Content for NMR-STAR saveframe, "assigned_chemical_shifts_3"
save_assigned_chemical_shifts_3
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_3
_Assigned_chem_shift_list.Entry_ID 34685
_Assigned_chem_shift_list.ID 3
_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
9 '2D NOESY' . . . 34685 3
10 '2D 1H-13C HSQC' . . . 34685 3
11 '2D 1H-1H TOCSY' . . . 34685 3
12 '2D 1H-31P COSY' . . . 34685 3
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 5.764 0.01 . 1 . . . . A 1 DC H1' . 34685 3
2 . 1 . 1 1 1 DC H2' H 1 1.880 0.01 . 1 . . . . A 1 DC H2' . 34685 3
3 . 1 . 1 1 1 DC H2'' H 1 2.383 0.01 . 1 . . . . A 1 DC H2'' . 34685 3
4 . 1 . 1 1 1 DC H3' H 1 4.711 0.01 . 1 . . . . A 1 DC H3' . 34685 3
5 . 1 . 1 1 1 DC H4' H 1 4.077 0.01 . 1 . . . . A 1 DC H4' . 34685 3
6 . 1 . 1 1 1 DC H5 H 1 5.906 0.01 . 1 . . . . A 1 DC H5 . 34685 3
7 . 1 . 1 1 1 DC H6 H 1 7.607 0.01 . 1 . . . . A 1 DC H6 . 34685 3
8 . 1 . 1 2 2 DG H1' H 1 5.557 0.01 . 1 . . . . A 2 DG H1' . 34685 3
9 . 1 . 1 2 2 DG H2' H 1 2.751 0.01 . 1 . . . . A 2 DG H2' . 34685 3
10 . 1 . 1 2 2 DG H2'' H 1 2.800 0.01 . 1 . . . . A 2 DG H2'' . 34685 3
11 . 1 . 1 2 2 DG H3' H 1 5.034 0.01 . 1 . . . . A 2 DG H3' . 34685 3
12 . 1 . 1 2 2 DG H4' H 1 4.346 0.01 . 1 . . . . A 2 DG H4' . 34685 3
13 . 1 . 1 2 2 DG H5'' H 1 3.997 0.01 . 2 . . . . A 2 DG H5'' . 34685 3
14 . 1 . 1 2 2 DG H8 H 1 7.953 0.01 . 1 . . . . A 2 DG H8 . 34685 3
15 . 1 . 1 2 2 DG P P 31 -3.886 0.05 . 1 . . . . A 2 DG P . 34685 3
16 . 1 . 1 3 3 DG H1' H 1 6.029 0.01 . 1 . . . . A 3 DG H1' . 34685 3
17 . 1 . 1 3 3 DG H2' H 1 2.680 0.01 . 1 . . . . A 3 DG H2' . 34685 3
18 . 1 . 1 3 3 DG H2'' H 1 2.780 0.01 . 1 . . . . A 3 DG H2'' . 34685 3
19 . 1 . 1 3 3 DG H3' H 1 5.132 0.01 . 1 . . . . A 3 DG H3' . 34685 3
20 . 1 . 1 3 3 DG H4' H 1 4.512 0.01 . 1 . . . . A 3 DG H4' . 34685 3
21 . 1 . 1 3 3 DG H8 H 1 7.891 0.01 . 1 . . . . A 3 DG H8 . 34685 3
22 . 1 . 1 3 3 DG P P 31 -3.761 0.05 . 1 . . . . A 3 DG P . 34685 3
23 . 1 . 1 4 4 DC H1' H 1 5.951 0.01 . 1 . . . . A 4 DC H1' . 34685 3
24 . 1 . 1 4 4 DC H2' H 1 1.404 0.01 . 1 . . . . A 4 DC H2' . 34685 3
25 . 1 . 1 4 4 DC H2'' H 1 2.339 0.01 . 1 . . . . A 4 DC H2'' . 34685 3
26 . 1 . 1 4 4 DC H3' H 1 4.914 0.01 . 1 . . . . A 4 DC H3' . 34685 3
