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 34436
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name .
_Assigned_chem_shift_list.Sample_condition_list_ID 2
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_2
_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 NOESY' . . . 34436 1
2 '2D NOESY' . . . 34436 1
3 '2D NOESY' . . . 34436 1
4 '2D NOESY' . . . 34436 1
5 '2D TOCSY' . . . 34436 1
6 '2D DQF-COSY' . . . 34436 1
7 '2D 1H-31P COSY' . . . 34436 1
8 '2D 1H-13C HSQC aromatic' . . . 34436 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 11.211 0.004 24 1 . . . . A 1 DG H1 . 34436 1
2 . 1 . 1 1 1 DG H1' H 1 4.360 0.003 35 1 . . . . A 1 DG H1' . 34436 1
3 . 1 . 1 1 1 DG H2' H 1 2.200 0.005 26 1 . . . . A 1 DG H2' . 34436 1
4 . 1 . 1 1 1 DG H2'' H 1 2.512 0.004 28 1 . . . . A 1 DG H2'' . 34436 1
5 . 1 . 1 1 1 DG H3' H 1 4.815 0.006 13 1 . . . . A 1 DG H3' . 34436 1
6 . 1 . 1 1 1 DG H4' H 1 3.513 0.003 17 1 . . . . A 1 DG H4' . 34436 1
7 . 1 . 1 1 1 DG H5' H 1 4.155 0.003 9 1 . . . . A 1 DG H5' . 34436 1
8 . 1 . 1 1 1 DG H5'' H 1 4.080 0.004 10 1 . . . . A 1 DG H5'' . 34436 1
9 . 1 . 1 1 1 DG H8 H 1 6.283 0.003 26 1 . . . . A 1 DG H8 . 34436 1
10 . 1 . 1 1 1 DG H21 H 1 8.976 0.003 2 1 . . . . A 1 DG H21 . 34436 1
11 . 1 . 1 1 1 DG H22 H 1 5.932 0.007 4 1 . . . . A 1 DG H22 . 34436 1
12 . 1 . 1 2 2 DC H1' H 1 5.972 0.002 31 1 . . . . A 2 DC H1' . 34436 1
13 . 1 . 1 2 2 DC H2' H 1 1.096 0.005 25 1 . . . . A 2 DC H2' . 34436 1
14 . 1 . 1 2 2 DC H2'' H 1 2.029 0.005 22 1 . . . . A 2 DC H2'' . 34436 1
15 . 1 . 1 2 2 DC H3' H 1 4.772 0.008 15 1 . . . . A 2 DC H3' . 34436 1
16 . 1 . 1 2 2 DC H4' H 1 4.077 0.004 19 1 . . . . A 2 DC H4' . 34436 1
17 . 1 . 1 2 2 DC H5 H 1 5.045 0.004 26 1 . . . . A 2 DC H5 . 34436 1
18 . 1 . 1 2 2 DC H5' H 1 3.510 0.005 10 2 . . . . A 2 DC H5' . 34436 1
19 . 1 . 1 2 2 DC H5'' H 1 3.510 0.005 10 2 . . . . A 2 DC H5'' . 34436 1
20 . 1 . 1 2 2 DC H6 H 1 6.733 0.003 36 1 . . . . A 2 DC H6 . 34436 1
21 . 1 . 1 2 2 DC H41 H 1 8.724 0.003 17 1 . . . . A 2 DC H41 . 34436 1
22 . 1 . 1 2 2 DC H42 H 1 8.750 0.003 17 1 . . . . A 2 DC H42 . 34436 1
23 . 1 . 1 2 2 DC P P 31 -1.011 0.001 2 1 . . . . A 2 DC P . 34436 1
