Content for NMR-STAR saveframe, "assigned_chem_shift_list_2"
save_assigned_chem_shift_list_2
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_2
_Assigned_chem_shift_list.Entry_ID 25042
_Assigned_chem_shift_list.ID 2
_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 .
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
4 '2D 1H-1H NOESY' . . . 25042 2
5 '2D 1H-1H TOCSY' . . . 25042 2
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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 . . 25042 2
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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 . 2 2 1 1 A H1' H 1 6.136 0.001 . 1 . . . B 1 A H1' . 25042 2
2 . 2 2 1 1 A H2 H 1 8.140 0.003 . 1 . . . B 1 A H2 . 25042 2
3 . 2 2 1 1 A H2' H 1 4.966 0.002 . 1 . . . B 1 A H2' . 25042 2
4 . 2 2 1 1 A H3' H 1 4.855 0.026 . 1 . . . B 1 A H3' . 25042 2
5 . 2 2 1 1 A H4' H 1 4.507 0.003 . 1 . . . B 1 A H4' . 25042 2
6 . 2 2 1 1 A H5' H 1 3.947 0.005 . 1 . . . B 1 A H5' . 25042 2
7 . 2 2 1 1 A H8 H 1 8.391 0.001 . 1 . . . B 1 A H8 . 25042 2
8 . 2 2 1 1 A C1' C 13 90.573 0.000 . 1 . . . B 1 A C1' . 25042 2
9 . 2 2 1 1 A C2 C 13 155.232 0.000 . 1 . . . B 1 A C2 . 25042 2
10 . 2 2 1 1 A C2' C 13 75.721 0.000 . 1 . . . B 1 A C2' . 25042 2
11 . 2 2 1 1 A C3' C 13 75.808 0.000 . 1 . . . B 1 A C3' . 25042 2
12 . 2 2 1 1 A C4' C 13 87.595 0.000 . 1 . . . B 1 A C4' . 25042 2
13 . 2 2 1 1 A C8 C 13 143.123 0.000 . 1 . . . B 1 A C8 . 25042 2
14 . 2 2 2 2 C H1' H 1 6.089 0.003 . 1 . . . B 2 C H1' . 25042 2
15 . 2 2 2 2 C H2' H 1 4.486 0.006 . 1 . . . B 2 C H2' . 25042 2
16 . 2 2 2 2 C H3' H 1 4.797 0.006 . 1 . . . B 2 C H3' . 25042 2
17 . 2 2 2 2 C H4' H 1 4.426 0.004 . 1 . . . B 2 C H4' . 25042 2
18 . 2 2 2 2 C H5 H 1 5.985 0.004 . 1 . . . B 2 C H5 . 25042 2
19 . 2 2 2 2 C H5' H 1 4.319 0.000 . 1 . . . B 2 C H5' . 25042 2
20 . 2 2 2 2 C H5'' H 1 4.291 0.000 . 1 . . . B 2 C H5'' . 25042 2
21 . 2 2 2 2 C H6 H 1 7.847 0.002 . 1 . . . B 2 C H6 . 25042 2
22 . 2 2 2 2 C C1' C 13 90.562 0.000 . 1 . . . B 2 C C1' . 25042 2
23 . 2 2 2 2 C C2' C 13 75.940 0.000 . 1 . . . B 2 C C2' . 25042 2
24 . 2 2 2 2 C C3' C 13 75.694 0.000 . 1 . . . B 2 C C3' . 25042 2
25 . 2 2 2 2 C C4' C 13 85.360 0.000 . 1 . . . B 2 C C4' . 25042 2
26 . 2 2 2 2 C C5 C 13 99.502 0.000 . 1 . . . B 2 C C5 . 25042 2
27 . 2 2 2 2 C C6 C 13 143.822 0.000 . 1 . . . B 2 C C6 . 25042 2
28 . 2 2 3 3 A H1' H 1 5.819 0.002 . 1 . . . B 3 A H1' . 25042 2
29 . 2 2 3 3 A H2 H 1 8.258 0.004 . 1 . . . B 3 A H2 . 25042 2
30 . 2 2 3 3 A H2' H 1 4.666 0.014 . 1 . . . B 3 A H2' . 25042 2
31 . 2 2 3 3 A H3' H 1 4.642 0.003 . 1 . . . B 3 A H3' . 25042 2
32 . 2 2 3 3 A H4' H 1 4.372 0.009 . 1 . . . B 3 A H4' . 25042 2
33 . 2 2 3 3 A H8 H 1 8.289 0.009 . 1 . . . B 3 A H8 . 25042 2
34 . 2 2 3 3 A C1' C 13 91.974 0.000 . 1 . . . B 3 A C1' . 25042 2