27 . 1 . 1 4 4 DC H4' H 1 4.239 0.01 . 1 . . . . A 4 DC H4' . 34685 3
28 . 1 . 1 4 4 DC H5 H 1 5.417 0.01 . 1 . . . . A 4 DC H5 . 34685 3
29 . 1 . 1 4 4 DC H6 H 1 7.038 0.01 . 1 . . . . A 4 DC H6 . 34685 3
30 . 1 . 1 4 4 DC P P 31 -3.878 0.05 . 1 . . . . A 4 DC P . 34685 3
31 . 1 . 1 5 5 DC H1' H 1 5.390 0.01 . 1 . . . . A 5 DC H1' . 34685 3
32 . 1 . 1 5 5 DC H2' H 1 1.610 0.01 . 1 . . . . A 5 DC H2' . 34685 3
33 . 1 . 1 5 5 DC H2'' H 1 0.632 0.01 . 1 . . . . A 5 DC H2'' . 34685 3
34 . 1 . 1 5 5 DC H3' H 1 4.751 0.01 . 1 . . . . A 5 DC H3' . 34685 3
35 . 1 . 1 5 5 DC H4' H 1 3.843 0.01 . 1 . . . . A 5 DC H4' . 34685 3
36 . 1 . 1 5 5 DC H5 H 1 5.019 0.01 . 1 . . . . A 5 DC H5 . 34685 3
37 . 1 . 1 5 5 DC H6 H 1 7.100 0.01 . 1 . . . . A 5 DC H6 . 34685 3
38 . 1 . 1 5 5 DC P P 31 -4.232 0.05 . 1 . . . . A 5 DC P . 34685 3
39 . 1 . 1 6 6 DG P P 31 -5.058 0.05 . 1 . . . . A 6 DG P . 34685 3
40 . 1 . 1 8 8 DC H1' H 1 6.519 0.01 . 1 . . . . A 8 DC H1' . 34685 3
41 . 1 . 1 8 8 DC H2' H 1 2.665 0.01 . 1 . . . . A 8 DC H2' . 34685 3
42 . 1 . 1 8 8 DC H2'' H 1 2.768 0.01 . 1 . . . . A 8 DC H2'' . 34685 3
43 . 1 . 1 8 8 DC H3' H 1 5.425 0.01 . 1 . . . . A 8 DC H3' . 34685 3
44 . 1 . 1 8 8 DC H5 H 1 6.382 0.01 . 1 . . . . A 8 DC H5 . 34685 3
45 . 1 . 1 8 8 DC H6 H 1 8.330 0.01 . 1 . . . . A 8 DC H6 . 34685 3
46 . 1 . 1 9 9 DG H1' H 1 5.604 0.01 . 1 . . . . A 9 DG H1' . 34685 3
47 . 1 . 1 9 9 DG H2' H 1 2.962 0.01 . 1 . . . . A 9 DG H2' . 34685 3
48 . 1 . 1 9 9 DG H2'' H 1 2.769 0.01 . 1 . . . . A 9 DG H2'' . 34685 3
49 . 1 . 1 9 9 DG H3' H 1 5.069 0.01 . 1 . . . . A 9 DG H3' . 34685 3
50 . 1 . 1 9 9 DG H4' H 1 4.694 0.01 . 1 . . . . A 9 DG H4' . 34685 3
51 . 1 . 1 9 9 DG H5'' H 1 4.356 0.01 . 2 . . . . A 9 DG H5'' . 34685 3
52 . 1 . 1 9 9 DG H8 H 1 8.515 0.01 . 1 . . . . A 9 DG H8 . 34685 3
53 . 1 . 1 9 9 DG P P 31 -4.487 0.05 . 1 . . . . A 9 DG P . 34685 3
54 . 1 . 1 10 10 DA H1' H 1 6.140 0.01 . 1 . . . . A 10 DA H1' . 34685 3
55 . 1 . 1 10 10 DA H2' H 1 2.388 0.01 . 1 . . . . A 10 DA H2' . 34685 3
56 . 1 . 1 10 10 DA H2'' H 1 2.431 0.01 . 1 . . . . A 10 DA H2'' . 34685 3
57 . 1 . 1 10 10 DA H3' H 1 4.678 0.01 . 1 . . . . A 10 DA H3' . 34685 3
58 . 1 . 1 10 10 DA H4' H 1 2.207 0.01 . 1 . . . . A 10 DA H4' . 34685 3
59 . 1 . 1 10 10 DA H5' H 1 3.477 0.01 . 2 . . . . A 10 DA H5' . 34685 3
