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 36698
_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' 1 $sample_1 isotropic 36698 1
2 '2D 1H-1H NOESY' 2 $sample_2 isotropic 36698 1
3 '2D 1H-1H TOCSY' 1 $sample_1 isotropic 36698 1
4 '2D 1H-1H COSY' 1 $sample_1 isotropic 36698 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 DG H1' H 1 6.20 0.02 . 1 . . . . A 1 DG H1' . 36698 1
2 . 1 . 1 1 1 DG H2' H 1 2.80 0.02 . 1 . . . . A 1 DG H2' . 36698 1
3 . 1 . 1 1 1 DG H2'' H 1 2.80 0.02 . 1 . . . . A 1 DG H2'' . 36698 1
4 . 1 . 1 1 1 DG H3' H 1 5.05 0.02 . 1 . . . . A 1 DG H3' . 36698 1
5 . 1 . 1 1 1 DG H8 H 1 7.90 0.02 . 1 . . . . A 1 DG H8 . 36698 1
6 . 1 . 1 2 2 DG H1 H 1 11.12 0.02 . 1 . . . . A 2 DG H1 . 36698 1
7 . 1 . 1 2 2 DG H1' H 1 6.08 0.02 . 1 . . . . A 2 DG H1' . 36698 1
8 . 1 . 1 2 2 DG H2' H 1 3.63 0.02 . 1 . . . . A 2 DG H2' . 36698 1
9 . 1 . 1 2 2 DG H2'' H 1 2.87 0.02 . 1 . . . . A 2 DG H2'' . 36698 1
10 . 1 . 1 2 2 DG H8 H 1 7.51 0.02 . 1 . . . . A 2 DG H8 . 36698 1
11 . 1 . 1 3 3 DG H1 H 1 11.99 0.02 . 1 . . . . A 3 DG H1 . 36698 1
12 . 1 . 1 3 3 DG H1' H 1 5.64 0.02 . 1 . . . . A 3 DG H1' . 36698 1
13 . 1 . 1 3 3 DG H2' H 1 2.60 0.02 . 1 . . . . A 3 DG H2' . 36698 1
14 . 1 . 1 3 3 DG H2'' H 1 2.53 0.02 . 1 . . . . A 3 DG H2'' . 36698 1
15 . 1 . 1 3 3 DG H3' H 1 4.95 0.02 . 1 . . . . A 3 DG H3' . 36698 1
16 . 1 . 1 3 3 DG H4' H 1 4.44 0.02 . 1 . . . . A 3 DG H4' . 36698 1
17 . 1 . 1 3 3 DG H8 H 1 7.97 0.02 . 1 . . . . A 3 DG H8 . 36698 1
18 . 1 . 1 4 4 DC H1' H 1 6.05 0.02 . 1 . . . . A 4 DC H1' . 36698 1
19 . 1 . 1 4 4 DC H2' H 1 2.51 0.02 . 1 . . . . A 4 DC H2' . 36698 1
20 . 1 . 1 4 4 DC H2'' H 1 2.51 0.02 . 1 . . . . A 4 DC H2'' . 36698 1
21 . 1 . 1 4 4 DC H5 H 1 5.01 0.02 . 1 . . . . A 4 DC H5 . 36698 1
22 . 1 . 1 4 4 DC H6 H 1 7.24 0.02 . 1 . . . . A 4 DC H6 . 36698 1
23 . 1 . 1 4 4 DC H41 H 1 9.27 0.02 . 1 . . . . A 4 DC H41 . 36698 1
24 . 1 . 1 4 4 DC H42 H 1 8.63 0.02 . 1 . . . . A 4 DC H42 . 36698 1
25 . 1 . 1 5 5 DC H1' H 1 5.37 0.02 . 1 . . . . A 5 DC H1' . 36698 1
26 . 1 . 1 5 5 DC H2' H 1 1.27 0.02 . 1 . . . . A 5 DC H2' . 36698 1
27 . 1 . 1 5 5 DC H2'' H 1 2.34 0.02 . 1 . . . . A 5 DC H2'' . 36698 1
28 . 1 . 1 5 5 DC H3' H 1 4.44 0.02 . 1 . . . . A 5 DC H3' . 36698 1
29 . 1 . 1 5 5 DC H5 H 1 5.42 0.02 . 1 . . . . A 5 DC H5 . 36698 1
30 . 1 . 1 5 5 DC H6 H 1 7.14 0.02 . 1 . . . . A 5 DC H6 . 36698 1
31 . 1 . 1 5 5 DC H41 H 1 8.48 0.02 . 1 . . . . A 5 DC H41 . 36698 1
32 . 1 . 1 5 5 DC H42 H 1 7.30 0.02 . 1 . . . . A 5 DC H42 . 36698 1
