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 51035
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name assigned_chem_shift_list_1
_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
2 '2D 1H-1H TOCSY' . . . 51035 1
3 '2D 1H-1H NOESY' . . . 51035 1
4 '2D 1H-13C HSQC aromatic' . . . 51035 1
6 '2D 1H-13C HSQC anomeric' . . . 51035 1
stop_
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
2 $software_2 . . 51035 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 DT H1' H 1 5.733 0.0 . 1 . . . . . 1 DT H1' . 51035 1
2 . 1 . 1 1 1 DT H6 H 1 7.2656 0.0 . 1 . . . . . 1 DT H6 . 51035 1
3 . 1 . 1 1 1 DT C6 C 13 139.1064 0.0 . 1 . . . . . 1 DT C6 . 51035 1
4 . 1 . 1 2 2 DA H1' H 1 5.9233 0.0 . 1 . . . . . 2 DA H1' . 51035 1
5 . 1 . 1 2 2 DA H8 H 1 8.319 0.0 . 1 . . . . . 2 DA H8 . 51035 1
6 . 1 . 1 2 2 DA C1' C 13 85.0539 0.0 . 1 . . . . . 2 DA C1' . 51035 1
7 . 1 . 1 3 3 DA H1' H 1 6.2075 0.0 . 1 . . . . . 3 DA H1' . 51035 1
8 . 1 . 1 3 3 DA H8 H 1 8.1998 0.0 . 1 . . . . . 3 DA H8 . 51035 1
9 . 1 . 1 3 3 DA C1' C 13 84.8861 0.0 . 1 . . . . . 3 DA C1' . 51035 1
10 . 1 . 1 3 3 DA C8 C 13 141.1654 0.0 . 1 . . . . . 3 DA C8 . 51035 1
11 . 1 . 1 4 4 DT H1' H 1 5.7502 0.0 . 1 . . . . . 4 DT H1' . 51035 1
12 . 1 . 1 4 4 DT H6 H 1 7.0679 0.0 . 1 . . . . . 4 DT H6 . 51035 1
13 . 1 . 1 4 4 DT C1' C 13 85.0485 0.0 . 1 . . . . . 4 DT C1' . 51035 1
14 . 1 . 1 4 4 DT C6 C 13 138.0928 0.0 . 1 . . . . . 4 DT C6 . 51035 1
15 . 1 . 1 5 5 DG H1' H 1 5.9096 0.0 . 1 . . . . . 5 DG H1' . 51035 1
16 . 1 . 1 5 5 DG H8 H 1 7.7235 0.0 . 1 . . . . . 5 DG H8 . 51035 1
17 . 1 . 1 5 5 DG C1' C 13 84.8131 0.0 . 1 . . . . . 5 DG C1' . 51035 1
18 . 1 . 1 5 5 DG C8 C 13 138.1746 0.0 . 1 . . . . . 5 DG C8 . 51035 1
19 . 1 . 1 6 6 DT H1' H 1 5.7506 0.0 . 1 . . . . . 6 DT H1' . 51035 1
20 . 1 . 1 6 6 DT H6 H 1 7.1957 0.0 . 1 . . . . . 6 DT H6 . 51035 1
21 . 1 . 1 6 6 DT C1' C 13 85.3603 0.0 . 1 . . . . . 6 DT C1' . 51035 1
22 . 1 . 1 6 6 DT C6 C 13 138.5092 0.0 . 1 . . . . . 6 DT C6 . 51035 1
23 . 1 . 1 7 7 DA H1' H 1 6.2083 0.0 . 1 . . . . . 7 DA H1' . 51035 1
