Content for NMR-STAR saveframe, "assigned_chem_shift_list_3"
save_assigned_chem_shift_list_3
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_3
_Assigned_chem_shift_list.Entry_ID 25043
_Assigned_chem_shift_list.ID 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 $chemical_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 .
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_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
4 '2D 1H-1H NOESY' . . . 25043 3
5 '2D 1H-1H TOCSY' . . . 25043 3
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_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
2 $SPARKY . . 25043 3
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_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 . 3 2 1 1 A H1' H 1 5.909 0.000 . . . . . B 1 A H1' . 25043 3
2 . 3 2 1 1 A H2 H 1 8.135 0.000 . . . . . B 1 A H2 . 25043 3
3 . 3 2 1 1 A H2' H 1 4.879 0.000 . . . . . B 1 A H2' . 25043 3
4 . 3 2 1 1 A H3' H 1 4.725 0.000 . . . . . B 1 A H3' . 25043 3
5 . 3 2 1 1 A H4' H 1 4.411 0.000 . . . . . B 1 A H4' . 25043 3
6 . 3 2 1 1 A H5' H 1 3.807 0.000 . . . . . B 1 A H5' . 25043 3
7 . 3 2 1 1 A H5'' H 1 3.907 0.000 . . . . . B 1 A H5'' . 25043 3
8 . 3 2 1 1 A H8 H 1 8.290 0.000 . . . . . B 1 A H8 . 25043 3
9 . 3 2 1 1 A C1' C 13 91.257 0.000 . . . . . B 1 A C1' . 25043 3
10 . 3 2 1 1 A C2 C 13 155.162 0.000 . . . . . B 1 A C2 . 25043 3
11 . 3 2 1 1 A C2' C 13 75.261 0.000 . . . . . B 1 A C2' . 25043 3
12 . 3 2 1 1 A C3' C 13 77.056 0.000 . . . . . B 1 A C3' . 25043 3
13 . 3 2 1 1 A C4' C 13 87.617 0.000 . . . . . B 1 A C4' . 25043 3
14 . 3 2 1 1 A C5' C 13 66.531 0.010 . . . . . B 1 A C5' . 25043 3
15 . 3 2 1 1 A C8 C 13 143.139 0.000 . . . . . B 1 A C8 . 25043 3
16 . 3 2 2 2 C H1' H 1 5.871 0.000 . . . . . B 2 C H1' . 25043 3
17 . 3 2 2 2 C H2' H 1 4.328 0.000 . . . . . B 2 C H2' . 25043 3
18 . 3 2 2 2 C H3' H 1 4.404 0.000 . . . . . B 2 C H3' . 25043 3
19 . 3 2 2 2 C H4' H 1 4.433 0.000 . . . . . B 2 C H4' . 25043 3
20 . 3 2 2 2 C H5 H 1 5.888 0.000 . . . . . B 2 C H5 . 25043 3
21 . 3 2 2 2 C H5' H 1 4.126 0.000 . . . . . B 2 C H5' . 25043 3
22 . 3 2 2 2 C H5'' H 1 4.233 0.000 . . . . . B 2 C H5'' . 25043 3
23 . 3 2 2 2 C H6 H 1 7.732 0.000 . . . . . B 2 C H6 . 25043 3
24 . 3 2 2 2 C C1' C 13 91.183 0.000 . . . . . B 2 C C1' . 25043 3
25 . 3 2 2 2 C C2' C 13 76.336 0.000 . . . . . B 2 C C2' . 25043 3
26 . 3 2 2 2 C C3' C 13 72.514 0.000 . . . . . B 2 C C3' . 25043 3
27 . 3 2 2 2 C C4' C 13 87.181 0.000 . . . . . B 2 C C4' . 25043 3
28 . 3 2 2 2 C C5 C 13 98.913 0.000 . . . . . B 2 C C5 . 25043 3
29 . 3 2 2 2 C C5' C 13 67.290 0.007 . . . . . B 2 C C5' . 25043 3
30 . 3 2 2 2 C C6 C 13 143.319 0.000 . . . . . B 2 C C6 . 25043 3
31 . 3 2 3 3 A H1' H 1 5.975 0.000 . . . . . B 3 A H1' . 25043 3