24 . 1 . 1 3 3 DG H1' H 1 5.154 0.005 27 1 . . . . A 3 DG H1' . 34436 1
25 . 1 . 1 3 3 DG H2' H 1 2.633 0.032 19 1 . . . . A 3 DG H2' . 34436 1
26 . 1 . 1 3 3 DG H2'' H 1 2.047 0.004 16 1 . . . . A 3 DG H2'' . 34436 1
27 . 1 . 1 3 3 DG H3' H 1 4.794 0.005 9 1 . . . . A 3 DG H3' . 34436 1
28 . 1 . 1 3 3 DG H4' H 1 4.320 0.036 3 1 . . . . A 3 DG H4' . 34436 1
29 . 1 . 1 3 3 DG H5' H 1 4.069 0.004 2 2 . . . . A 3 DG H5' . 34436 1
30 . 1 . 1 3 3 DG H5'' H 1 4.069 0.004 2 2 . . . . A 3 DG H5'' . 34436 1
31 . 1 . 1 3 3 DG H8 H 1 7.961 0.002 25 1 . . . . A 3 DG H8 . 34436 1
32 . 1 . 1 3 3 DG P P 31 -1.345 0.002 2 1 . . . . A 3 DG P . 34436 1
33 . 1 . 1 4 4 DG H1' H 1 5.612 0.001 30 1 . . . . A 4 DG H1' . 34436 1
34 . 1 . 1 4 4 DG H2' H 1 2.331 0.006 23 1 . . . . A 4 DG H2' . 34436 1
35 . 1 . 1 4 4 DG H2'' H 1 2.051 0.003 26 1 . . . . A 4 DG H2'' . 34436 1
36 . 1 . 1 4 4 DG H3' H 1 4.449 0.006 27 1 . . . . A 4 DG H3' . 34436 1
37 . 1 . 1 4 4 DG H4' H 1 3.070 0.003 21 1 . . . . A 4 DG H4' . 34436 1
38 . 1 . 1 4 4 DG H5' H 1 2.733 0.008 10 1 . . . . A 4 DG H5' . 34436 1
39 . 1 . 1 4 4 DG H5'' H 1 1.937 0.002 16 1 . . . . A 4 DG H5'' . 34436 1
40 . 1 . 1 4 4 DG H8 H 1 7.737 0.001 26 1 . . . . A 4 DG H8 . 34436 1
41 . 1 . 1 4 4 DG P P 31 -0.614 0.000 1 1 . . . . A 4 DG P . 34436 1
42 . 1 . 1 5 5 DA H1' H 1 6.393 0.002 37 1 . . . . A 5 DA H1' . 34436 1
43 . 1 . 1 5 5 DA H2 H 1 7.948 0.000 6 1 . . . . A 5 DA H2 . 34436 1
44 . 1 . 1 5 5 DA H2' H 1 3.012 0.017 26 1 . . . . A 5 DA H2' . 34436 1
45 . 1 . 1 5 5 DA H2'' H 1 2.936 0.017 26 1 . . . . A 5 DA H2'' . 34436 1
46 . 1 . 1 5 5 DA H3' H 1 5.167 0.003 18 1 . . . . A 5 DA H3' . 34436 1
47 . 1 . 1 5 5 DA H4' H 1 4.355 0.003 22 1 . . . . A 5 DA H4' . 34436 1
48 . 1 . 1 5 5 DA H5' H 1 4.162 0.005 19 1 . . . . A 5 DA H5' . 34436 1
49 . 1 . 1 5 5 DA H5'' H 1 3.853 0.003 24 1 . . . . A 5 DA H5'' . 34436 1
50 . 1 . 1 5 5 DA H8 H 1 8.425 0.003 12 1 . . . . A 5 DA H8 . 34436 1
51 . 1 . 1 5 5 DA P P 31 -1.070 0.001 2 1 . . . . A 5 DA P . 34436 1
52 . 1 . 1 6 6 DG H1 H 1 13.235 0.001 6 1 . . . . A 6 DG H1 . 34436 1
53 . 1 . 1 6 6 DG H1' H 1 5.197 0.005 20 1 . . . . A 6 DG H1' . 34436 1
54 . 1 . 1 6 6 DG H2' H 1 2.514 0.003 21 2 . . . . A 6 DG H2' . 34436 1