60 . 1 . 1 10 10 DA H5'' H 1 3.240 0.01 . 2 . . . . A 10 DA H5'' . 34685 3
61 . 1 . 1 10 10 DA H8 H 1 8.314 0.01 . 1 . . . . A 10 DA H8 . 34685 3
62 . 1 . 1 11 11 DA H1' H 1 6.307 0.01 . 1 . . . . A 11 DA H1' . 34685 3
63 . 1 . 1 11 11 DA H2' H 1 3.045 0.01 . 1 . . . . A 11 DA H2' . 34685 3
64 . 1 . 1 11 11 DA H2'' H 1 2.934 0.01 . 1 . . . . A 11 DA H2'' . 34685 3
65 . 1 . 1 11 11 DA H3' H 1 4.928 0.01 . 1 . . . . A 11 DA H3' . 34685 3
66 . 1 . 1 11 11 DA H8 H 1 8.089 0.01 . 1 . . . . A 11 DA H8 . 34685 3
67 . 1 . 1 11 11 DA P P 31 -4.428 0.05 . 1 . . . . A 11 DA P . 34685 3
68 . 1 . 1 12 12 DG H1' H 1 5.135 0.01 . 1 . . . . A 12 DG H1' . 34685 3
69 . 1 . 1 12 12 DG H2' H 1 2.782 0.01 . 1 . . . . A 12 DG H2' . 34685 3
70 . 1 . 1 12 12 DG H2'' H 1 2.681 0.01 . 1 . . . . A 12 DG H2'' . 34685 3
71 . 1 . 1 12 12 DG H3' H 1 4.972 0.01 . 1 . . . . A 12 DG H3' . 34685 3
72 . 1 . 1 12 12 DG H4' H 1 4.400 0.01 . 1 . . . . A 12 DG H4' . 34685 3
73 . 1 . 1 12 12 DG H5' H 1 4.313 0.01 . 2 . . . . A 12 DG H5' . 34685 3
74 . 1 . 1 12 12 DG H5'' H 1 4.168 0.01 . 2 . . . . A 12 DG H5'' . 34685 3
75 . 1 . 1 12 12 DG H8 H 1 8.226 0.01 . 1 . . . . A 12 DG H8 . 34685 3
76 . 1 . 1 12 12 DG P P 31 -4.867 0.05 . 1 . . . . A 12 DG P . 34685 3
77 . 1 . 1 13 13 DA H1' H 1 6.034 0.01 . 1 . . . . A 13 DA H1' . 34685 3
78 . 1 . 1 13 13 DA H2' H 1 2.538 0.01 . 1 . . . . A 13 DA H2' . 34685 3
79 . 1 . 1 13 13 DA H2'' H 1 2.720 0.01 . 1 . . . . A 13 DA H2'' . 34685 3
80 . 1 . 1 13 13 DA H3' H 1 4.915 0.01 . 1 . . . . A 13 DA H3' . 34685 3
81 . 1 . 1 13 13 DA H4' H 1 4.355 0.01 . 1 . . . . A 13 DA H4' . 34685 3
82 . 1 . 1 13 13 DA H5'' H 1 4.071 0.01 . 2 . . . . A 13 DA H5'' . 34685 3
83 . 1 . 1 13 13 DA H8 H 1 8.267 0.01 . 1 . . . . A 13 DA H8 . 34685 3
84 . 1 . 1 13 13 DA P P 31 -3.185 0.05 . 1 . . . . A 13 DA P . 34685 3
85 . 1 . 1 14 14 DC H5 H 1 5.089 0.01 . 1 . . . . A 14 DC H5 . 34685 3
86 . 1 . 1 14 14 DC H6 H 1 6.733 0.01 . 1 . . . . A 14 DC H6 . 34685 3
87 . 1 . 1 16 16 DC H1' H 1 5.915 0.01 . 1 . . . . A 16 DC H1' . 34685 3
88 . 1 . 1 16 16 DC H5 H 1 6.190 0.01 . 1 . . . . A 16 DC H5 . 34685 3
89 . 1 . 1 16 16 DC H6 H 1 7.820 0.01 . 1 . . . . A 16 DC H6 . 34685 3
90 . 1 . 1 19 19 DG H1' H 1 6.725 0.01 . 1 . . . . A 19 DG H1' . 34685 3