24 . 1 . 1 7 7 DA H8 H 1 8.2519 0.0 . 1 . . . . . 7 DA H8 . 51035 1
25 . 1 . 1 7 7 DA C1' C 13 85.0732 0.0 . 1 . . . . . 7 DA C1' . 51035 1
26 . 1 . 1 7 7 DA C8 C 13 141.6183 0.0 . 1 . . . . . 7 DA C8 . 51035 1
27 . 1 . 1 8 8 DT H1' H 1 5.7226 0.0 . 1 . . . . . 8 DT H1' . 51035 1
28 . 1 . 1 8 8 DT H6 H 1 7.0678 0.0 . 1 . . . . . 8 DT H6 . 51035 1
29 . 1 . 1 8 8 DT C1' C 13 84.9335 0.0 . 1 . . . . . 8 DT C1' . 51035 1
30 . 1 . 1 8 8 DT C6 C 13 138.1815 0.0 . 1 . . . . . 8 DT C6 . 51035 1
31 . 1 . 1 9 9 DG H1' H 1 5.8342 0.0 . 1 . . . . . 9 DG H1' . 51035 1
32 . 1 . 1 9 9 DG H8 H 1 7.8002 0.0 . 1 . . . . . 9 DG H8 . 51035 1
33 . 1 . 1 9 9 DG C1' C 13 84.3968 0.0 . 1 . . . . . 9 DG C1' . 51035 1
34 . 1 . 1 9 9 DG C8 C 13 138.1011 0.0 . 1 . . . . . 9 DG C8 . 51035 1
35 . 1 . 1 10 10 DC H1' H 1 5.9549 0.0 . 1 . . . . . 10 DC H1' . 51035 1
36 . 1 . 1 10 10 DC H5 H 1 5.3108 0.0 . 1 . . . . . 10 DC H5 . 51035 1
37 . 1 . 1 10 10 DC H6 H 1 7.3791 0.0 . 1 . . . . . 10 DC H6 . 51035 1
38 . 1 . 1 10 10 DC C1' C 13 85.8981 0.0 . 1 . . . . . 10 DC C1' . 51035 1
39 . 1 . 1 10 10 DC C6 C 13 142.2402 0.0 . 1 . . . . . 10 DC C6 . 51035 1
40 . 1 . 1 11 11 DT H1' H 1 5.9542 0.0 . 1 . . . . . 11 DT H1' . 51035 1
41 . 1 . 1 11 11 DT H6 H 1 7.3728 0.0 . 1 . . . . . 11 DT H6 . 51035 1
42 . 1 . 1 11 11 DT C1' C 13 85.1045 0.0 . 1 . . . . . 11 DT C1' . 51035 1
43 . 1 . 1 11 11 DT C6 C 13 139.849 0.0 . 1 . . . . . 11 DT C6 . 51035 1
44 . 2 . 2 2 2 DA H1' H 1 5.9791 0.0 . 1 . . . . . 2 DA H1' . 51035 1
45 . 2 . 2 2 2 DA C1' C 13 85.2737 0.0 . 1 . . . . . 2 DA C1' . 51035 1
46 . 2 . 2 3 3 DG H1' H 1 5.7625 0.0 . 1 . . . . . 3 DG H1' . 51035 1
47 . 2 . 2 3 3 DG H8 H 1 7.7122 0.0 . 1 . . . . . 3 DG H8 . 51035 1
48 . 2 . 2 3 3 DG C1' C 13 84.0213 0.0 . 1 . . . . . 3 DG C1' . 51035 1
49 . 2 . 2 3 3 DG C8 C 13 137.403 0.0 . 1 . . . . . 3 DG C8 . 51035 1
50 . 2 . 2 4 4 DC H1' H 1 5.663 0.0 . 1 . . . . . 4 DC H1' . 51035 1
51 . 2 . 2 4 4 DC H5 H 1 5.2912 0.0 . 1 . . . . . 4 DC H5 . 51035 1
52 . 2 . 2 4 4 DC H6 H 1 7.3164 0.0 . 1 . . . . . 4 DC H6 . 51035 1