55 . 1 . 1 6 6 DG H2'' H 1 2.514 0.003 21 2 . . . . A 6 DG H2'' . 34436 1
56 . 1 . 1 6 6 DG H3' H 1 4.850 0.004 15 1 . . . . A 6 DG H3' . 34436 1
57 . 1 . 1 6 6 DG H4' H 1 4.354 0.005 5 1 . . . . A 6 DG H4' . 34436 1
58 . 1 . 1 6 6 DG H5' H 1 4.154 0.005 5 2 . . . . A 6 DG H5' . 34436 1
59 . 1 . 1 6 6 DG H5'' H 1 4.154 0.005 5 2 . . . . A 6 DG H5'' . 34436 1
60 . 1 . 1 6 6 DG H8 H 1 8.001 0.002 32 1 . . . . A 6 DG H8 . 34436 1
61 . 1 . 1 6 6 DG P P 31 -0.864 0.000 2 1 . . . . A 6 DG P . 34436 1
62 . 1 . 1 7 7 DG H1 H 1 11.650 0.002 17 1 . . . . A 7 DG H1 . 34436 1
63 . 1 . 1 7 7 DG H1' H 1 6.064 0.002 35 1 . . . . A 7 DG H1' . 34436 1
64 . 1 . 1 7 7 DG H2' H 1 2.615 0.004 30 1 . . . . A 7 DG H2' . 34436 1
65 . 1 . 1 7 7 DG H2'' H 1 2.888 0.003 29 1 . . . . A 7 DG H2'' . 34436 1
66 . 1 . 1 7 7 DG H3' H 1 5.081 0.003 30 1 . . . . A 7 DG H3' . 34436 1
67 . 1 . 1 7 7 DG H4' H 1 4.496 0.003 24 1 . . . . A 7 DG H4' . 34436 1
68 . 1 . 1 7 7 DG H5' H 1 4.227 0.004 19 1 . . . . A 7 DG H5' . 34436 1
69 . 1 . 1 7 7 DG H5'' H 1 4.197 0.001 15 1 . . . . A 7 DG H5'' . 34436 1
70 . 1 . 1 7 7 DG H8 H 1 7.868 0.001 36 1 . . . . A 7 DG H8 . 34436 1
71 . 1 . 1 7 7 DG H21 H 1 10.192 0.000 1 1 . . . . A 7 DG H21 . 34436 1
72 . 1 . 1 7 7 DG P P 31 -0.305 0.002 3 1 . . . . A 7 DG P . 34436 1
73 . 1 . 1 8 8 DG H1 H 1 11.407 0.002 19 1 . . . . A 8 DG H1 . 34436 1
74 . 1 . 1 8 8 DG H1' H 1 6.242 0.002 34 1 . . . . A 8 DG H1' . 34436 1
75 . 1 . 1 8 8 DG H2' H 1 2.763 0.004 29 1 . . . . A 8 DG H2' . 34436 1
76 . 1 . 1 8 8 DG H2'' H 1 2.939 0.005 26 1 . . . . A 8 DG H2'' . 34436 1
77 . 1 . 1 8 8 DG H3' H 1 5.071 0.003 28 1 . . . . A 8 DG H3' . 34436 1
78 . 1 . 1 8 8 DG H4' H 1 4.658 0.003 12 1 . . . . A 8 DG H4' . 34436 1
79 . 1 . 1 8 8 DG H5' H 1 4.363 0.004 18 2 . . . . A 8 DG H5' . 34436 1
80 . 1 . 1 8 8 DG H5'' H 1 4.363 0.004 18 2 . . . . A 8 DG H5'' . 34436 1
81 . 1 . 1 8 8 DG H8 H 1 7.785 0.004 34 1 . . . . A 8 DG H8 . 34436 1
82 . 1 . 1 8 8 DG H21 H 1 9.484 0.017 6 1 . . . . A 8 DG H21 . 34436 1
83 . 1 . 1 8 8 DG H22 H 1 8.341 0.014 4 1 . . . . A 8 DG H22 . 34436 1
84 . 1 . 1 8 8 DG P P 31 -1.169 0.001 3 1 . . . . A 8 DG P . 34436 1
85 . 1 . 1 9 9 DG H1 H 1 11.318 0.004 18 1 . . . . A 9 DG H1 . 34436 1