91 . 1 . 1 19 19 DG H3' H 1 5.346 0.01 . 1 . . . . A 19 DG H3' . 34685 3
92 . 1 . 1 20 20 DA H1' H 1 6.559 0.01 . 1 . . . . A 20 DA H1' . 34685 3
93 . 1 . 1 20 20 DA H3' H 1 4.872 0.01 . 1 . . . . A 20 DA H3' . 34685 3
94 . 1 . 1 20 20 DA H5' H 1 3.736 0.01 . 2 . . . . A 20 DA H5' . 34685 3
95 . 1 . 1 20 20 DA H5'' H 1 3.549 0.01 . 2 . . . . A 20 DA H5'' . 34685 3
96 . 1 . 1 20 20 DA H8 H 1 8.570 0.01 . 1 . . . . A 20 DA H8 . 34685 3
97 . 1 . 1 21 21 DA H1' H 1 6.714 0.01 . 1 . . . . A 21 DA H1' . 34685 3
98 . 1 . 1 21 21 DA H2' H 1 3.065 0.01 . 1 . . . . A 21 DA H2' . 34685 3
99 . 1 . 1 21 21 DA H2'' H 1 3.304 0.01 . 1 . . . . A 21 DA H2'' . 34685 3
100 . 1 . 1 21 21 DA H3' H 1 5.091 0.01 . 1 . . . . A 21 DA H3' . 34685 3
101 . 1 . 1 21 21 DA H8 H 1 8.584 0.01 . 1 . . . . A 21 DA H8 . 34685 3
102 . 1 . 1 22 22 DG H1' H 1 6.058 0.01 . 1 . . . . A 22 DG H1' . 34685 3
103 . 1 . 1 22 22 DG H2' H 1 2.775 0.01 . 1 . . . . A 22 DG H2' . 34685 3
104 . 1 . 1 22 22 DG H2'' H 1 3.062 0.01 . 1 . . . . A 22 DG H2'' . 34685 3
105 . 1 . 1 22 22 DG H3' H 1 5.106 0.01 . 1 . . . . A 22 DG H3' . 34685 3
106 . 1 . 1 22 22 DG H4' H 1 4.638 0.01 . 1 . . . . A 22 DG H4' . 34685 3
107 . 1 . 1 22 22 DG H5' H 1 4.559 0.01 . 2 . . . . A 22 DG H5' . 34685 3
108 . 1 . 1 22 22 DG H5'' H 1 4.363 0.01 . 2 . . . . A 22 DG H5'' . 34685 3
109 . 1 . 1 22 22 DG H8 H 1 8.410 0.01 . 1 . . . . A 22 DG H8 . 34685 3
110 . 1 . 1 22 22 DG P P 31 -4.665 0.05 . 1 . . . . A 22 DG P . 34685 3
111 . 1 . 1 23 23 DT H1' H 1 6.104 0.01 . 1 . . . . A 23 DT H1' . 34685 3
112 . 1 . 1 23 23 DT H2' H 1 2.399 0.01 . 1 . . . . A 23 DT H2' . 34685 3
113 . 1 . 1 23 23 DT H2'' H 1 2.651 0.01 . 1 . . . . A 23 DT H2'' . 34685 3
114 . 1 . 1 23 23 DT H3' H 1 4.849 0.01 . 1 . . . . A 23 DT H3' . 34685 3
115 . 1 . 1 23 23 DT H4' H 1 4.471 0.01 . 1 . . . . A 23 DT H4' . 34685 3
116 . 1 . 1 23 23 DT H5'' H 1 4.204 0.01 . 2 . . . . A 23 DT H5'' . 34685 3
117 . 1 . 1 23 23 DT H6 H 1 7.462 0.01 . 1 . . . . A 23 DT H6 . 34685 3
118 . 1 . 1 23 23 DT H71 H 1 1.921 0.01 . 3 . . . . A 23 DT H71 . 34685 3
119 . 1 . 1 23 23 DT H72 H 1 1.921 0.01 . 3 . . . . A 23 DT H72 . 34685 3
120 . 1 . 1 23 23 DT H73 H 1 1.921 0.01 . 3 . . . . A 23 DT H73 . 34685 3
