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 34626
_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 NOESY' . . . 34626 1
2 '2D DQF-COSY' . . . 34626 1
3 '2D 1H-1H TOCSY' . . . 34626 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 DC H1' H 1 5.726 0.003 . . . . . . A 1 DC H1' . 34626 1
2 . 1 . 1 1 1 DC H2' H 1 1.902 0.003 . . . . . . A 1 DC H2' . 34626 1
3 . 1 . 1 1 1 DC H2'' H 1 2.381 0.003 . . . . . . A 1 DC H2'' . 34626 1
4 . 1 . 1 1 1 DC H3' H 1 4.698 0.004 . . . . . . A 1 DC H3' . 34626 1
5 . 1 . 1 1 1 DC H4' H 1 4.059 0.005 . . . . . . A 1 DC H4' . 34626 1
6 . 1 . 1 1 1 DC H5 H 1 5.912 0.003 . . . . . . A 1 DC H5 . 34626 1
7 . 1 . 1 1 1 DC H6 H 1 7.626 0.003 . . . . . . A 1 DC H6 . 34626 1
8 . 1 . 1 1 1 DC H41 H 1 7.127 0.003 . . . . . . A 1 DC H41 . 34626 1
9 . 1 . 1 1 1 DC H42 H 1 8.310 0.008 . . . . . . A 1 DC H42 . 34626 1
10 . 1 . 1 2 2 DG H1 H 1 12.987 0.005 . . . . . . A 2 DG H1 . 34626 1
11 . 1 . 1 2 2 DG H1' H 1 5.499 0.003 . . . . . . A 2 DG H1' . 34626 1
12 . 1 . 1 2 2 DG H2' H 1 2.746 0.015 . . . . . . A 2 DG H2' . 34626 1
13 . 1 . 1 2 2 DG H2'' H 1 2.799 0.002 . . . . . . A 2 DG H2'' . 34626 1
14 . 1 . 1 2 2 DG H3' H 1 5.014 0.005 . . . . . . A 2 DG H3' . 34626 1
15 . 1 . 1 2 2 DG H4' H 1 4.323 0.003 . . . . . . A 2 DG H4' . 34626 1
16 . 1 . 1 2 2 DG H5' H 1 4.093 0.007 . . . . . . A 2 DG H5' . 34626 1
17 . 1 . 1 2 2 DG H5'' H 1 3.977 0.004 . . . . . . A 2 DG H5'' . 34626 1
18 . 1 . 1 2 2 DG H8 H 1 7.965 0.003 . . . . . . A 2 DG H8 . 34626 1
19 . 1 . 1 3 3 DA H1' H 1 6.290 0.003 . . . . . . A 3 DA H1' . 34626 1
20 . 1 . 1 3 3 DA H2 H 1 7.926 0.002 . . . . . . A 3 DA H2 . 34626 1
21 . 1 . 1 3 3 DA H2' H 1 2.649 0.016 . . . . . . A 3 DA H2' . 34626 1
22 . 1 . 1 3 3 DA H2'' H 1 2.964 0.006 . . . . . . A 3 DA H2'' . 34626 1
23 . 1 . 1 3 3 DA H3' H 1 5.063 0.004 . . . . . . A 3 DA H3' . 34626 1
24 . 1 . 1 3 3 DA H4' H 1 4.492 0.004 . . . . . . A 3 DA H4' . 34626 1
25 . 1 . 1 3 3 DA H5' H 1 4.240 0.005 . . . . . . A 3 DA H5' . 34626 1
26 . 1 . 1 3 3 DA H5'' H 1 4.184 0.005 . . . . . . A 3 DA H5'' . 34626 1
27 . 1 . 1 3 3 DA H8 H 1 8.219 0.003 . . . . . . A 3 DA H8 . 34626 1
28 . 1 . 1 4 4 5HC H1' H 1 5.551 0.003 . . . . . . A 4 5HC H1' . 34626 1
29 . 1 . 1 4 4 5HC H2' H 1 2.116 0.085 . . . . . . A 4 5HC H2' . 34626 1
30 . 1 . 1 4 4 5HC H2'' H 1 2.400 0.004 . . . . . . A 4 5HC H2'' . 34626 1
31 . 1 . 1 4 4 5HC H3' H 1 4.828 0.003 . . . . . . A 4 5HC H3' . 34626 1
32 . 1 . 1 4 4 5HC H4 H 1 4.184 0.003 . . . . . . A 4 5HC H4 . 34626 1
33 . 1 . 1 4 4 5HC H5M1 H 1 3.986 0.005 . . . . . . A 4 5HC H5M1 . 34626 1
34 . 1 . 1 4 4 5HC H5M2 H 1 3.986 0.005 . . . . . . A 4 5HC H5M2 . 34626 1
35 . 1 . 1 4 4 5HC H6 H 1 7.242 0.003 . . . . . . A 4 5HC H6 . 34626 1