53 . 2 . 2 4 4 DC C1' C 13 86.4304 0.0 . 1 . . . . . 4 DC C1' . 51035 1
54 . 2 . 2 4 4 DC C6 C 13 142.4139 0.0 . 1 . . . . . 4 DC C6 . 51035 1
55 . 2 . 2 5 5 DA H1' H 1 6.2034 0.0 . 1 . . . . . 5 DA H1' . 51035 1
56 . 2 . 2 5 5 DA H8 H 1 8.2524 0.0 . 1 . . . . . 5 DA H8 . 51035 1
57 . 2 . 2 5 5 DA C1' C 13 85.2173 0.0 . 1 . . . . . 5 DA C1' . 51035 1
58 . 2 . 2 5 5 DA C8 C 13 141.8455 0.0 . 1 . . . . . 5 DA C8 . 51035 1
59 . 2 . 2 6 6 DT H1' H 1 5.6142 0.0 . 1 . . . . . 6 DT H1' . 51035 1
60 . 2 . 2 6 6 DT H6 H 1 7.1149 0.0 . 1 . . . . . 6 DT H6 . 51035 1
61 . 2 . 2 6 6 DT C1' C 13 84.7922 0.0 . 1 . . . . . 6 DT C1' . 51035 1
62 . 2 . 2 6 6 DT C6 C 13 138.3002 0.0 . 1 . . . . . 6 DT C6 . 51035 1
63 . 2 . 2 7 7 DA H1' H 1 6.1345 0.0 . 1 . . . . . 7 DA H1' . 51035 1
64 . 2 . 2 7 7 DA H8 H 1 8.1816 0.0 . 1 . . . . . 7 DA H8 . 51035 1
65 . 2 . 2 7 7 DA C1' C 13 84.888 0.0 . 1 . . . . . 7 DA C1' . 51035 1
66 . 2 . 2 7 7 DA C8 C 13 141.6352 0.0 . 1 . . . . . 7 DA C8 . 51035 1
67 . 2 . 2 8 8 DC H1' H 1 5.5294 0.0 . 1 . . . . . 8 DC H1' . 51035 1
68 . 2 . 2 8 8 DC H6 H 1 7.2533 0.0 . 1 . . . . . 8 DC H6 . 51035 1
69 . 2 . 2 8 8 DC C1' C 13 85.9053 0.0 . 1 . . . . . 8 DC C1' . 51035 1
70 . 2 . 2 8 8 DC C6 C 13 142.2162 0.0 . 1 . . . . . 8 DC C6 . 51035 1
71 . 2 . 2 9 9 DA H1' H 1 6.1773 0.0 . 1 . . . . . 9 DA H1' . 51035 1
72 . 2 . 2 9 9 DA H8 H 1 8.1775 0.0 . 1 . . . . . 9 DA H8 . 51035 1
73 . 2 . 2 9 9 DA C1' C 13 85.3846 0.0 . 1 . . . . . 9 DA C1' . 51035 1
74 . 2 . 2 9 9 DA C8 C 13 141.6365 0.0 . 1 . . . . . 9 DA C8 . 51035 1
75 . 2 . 2 10 10 DT H1' H 1 5.9618 0.0 . 1 . . . . . 10 DT H1' . 51035 1
76 . 2 . 2 10 10 DT H6 H 1 7.1931 0.0 . 1 . . . . . 10 DT H6 . 51035 1
77 . 2 . 2 10 10 DT C1' C 13 85.4649 0.0 . 1 . . . . . 10 DT C1' . 51035 1
78 . 2 . 2 10 10 DT C6 C 13 138.3485 0.0 . 1 . . . . . 10 DT C6 . 51035 1
79 . 2 . 2 11 11 DT H1' H 1 5.9619 0.0 . 1 . . . . . 11 DT H1' . 51035 1
80 . 2 . 2 11 11 DT H6 H 1 7.3123 0.0 . 1 . . . . . 11 DT H6 . 51035 1
81 . 2 . 2 11 11 DT C6 C 13 140.0109 0.0 . 1 . . . . . 11 DT C6 . 51035 1
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save_