121 . 1 . 1 23 23 DT P P 31 -4.341 0.05 . 1 . . . . A 23 DT P . 34685 3
122 . 1 . 1 24 24 DG H1' H 1 5.601 0.01 . 1 . . . . A 24 DG H1' . 34685 3
123 . 1 . 1 24 24 DG H2' H 1 2.290 0.01 . 1 . . . . A 24 DG H2' . 34685 3
124 . 1 . 1 24 24 DG H2'' H 1 2.502 0.01 . 1 . . . . A 24 DG H2'' . 34685 3
125 . 1 . 1 24 24 DG H3' H 1 4.859 0.01 . 1 . . . . A 24 DG H3' . 34685 3
126 . 1 . 1 24 24 DG H8 H 1 7.657 0.01 . 1 . . . . A 24 DG H8 . 34685 3
127 . 1 . 1 25 25 DG H1' H 1 5.676 0.01 . 1 . . . . A 25 DG H1' . 34685 3
128 . 1 . 1 25 25 DG H2' H 1 2.444 0.01 . 1 . . . . A 25 DG H2' . 34685 3
129 . 1 . 1 25 25 DG H2'' H 1 2.577 0.01 . 1 . . . . A 25 DG H2'' . 34685 3
130 . 1 . 1 25 25 DG H3' H 1 4.817 0.01 . 1 . . . . A 25 DG H3' . 34685 3
131 . 1 . 1 25 25 DG H4' H 1 4.114 0.01 . 1 . . . . A 25 DG H4' . 34685 3
132 . 1 . 1 25 25 DG H8 H 1 7.668 0.01 . 1 . . . . A 25 DG H8 . 34685 3
133 . 1 . 1 25 25 DG P P 31 -4.266 0.05 . 1 . . . . A 25 DG P . 34685 3
134 . 1 . 1 26 26 DC H1' H 1 5.821 0.01 . 1 . . . . A 26 DC H1' . 34685 3
135 . 1 . 1 26 26 DC H2' H 1 1.930 0.01 . 1 . . . . A 26 DC H2' . 34685 3
136 . 1 . 1 26 26 DC H2'' H 1 2.339 0.01 . 1 . . . . A 26 DC H2'' . 34685 3
137 . 1 . 1 26 26 DC H3' H 1 4.697 0.01 . 1 . . . . A 26 DC H3' . 34685 3
138 . 1 . 1 26 26 DC H5 H 1 5.192 0.01 . 1 . . . . A 26 DC H5 . 34685 3
139 . 1 . 1 26 26 DC H6 H 1 7.220 0.01 . 1 . . . . A 26 DC H6 . 34685 3
140 . 1 . 1 27 27 DC H1' H 1 5.597 0.01 . 1 . . . . A 27 DC H1' . 34685 3
141 . 1 . 1 27 27 DC H2' H 1 1.940 0.01 . 1 . . . . A 27 DC H2' . 34685 3
142 . 1 . 1 27 27 DC H2'' H 1 2.308 0.01 . 1 . . . . A 27 DC H2'' . 34685 3
143 . 1 . 1 27 27 DC H3' H 1 4.782 0.01 . 1 . . . . A 27 DC H3' . 34685 3
144 . 1 . 1 27 27 DC H4' H 1 4.048 0.01 . 1 . . . . A 27 DC H4' . 34685 3
145 . 1 . 1 27 27 DC H5 H 1 5.594 0.01 . 1 . . . . A 27 DC H5 . 34685 3
146 . 1 . 1 27 27 DC H6 H 1 7.404 0.01 . 1 . . . . A 27 DC H6 . 34685 3
147 . 1 . 1 27 27 DC P P 31 -4.130 0.05 . 1 . . . . A 27 DC P . 34685 3
148 . 1 . 1 28 28 DG H1' H 1 6.201 0.01 . 1 . . . . A 28 DG H1' . 34685 3
149 . 1 . 1 28 28 DG H2' H 1 2.645 0.01 . 1 . . . . A 28 DG H2' . 34685 3
150 . 1 . 1 28 28 DG H2'' H 1 2.391 0.01 . 1 . . . . A 28 DG H2'' . 34685 3
151 . 1 . 1 28 28 DG H8 H 1 7.953 0.01 . 1 . . . . A 28 DG H8 . 34685 3
stop_
save_