33 . 1 . 1 6 6 DT H1' H 1 6.02 0.02 . 1 . . . . A 6 DT H1' . 36698 1
34 . 1 . 1 6 6 DT H2' H 1 2.09 0.02 . 1 . . . . A 6 DT H2' . 36698 1
35 . 1 . 1 6 6 DT H2'' H 1 2.26 0.02 . 1 . . . . A 6 DT H2'' . 36698 1
36 . 1 . 1 6 6 DT H3' H 1 4.70 0.02 . 1 . . . . A 6 DT H3' . 36698 1
37 . 1 . 1 6 6 DT H6 H 1 7.36 0.02 . 1 . . . . A 6 DT H6 . 36698 1
38 . 1 . 1 6 6 DT H71 H 1 1.50 0.02 . 1 . . . . A 6 DT H71 . 36698 1
39 . 1 . 1 6 6 DT H72 H 1 1.50 0.02 . 1 . . . . A 6 DT H72 . 36698 1
40 . 1 . 1 6 6 DT H73 H 1 1.50 0.02 . 1 . . . . A 6 DT H73 . 36698 1
41 . 1 . 1 7 7 DG H1 H 1 12.96 0.02 . 1 . . . . A 7 DG H1 . 36698 1
42 . 1 . 1 7 7 DG H1' H 1 6.14 0.02 . 1 . . . . A 7 DG H1' . 36698 1
43 . 1 . 1 7 7 DG H2' H 1 2.53 0.02 . 1 . . . . A 7 DG H2' . 36698 1
44 . 1 . 1 7 7 DG H2'' H 1 2.90 0.02 . 1 . . . . A 7 DG H2'' . 36698 1
45 . 1 . 1 7 7 DG H8 H 1 7.81 0.02 . 1 . . . . A 7 DG H8 . 36698 1
46 . 1 . 1 8 8 DG H1 H 1 11.25 0.02 . 1 . . . . A 8 DG H1 . 36698 1
47 . 1 . 1 8 8 DG H1' H 1 5.83 0.02 . 1 . . . . A 8 DG H1' . 36698 1
48 . 1 . 1 8 8 DG H2' H 1 3.21 0.02 . 1 . . . . A 8 DG H2' . 36698 1
49 . 1 . 1 8 8 DG H2'' H 1 2.76 0.02 . 1 . . . . A 8 DG H2'' . 36698 1
50 . 1 . 1 8 8 DG H3' H 1 5.03 0.02 . 1 . . . . A 8 DG H3' . 36698 1
51 . 1 . 1 8 8 DG H4' H 1 4.41 0.02 . 1 . . . . A 8 DG H4' . 36698 1
52 . 1 . 1 8 8 DG H8 H 1 7.11 0.02 . 1 . . . . A 8 DG H8 . 36698 1
53 . 1 . 1 9 9 DG H1 H 1 10.80 0.02 . 1 . . . . A 9 DG H1 . 36698 1
54 . 1 . 1 9 9 DG H1' H 1 5.74 0.02 . 1 . . . . A 9 DG H1' . 36698 1
55 . 1 . 1 9 9 DG H2' H 1 2.75 0.02 . 1 . . . . A 9 DG H2' . 36698 1
56 . 1 . 1 9 9 DG H2'' H 1 2.52 0.02 . 1 . . . . A 9 DG H2'' . 36698 1
57 . 1 . 1 9 9 DG H8 H 1 8.07 0.02 . 1 . . . . A 9 DG H8 . 36698 1
58 . 1 . 1 10 10 DC H1' H 1 6.12 0.02 . 1 . . . . A 10 DC H1' . 36698 1
59 . 1 . 1 10 10 DC H2' H 1 2.40 0.02 . 1 . . . . A 10 DC H2' . 36698 1
60 . 1 . 1 10 10 DC H2'' H 1 2.17 0.02 . 1 . . . . A 10 DC H2'' . 36698 1
61 . 1 . 1 10 10 DC H3' H 1 4.68 0.02 . 1 . . . . A 10 DC H3' . 36698 1
62 . 1 . 1 10 10 DC H5 H 1 5.85 0.02 . 1 . . . . A 10 DC H5 . 36698 1
63 . 1 . 1 10 10 DC H6 H 1 7.81 0.02 . 1 . . . . A 10 DC H6 . 36698 1
64 . 1 . 1 11 11 DC H1' H 1 6.05 0.02 . 1 . . . . A 11 DC H1' . 36698 1
65 . 1 . 1 11 11 DC H2' H 1 2.61 0.02 . 1 . . . . A 11 DC H2' . 36698 1
66 . 1 . 1 11 11 DC H2'' H 1 2.31 0.02 . 1 . . . . A 11 DC H2'' . 36698 1
67 . 1 . 1 11 11 DC H3' H 1 4.91 0.02 . 1 . . . . A 11 DC H3' . 36698 1
68 . 1 . 1 11 11 DC H4' H 1 4.52 0.02 . 1 . . . . A 11 DC H4' . 36698 1