32 . 3 2 3 3 A H2 H 1 8.145 0.000 . . . . . B 3 A H2 . 25043 3
33 . 3 2 3 3 A H2' H 1 4.805 0.000 . . . . . B 3 A H2' . 25043 3
34 . 3 2 3 3 A H3' H 1 4.513 0.000 . . . . . B 3 A H3' . 25043 3
35 . 3 2 3 3 A H4' H 1 4.313 0.000 . . . . . B 3 A H4' . 25043 3
36 . 3 2 3 3 A H5' H 1 4.024 0.000 . . . . . B 3 A H5' . 25043 3
37 . 3 2 3 3 A H5'' H 1 4.101 0.004 . . . . . B 3 A H5'' . 25043 3
38 . 3 2 3 3 A H8 H 1 8.301 0.000 . . . . . B 3 A H8 . 25043 3
39 . 3 2 3 3 A C1' C 13 91.367 0.000 . . . . . B 3 A C1' . 25043 3
40 . 3 2 3 3 A C2 C 13 155.000 0.000 . . . . . B 3 A C2 . 25043 3
41 . 3 2 3 3 A C2' C 13 75.587 0.000 . . . . . B 3 A C2' . 25043 3
42 . 3 2 3 3 A C3' C 13 74.819 0.000 . . . . . B 3 A C3' . 25043 3
43 . 3 2 3 3 A C4' C 13 86.010 0.000 . . . . . B 3 A C4' . 25043 3
44 . 3 2 3 3 A C5' C 13 66.848 0.000 . . . . . B 3 A C5' . 25043 3
45 . 3 2 3 3 A C8 C 13 141.760 0.000 . . . . . B 3 A C8 . 25043 3
46 . 3 2 4 4 C H1' H 1 5.614 0.000 . . . . . B 4 C H1' . 25043 3
47 . 3 2 4 4 C H2' H 1 4.157 0.000 . . . . . B 4 C H2' . 25043 3
48 . 3 2 4 4 C H3' H 1 4.832 0.000 . . . . . B 4 C H3' . 25043 3
49 . 3 2 4 4 C H4' H 1 4.441 0.000 . . . . . B 4 C H4' . 25043 3
50 . 3 2 4 4 C H5 H 1 5.805 0.000 . . . . . B 4 C H5 . 25043 3
51 . 3 2 4 4 C H6 H 1 7.624 0.000 . . . . . B 4 C H6 . 25043 3
52 . 3 2 4 4 C C1' C 13 92.100 0.000 . . . . . B 4 C C1' . 25043 3
53 . 3 2 4 4 C C2' C 13 76.374 0.000 . . . . . B 4 C C2' . 25043 3
54 . 3 2 4 4 C C3' C 13 75.556 0.000 . . . . . B 4 C C3' . 25043 3
55 . 3 2 4 4 C C4' C 13 86.737 0.000 . . . . . B 4 C C4' . 25043 3
56 . 3 2 4 4 C C5 C 13 98.595 0.000 . . . . . B 4 C C5 . 25043 3
57 . 3 2 4 4 C C6 C 13 142.622 0.000 . . . . . B 4 C C6 . 25043 3
58 . 3 2 5 5 A H1' H 1 5.946 0.000 . . . . . B 5 A H1' . 25043 3
59 . 3 2 5 5 A H2 H 1 8.146 0.000 . . . . . B 5 A H2 . 25043 3
60 . 3 2 5 5 A H2' H 1 4.538 0.000 . . . . . B 5 A H2' . 25043 3
61 . 3 2 5 5 A H3' H 1 4.376 0.000 . . . . . B 5 A H3' . 25043 3
62 . 3 2 5 5 A H4' H 1 4.271 0.000 . . . . . B 5 A H4' . 25043 3
63 . 3 2 5 5 A H5' H 1 4.061 0.000 . . . . . B 5 A H5' . 25043 3
64 . 3 2 5 5 A H5'' H 1 4.163 0.000 . . . . . B 5 A H5'' . 25043 3
65 . 3 2 5 5 A H8 H 1 8.265 0.000 . . . . . B 5 A H8 . 25043 3
66 . 3 2 5 5 A C1' C 13 90.067 0.000 . . . . . B 5 A C1' . 25043 3
67 . 3 2 5 5 A C2 C 13 155.244 0.000 . . . . . B 5 A C2 . 25043 3
68 . 3 2 5 5 A C2' C 13 77.159 0.000 . . . . . B 5 A C2' . 25043 3
69 . 3 2 5 5 A C3' C 13 72.590 0.000 . . . . . B 5 A C3' . 25043 3
70 . 3 2 5 5 A C4' C 13 86.008 0.000 . . . . . B 5 A C4' . 25043 3
71 . 3 2 5 5 A C5' C 13 67.521 0.003 . . . . . B 5 A C5' . 25043 3
72 . 3 2 5 5 A C8 C 13 141.924 0.000 . . . . . B 5 A C8 . 25043 3
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