1 4.178 0.003 . 1 . . . . . 3 C H5'' . 52123 1
36 . 1 . 1 3 3 C H6 H 1 7.706 0.013 . 1 . . . . . 3 C H6 . 52123 1
37 . 1 . 1 3 3 C H41 H 1 8.505 0.002 . 1 . . . . . 3 C H41 . 52123 1
38 . 1 . 1 3 3 C H42 H 1 6.709 0.003 . 1 . . . . . 3 C H42 . 52123 1
39 . 1 . 1 3 3 C C1' C 13 93.690 0.108 . 1 . . . . . 3 C C1' . 52123 1
40 . 1 . 1 3 3 C C3' C 13 72.140 0.000 . 1 . . . . . 3 C C3' . 52123 1
41 . 1 . 1 3 3 C C4' C 13 81.865 0.000 . 1 . . . . . 3 C C4' . 52123 1
42 . 1 . 1 3 3 C C5 C 13 97.740 0.166 . 1 . . . . . 3 C C5 . 52123 1
43 . 1 . 1 3 3 C C5' C 13 64.890 0.001 . 1 . . . . . 3 C C5' . 52123 1
44 . 1 . 1 3 3 C C6 C 13 140.907 0.398 . 1 . . . . . 3 C C6 . 52123 1
45 . 1 . 1 4 4 G H1 H 1 12.945 0.002 . 1 . . . . . 4 G H1 . 52123 1
46 . 1 . 1 4 4 G H1' H 1 5.750 0.007 . 1 . . . . . 4 G H1' . 52123 1
47 . 1 . 1 4 4 G H2' H 1 4.563 0.017 . 1 . . . . . 4 G H2' . 52123 1
48 . 1 . 1 4 4 G H3' H 1 4.559 0.013 . 1 . . . . . 4 G H3' . 52123 1
49 . 1 . 1 4 4 G H4' H 1 4.494 0.007 . 1 . . . . . 4 G H4' . 52123 1
50 . 1 . 1 4 4 G H5' H 1 4.515 0.004 . 1 . . . . . 4 G H5' . 52123 1
51 . 1 . 1 4 4 G H5'' H 1 4.146 0.005 . 1 . . . . . 4 G H5'' . 52123 1
52 . 1 . 1 4 4 G H8 H 1 7.586 0.033 . 1 . . . . . 4 G H8 . 52123 1
53 . 1 . 1 4 4 G C1' C 13 92.903 0.122 . 1 . . . . . 4 G C1' . 52123 1
54 . 1 . 1 4 4 G C2' C 13 75.396 0.014 . 1 . . . . . 4 G C2' . 52123 1
55 . 1 . 1 4 4 G C3' C 13 73.009 0.003 . 1 . . . . . 4 G C3' . 52123 1
56 . 1 . 1 4 4 G C4' C 13 81.974 0.055 . 1 . . . . . 4 G C4' . 52123 1
57 . 1 . 1 4 4 G C5' C 13 65.576 0.057 . 1 . . . . . 4 G C5' . 52123 1
58 . 1 . 1 4 4 G C8 C 13 136.238 0.496 . 1 . . . . . 4 G C8 . 52123 1
59 . 1 . 1 5 5 C H1' H 1 5.542 0.032 . 1 . . . . . 5 C H1' . 52123 1
60 . 1 . 1 5 5 C H2' H 1 4.557 0.006 . 1 . . . . . 5 C H2' . 52123 1
61 . 1 . 1 5 5 C H3' H 1 4.488 0.003 . 1 . . . . . 5 C H3' . 52123 1
62 . 1 . 1 5 5 C H4' H 1 4.420 0.001 . 1 . . . . . 5 C H4' . 52123 1
63 . 1 . 1 5 5 C H5 H 1 5.278 0.030 . 1 . . . . . 5 C H5 . 52123 1
64 . 1 . 1 5 5 C H5' H 1 4.552 0.003 . 1 . . . . . 5 C H5' . 52123 1
65 . 1 . 1 5 5 C H5'' H 1 4.097 0.004 . 1 . . . . . 5 C H5'' . 52123 1
66 . 1 . 1 5 5 C H6 H 1 7.591 0.016 . 1 . . . . . 5 C H6 . 52123 1
67 . 1 . 1 5 5 C H41 H 1 8.404 0.004 . 1 . . . . . 5 C H41 . 52123 1
68 . 1 . 1 5 5 C H42 H 1 6.802 0.005 . 1 . . . . . 5 C H42 . 52123 1
69 . 1 . 1 5 5 C C1' C 13 93.755 0.117 . 1 . . . . . 5 C C1' . 52123 1
70 . 1 . 1 5 5 C C2' C 13 72.487 0.000 . 1 . . . . . 5 C C2' . 52123 1
71 . 1 . 1 5 5 C C3' C 13 72.147 0.000 . 1 . . . . . 5 C C3' . 52123 1
72 . 1 . 1 5 5 C C4' C 13 81.843 0.000 . 1 . . . . . 5 C C4' . 52123 1
73 . 1 . 1 5 5 C C5 C 13 97.554 0.172 . 1 . . . . . 5 C C5 . 52123 1
74 . 1 . 1 5 5 C C5' C 13 64.532 0.001 . 1 . . . . . 5 C C5' . 52123 1
75 . 1 . 1 5 5 C C6 C 13 140.564 0.404 . 1 . . . . . 5 C C6 . 52123 1
76 . 1 . 1 6 6 G H1' H 1 5.877 0.005 . 1 . . . . . 6 G H1' . 52123 1
77 . 1 . 1 6 6 G H2' H 1 4.132 0.002 . 1 . . . . . 6 G H2' . 52123 1
78 . 1 . 1 6 6 G H3' H 1 4.320 0.003 . 1 . . . . . 6 G H3' . 52123 1
79 . 1 . 1 6 6 G H4' H 1 4.255 0.001 . 1 . . . . . 6 G H4' . 52123 1
80 . 1 . 1 6 6 G H5' H 1 4.473 0.003 . 1 . . . . . 6 G H5' . 52123 1
81 . 1 . 1 6 6 G H5'' H 1 4.077 0.001 . 1 . . . . . 6 G H5'' . 52123 1
82 . 1 . 1 6 6 G H8 H 1 7.654 0.034 . 1 . . . . . 6 G H8 . 52123 1
83 . 1 . 1 6 6 G C1' C 13 91.213 0.163 . 1 . . . . . 6 G C1' . 52123 1
84 . 1 . 1 6 6 G C2' C 13 77.905 0.000 . 1 . . . . . 6 G C2' . 52123 1
85 . 1 . 1 6 6 G C3' C 13 70.504 0.000 . 1 . . . . . 6 G C3' . 52123 1
86 . 1 . 1 6 6 G C4' C 13 83.955 0.000 . 1 . . . . . 6 G C4' . 52123 1
87 . 1 . 1 6 6 G C5' C 13 65.695 0.001 . 1 . . . . . 6 G C5' . 52123 1
88 . 1 . 1 6 6 G C8 C 13 137.771 0.520 . 1 . . . . . 6 G C8 . 52123 1
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