69 . 1 . 1 11 11 DC H5 H 1 5.69 0.02 . 1 . . . . A 11 DC H5 . 36698 1
70 . 1 . 1 11 11 DC H6 H 1 7.64 0.02 . 1 . . . . A 11 DC H6 . 36698 1
71 . 1 . 1 12 12 DT H1' H 1 5.81 0.02 . 1 . . . . A 12 DT H1' . 36698 1
72 . 1 . 1 12 12 DT H2' H 1 1.48 0.02 . 1 . . . . A 12 DT H2' . 36698 1
73 . 1 . 1 12 12 DT H2'' H 1 2.03 0.02 . 1 . . . . A 12 DT H2'' . 36698 1
74 . 1 . 1 12 12 DT H6 H 1 7.19 0.02 . 1 . . . . A 12 DT H6 . 36698 1
75 . 1 . 1 12 12 DT H71 H 1 1.36 0.02 . 1 . . . . A 12 DT H71 . 36698 1
76 . 1 . 1 12 12 DT H72 H 1 1.36 0.02 . 1 . . . . A 12 DT H72 . 36698 1
77 . 1 . 1 12 12 DT H73 H 1 1.36 0.02 . 1 . . . . A 12 DT H73 . 36698 1
78 . 1 . 1 13 13 DG H1' H 1 6.04 0.02 . 1 . . . . A 13 DG H1' . 36698 1
79 . 1 . 1 13 13 DG H8 H 1 7.54 0.02 . 1 . . . . A 13 DG H8 . 36698 1
80 . 1 . 1 14 14 DG H1 H 1 11.60 0.02 . 1 . . . . A 14 DG H1 . 36698 1
81 . 1 . 1 14 14 DG H1' H 1 5.97 0.02 . 1 . . . . A 14 DG H1' . 36698 1
82 . 1 . 1 14 14 DG H2' H 1 3.46 0.02 . 1 . . . . A 14 DG H2' . 36698 1
83 . 1 . 1 14 14 DG H2'' H 1 2.83 0.02 . 1 . . . . A 14 DG H2'' . 36698 1
84 . 1 . 1 14 14 DG H3' H 1 4.97 0.02 . 1 . . . . A 14 DG H3' . 36698 1
85 . 1 . 1 14 14 DG H4' H 1 4.59 0.02 . 1 . . . . A 14 DG H4' . 36698 1
86 . 1 . 1 14 14 DG H8 H 1 6.87 0.02 . 1 . . . . A 14 DG H8 . 36698 1
87 . 1 . 1 15 15 DG H1 H 1 11.90 0.02 . 1 . . . . A 15 DG H1 . 36698 1
88 . 1 . 1 15 15 DG H1' H 1 5.79 0.02 . 1 . . . . A 15 DG H1' . 36698 1
89 . 1 . 1 15 15 DG H2' H 1 2.69 0.02 . 1 . . . . A 15 DG H2' . 36698 1
90 . 1 . 1 15 15 DG H2'' H 1 2.65 0.02 . 1 . . . . A 15 DG H2'' . 36698 1
91 . 1 . 1 15 15 DG H3' H 1 5.04 0.02 . 1 . . . . A 15 DG H3' . 36698 1
92 . 1 . 1 15 15 DG H4' H 1 4.49 0.02 . 1 . . . . A 15 DG H4' . 36698 1
93 . 1 . 1 15 15 DG H8 H 1 8.04 0.02 . 1 . . . . A 15 DG H8 . 36698 1
94 . 1 . 1 16 16 DC H1' H 1 6.13 0.02 . 1 . . . . A 16 DC H1' . 36698 1
95 . 1 . 1 16 16 DC H2' H 1 2.46 0.02 . 1 . . . . A 16 DC H2' . 36698 1
96 . 1 . 1 16 16 DC H2'' H 1 2.54 0.02 . 1 . . . . A 16 DC H2'' . 36698 1
97 . 1 . 1 16 16 DC H3' H 1 4.48 0.02 . 1 . . . . A 16 DC H3' . 36698 1
98 . 1 . 1 16 16 DC H5 H 1 5.00 0.02 . 1 . . . . A 16 DC H5 . 36698 1
99 . 1 . 1 16 16 DC H6 H 1 7.24 0.02 . 1 . . . . A 16 DC H6 . 36698 1
100 . 1 . 1 16 16 DC H41 H 1 9.56 0.02 . 1 . . . . A 16 DC H41 . 36698 1
101 . 1 . 1 16 16 DC H42 H 1 8.74 0.02 . 1 . . . . A 16 DC H42 . 36698 1
102 . 1 . 1 17 17 DC H1' H 1 5.43 0.02 . 1 . . . . A 17 DC H1' . 36698 1