36 . 1 . 1 4 4 5HC HN41 H 1 6.489 0.002 . . . . . . A 4 5HC HN41 . 34626 1
37 . 1 . 1 4 4 5HC HN42 H 1 8.534 0.003 . . . . . . A 4 5HC HN42 . 34626 1
38 . 1 . 1 5 5 DG H1 H 1 12.710 0.006 . . . . . . A 5 DG H1 . 34626 1
39 . 1 . 1 5 5 DG H1' H 1 5.968 0.002 . . . . . . A 5 DG H1' . 34626 1
40 . 1 . 1 5 5 DG H2' H 1 2.594 0.002 . . . . . . A 5 DG H2' . 34626 1
41 . 1 . 1 5 5 DG H2'' H 1 2.790 0.002 . . . . . . A 5 DG H2'' . 34626 1
42 . 1 . 1 5 5 DG H3' H 1 4.928 0.004 . . . . . . A 5 DG H3' . 34626 1
43 . 1 . 1 5 5 DG H4' H 1 4.374 0.005 . . . . . . A 5 DG H4' . 34626 1
44 . 1 . 1 5 5 DG H5' H 1 4.236 0.005 . . . . . . A 5 DG H5' . 34626 1
45 . 1 . 1 5 5 DG H5'' H 1 4.143 0.005 . . . . . . A 5 DG H5'' . 34626 1
46 . 1 . 1 5 5 DG H8 H 1 7.824 0.003 . . . . . . A 5 DG H8 . 34626 1
47 . 1 . 1 6 6 DT H1' H 1 6.074 0.005 . . . . . . A 6 DT H1' . 34626 1
48 . 1 . 1 6 6 DT H2' H 1 2.120 0.004 . . . . . . A 6 DT H2' . 34626 1
49 . 1 . 1 6 6 DT H2'' H 1 2.483 0.004 . . . . . . A 6 DT H2'' . 34626 1
50 . 1 . 1 6 6 DT H3 H 1 13.877 0.003 . . . . . . A 6 DT H3 . 34626 1
51 . 1 . 1 6 6 DT H3' H 1 4.882 0.007 . . . . . . A 6 DT H3' . 34626 1
52 . 1 . 1 6 6 DT H4' H 1 4.244 0.003 . . . . . . A 6 DT H4' . 34626 1
53 . 1 . 1 6 6 DT H6 H 1 7.312 0.002 . . . . . . A 6 DT H6 . 34626 1
54 . 1 . 1 6 6 DT H71 H 1 1.445 0.256 . . . . . . A 6 DT M7 . 34626 1
55 . 1 . 1 6 6 DT H72 H 1 1.445 0.256 . . . . . . A 6 DT M7 . 34626 1
56 . 1 . 1 6 6 DT H73 H 1 1.445 0.256 . . . . . . A 6 DT M7 . 34626 1
57 . 1 . 1 7 7 DC H1' H 1 5.735 0.004 . . . . . . A 7 DC H1' . 34626 1
58 . 1 . 1 7 7 DC H2' H 1 2.065 0.106 . . . . . . A 7 DC H2' . 34626 1
59 . 1 . 1 7 7 DC H2'' H 1 2.309 0.150 . . . . . . A 7 DC H2'' . 34626 1
60 . 1 . 1 7 7 DC H3' H 1 4.850 0.005 . . . . . . A 7 DC H3' . 34626 1
61 . 1 . 1 7 7 DC H4' H 1 4.132 0.004 . . . . . . A 7 DC H4' . 34626 1
62 . 1 . 1 7 7 DC H5 H 1 5.712 0.007 . . . . . . A 7 DC H5 . 34626 1
63 . 1 . 1 7 7 DC H6 H 1 7.503 0.003 . . . . . . A 7 DC H6 . 34626 1
64 . 1 . 1 7 7 DC H41 H 1 7.188 0.002 . . . . . . A 7 DC H41 . 34626 1
65 . 1 . 1 7 7 DC H42 H 1 8.678 0.005 . . . . . . A 7 DC H42 . 34626 1
66 . 1 . 1 8 8 DG H1 H 1 12.991 0.004 . . . . . . A 8 DG H1 . 34626 1
67 . 1 . 1 8 8 DG H1' H 1 6.173 0.003 . . . . . . A 8 DG H1' . 34626 1
68 . 1 . 1 8 8 DG H2' H 1 2.386 0.009 . . . . . . A 8 DG H2' . 34626 1
69 . 1 . 1 8 8 DG H2'' H 1 2.630 0.007 . . . . . . A 8 DG H2'' . 34626 1
70 . 1 . 1 8 8 DG H3' H 1 4.690 0.004 . . . . . . A 8 DG H3' . 34626 1
71 . 1 . 1 8 8 DG H4' H 1 4.198 0.002 . . . . . . A 8 DG H4' . 34626 1
72 . 1 . 1 8 8 DG H8 H 1 7.961 0.003 . . . . . . A 8 DG H8 . 34626 1
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save_