35 . 2 2 3 3 A C2 C 13 155.570 0.000 . 1 . . . B 3 A C2 . 25042 2
36 . 2 2 3 3 A C2' C 13 74.546 0.000 . 1 . . . B 3 A C2' . 25042 2
37 . 2 2 3 3 A C3' C 13 74.003 0.000 . 1 . . . B 3 A C3' . 25042 2
38 . 2 2 3 3 A C4' C 13 84.366 0.000 . 1 . . . B 3 A C4' . 25042 2
39 . 2 2 3 3 A C8 C 13 141.383 0.000 . 1 . . . B 3 A C8 . 25042 2
40 . 2 2 4 4 C H1' H 1 5.739 0.005 . 1 . . . B 4 C H1' . 25042 2
41 . 2 2 4 4 C H2' H 1 4.095 0.004 . 1 . . . B 4 C H2' . 25042 2
42 . 2 2 4 4 C H3' H 1 4.236 0.001 . 1 . . . B 4 C H3' . 25042 2
43 . 2 2 4 4 C H4' H 1 4.255 0.005 . 1 . . . B 4 C H4' . 25042 2
44 . 2 2 4 4 C H5 H 1 5.690 0.004 . 1 . . . B 4 C H5 . 25042 2
45 . 2 2 4 4 C H5' H 1 4.250 0.000 . 1 . . . B 4 C H5' . 25042 2
46 . 2 2 4 4 C H5'' H 1 4.123 0.000 . 1 . . . B 4 C H5'' . 25042 2
47 . 2 2 4 4 C H6 H 1 7.667 0.002 . 1 . . . B 4 C H6 . 25042 2
48 . 2 2 4 4 C C1' C 13 92.715 0.000 . 1 . . . B 4 C C1' . 25042 2
49 . 2 2 4 4 C C2' C 13 77.460 0.000 . 1 . . . B 4 C C2' . 25042 2
50 . 2 2 4 4 C C3' C 13 70.722 0.000 . 1 . . . B 4 C C3' . 25042 2
51 . 2 2 4 4 C C4' C 13 84.330 0.000 . 1 . . . B 4 C C4' . 25042 2
52 . 2 2 4 4 C C5 C 13 97.994 0.000 . 1 . . . B 4 C C5 . 25042 2
53 . 2 2 4 4 C C6 C 13 142.389 0.000 . 1 . . . B 4 C C6 . 25042 2
54 . 2 2 5 5 A H1' H 1 5.679 0.007 . 1 . . . B 5 A H1' . 25042 2
55 . 2 2 5 5 A H2 H 1 8.291 0.003 . 1 . . . B 5 A H2 . 25042 2
56 . 2 2 5 5 A H2' H 1 4.546 0.010 . 1 . . . B 5 A H2' . 25042 2
57 . 2 2 5 5 A H3' H 1 4.255 0.001 . 1 . . . B 5 A H3' . 25042 2
58 . 2 2 5 5 A H4' H 1 4.420 0.000 . 1 . . . B 5 A H4' . 25042 2
59 . 2 2 5 5 A H8 H 1 8.411 0.003 . 1 . . . B 5 A H8 . 25042 2
60 . 2 2 5 5 A C1' C 13 92.718 0.000 . 1 . . . B 5 A C1' . 25042 2
61 . 2 2 5 5 A C2 C 13 155.288 0.000 . 1 . . . B 5 A C2 . 25042 2
62 . 2 2 5 5 A C2' C 13 75.855 0.000 . 1 . . . B 5 A C2' . 25042 2
63 . 2 2 5 5 A C3' C 13 76.566 0.000 . 1 . . . B 5 A C3' . 25042 2
64 . 2 2 5 5 A C4' C 13 84.100 0.000 . 1 . . . B 5 A C4' . 25042 2
65 . 2 2 5 5 A C8 C 13 143.122 0.000 . 1 . . . B 5 A C8 . 25042 2
66 . 2 2 6 6 C H1' H 1 5.821 0.007 . 1 . . . B 6 C H1' . 25042 2
67 . 2 2 6 6 C H2' H 1 4.405 0.006 . 1 . . . B 6 C H2' . 25042 2
68 . 2 2 6 6 C H3' H 1 4.849 0.012 . 1 . . . B 6 C H3' . 25042 2
69 . 2 2 6 6 C H4' H 1 4.428 0.003 . 1 . . . B 6 C H4' . 25042 2
70 . 2 2 6 6 C H5 H 1 5.745 0.008 . 1 . . . B 6 C H5 . 25042 2
71 . 2 2 6 6 C H6 H 1 7.684 0.007 . 1 . . . B 6 C H6 . 25042 2
72 . 2 2 6 6 C C1' C 13 92.082 0.000 . 1 . . . B 6 C C1' . 25042 2
73 . 2 2 6 6 C C2' C 13 76.198 0.000 . 1 . . . B 6 C C2' . 25042 2
74 . 2 2 6 6 C C3' C 13 77.628 0.000 . 1 . . . B 6 C C3' . 25042 2
75 . 2 2 6 6 C C4' C 13 84.381 0.000 . 1 . . . B 6 C C4' . 25042 2
76 . 2 2 6 6 C C5 C 13 98.104 0.000 . 1 . . . B 6 C C5 . 25042 2
77 . 2 2 6 6 C C6 C 13 142.455 0.000 . 1 . . . B 6 C C6 . 25042 2
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