103 . 1 . 1 17 17 DC H2' H 1 1.26 0.02 . 1 . . . . A 17 DC H2' . 36698 1
104 . 1 . 1 17 17 DC H2'' H 1 2.35 0.02 . 1 . . . . A 17 DC H2'' . 36698 1
105 . 1 . 1 17 17 DC H3' H 1 4.44 0.02 . 1 . . . . A 17 DC H3' . 36698 1
106 . 1 . 1 17 17 DC H5 H 1 5.46 0.02 . 1 . . . . A 17 DC H5 . 36698 1
107 . 1 . 1 17 17 DC H6 H 1 7.17 0.02 . 1 . . . . A 17 DC H6 . 36698 1
108 . 1 . 1 17 17 DC H41 H 1 8.68 0.02 . 1 . . . . A 17 DC H41 . 36698 1
109 . 1 . 1 17 17 DC H42 H 1 7.49 0.02 . 1 . . . . A 17 DC H42 . 36698 1
110 . 1 . 1 18 18 DT H1' H 1 5.99 0.02 . 1 . . . . A 18 DT H1' . 36698 1
111 . 1 . 1 18 18 DT H2' H 1 2.06 0.02 . 1 . . . . A 18 DT H2' . 36698 1
112 . 1 . 1 18 18 DT H2'' H 1 2.24 0.02 . 1 . . . . A 18 DT H2'' . 36698 1
113 . 1 . 1 18 18 DT H3' H 1 4.67 0.02 . 1 . . . . A 18 DT H3' . 36698 1
114 . 1 . 1 18 18 DT H6 H 1 7.31 0.02 . 1 . . . . A 18 DT H6 . 36698 1
115 . 1 . 1 18 18 DT H71 H 1 1.46 0.02 . 1 . . . . A 18 DT H71 . 36698 1
116 . 1 . 1 18 18 DT H72 H 1 1.46 0.02 . 1 . . . . A 18 DT H72 . 36698 1
117 . 1 . 1 18 18 DT H73 H 1 1.46 0.02 . 1 . . . . A 18 DT H73 . 36698 1
118 . 1 . 1 19 19 DG H1 H 1 13.60 0.02 . 1 . . . . A 19 DG H1 . 36698 1
119 . 1 . 1 19 19 DG H1' H 1 6.04 0.02 . 1 . . . . A 19 DG H1' . 36698 1
120 . 1 . 1 19 19 DG H2' H 1 2.51 0.02 . 1 . . . . A 19 DG H2' . 36698 1
121 . 1 . 1 19 19 DG H2'' H 1 2.93 0.02 . 1 . . . . A 19 DG H2'' . 36698 1
122 . 1 . 1 19 19 DG H8 H 1 7.76 0.02 . 1 . . . . A 19 DG H8 . 36698 1
123 . 1 . 1 20 20 DG H1 H 1 11.10 0.02 . 1 . . . . A 20 DG H1 . 36698 1
124 . 1 . 1 20 20 DG H1' H 1 5.89 0.02 . 1 . . . . A 20 DG H1' . 36698 1
125 . 1 . 1 20 20 DG H2' H 1 3.02 0.02 . 1 . . . . A 20 DG H2' . 36698 1
126 . 1 . 1 20 20 DG H2'' H 1 2.76 0.02 . 1 . . . . A 20 DG H2'' . 36698 1
127 . 1 . 1 20 20 DG H3' H 1 5.01 0.02 . 1 . . . . A 20 DG H3' . 36698 1
128 . 1 . 1 20 20 DG H4' H 1 4.37 0.02 . 1 . . . . A 20 DG H4' . 36698 1
129 . 1 . 1 20 20 DG H8 H 1 7.32 0.02 . 1 . . . . A 20 DG H8 . 36698 1
130 . 1 . 1 21 21 DG H1 H 1 11.22 0.02 . 1 . . . . A 21 DG H1 . 36698 1
131 . 1 . 1 21 21 DG H1' H 1 6.04 0.02 . 1 . . . . A 21 DG H1' . 36698 1
132 . 1 . 1 21 21 DG H2' H 1 2.72 0.02 . 1 . . . . A 21 DG H2' . 36698 1
133 . 1 . 1 21 21 DG H2'' H 1 2.90 0.02 . 1 . . . . A 21 DG H2'' . 36698 1
134 . 1 . 1 21 21 DG H3' H 1 5.11 0.02 . 1 . . . . A 21 DG H3' . 36698 1
135 . 1 . 1 21 21 DG H4' H 1 4.52 0.02 . 1 . . . . A 21 DG H4' . 36698 1
136 . 1 . 1 21 21 DG H8 H 1 7.93 0.02 . 1 . . . . A 21 DG H8 . 36698 1
stop_
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