86 . 1 . 1 9 9 DG H1' H 1 6.178 0.002 31 1 . . . . A 9 DG H1' . 34436 1
87 . 1 . 1 9 9 DG H2' H 1 2.265 0.005 29 1 . . . . A 9 DG H2' . 34436 1
88 . 1 . 1 9 9 DG H2'' H 1 2.363 0.006 29 1 . . . . A 9 DG H2'' . 34436 1
89 . 1 . 1 9 9 DG H3' H 1 4.730 0.004 22 1 . . . . A 9 DG H3' . 34436 1
90 . 1 . 1 9 9 DG H4' H 1 3.100 0.003 27 1 . . . . A 9 DG H4' . 34436 1
91 . 1 . 1 9 9 DG H5' H 1 3.878 0.012 26 1 . . . . A 9 DG H5' . 34436 1
92 . 1 . 1 9 9 DG H5'' H 1 3.833 0.008 22 1 . . . . A 9 DG H5'' . 34436 1
93 . 1 . 1 9 9 DG H8 H 1 7.579 0.002 32 1 . . . . A 9 DG H8 . 34436 1
94 . 1 . 1 9 9 DG P P 31 -1.108 0.001 4 1 . . . . A 9 DG P . 34436 1
95 . 1 . 1 10 10 DA H1' H 1 6.635 0.003 45 1 . . . . A 10 DA H1' . 34436 1
96 . 1 . 1 10 10 DA H2 H 1 8.441 0.002 20 1 . . . . A 10 DA H2 . 34436 1
97 . 1 . 1 10 10 DA H2' H 1 3.155 0.003 40 1 . . . . A 10 DA H2' . 34436 1
98 . 1 . 1 10 10 DA H2'' H 1 3.280 0.003 41 1 . . . . A 10 DA H2'' . 34436 1
99 . 1 . 1 10 10 DA H3' H 1 5.495 0.002 49 1 . . . . A 10 DA H3' . 34436 1
100 . 1 . 1 10 10 DA H4' H 1 4.411 0.007 37 1 . . . . A 10 DA H4' . 34436 1
101 . 1 . 1 10 10 DA H5' H 1 4.146 0.005 29 1 . . . . A 10 DA H5' . 34436 1
102 . 1 . 1 10 10 DA H5'' H 1 3.985 0.004 28 1 . . . . A 10 DA H5'' . 34436 1
103 . 1 . 1 10 10 DA H8 H 1 8.925 0.009 37 1 . . . . A 10 DA H8 . 34436 1
104 . 1 . 1 10 10 DA P P 31 0.422 0.001 3 1 . . . . A 10 DA P . 34436 1
105 . 1 . 1 11 11 DG H1 H 1 11.576 0.005 22 1 . . . . A 11 DG H1 . 34436 1
106 . 1 . 1 11 11 DG H1' H 1 6.268 0.001 37 1 . . . . A 11 DG H1' . 34436 1
107 . 1 . 1 11 11 DG H2' H 1 2.410 0.004 32 1 . . . . A 11 DG H2' . 34436 1
108 . 1 . 1 11 11 DG H2'' H 1 2.763 0.004 32 1 . . . . A 11 DG H2'' . 34436 1
109 . 1 . 1 11 11 DG H3' H 1 5.024 0.002 29 1 . . . . A 11 DG H3' . 34436 1
110 . 1 . 1 11 11 DG H4' H 1 4.467 0.002 35 1 . . . . A 11 DG H4' . 34436 1
111 . 1 . 1 11 11 DG H5' H 1 4.288 0.047 23 1 . . . . A 11 DG H5' . 34436 1
112 . 1 . 1 11 11 DG H5'' H 1 4.059 0.179 19 1 . . . . A 11 DG H5'' . 34436 1
113 . 1 . 1 11 11 DG H8 H 1 7.632 0.003 43 1 . . . . A 11 DG H8 . 34436 1
114 . 1 . 1 11 11 DG H21 H 1 9.108 0.008 5 1 . . . . A 11 DG H21 . 34436 1
115 . 1 . 1 11 11 DG H22 H 1 5.609 0.001 4 1 . . . . A 11 DG H22 . 34436 1
116 . 1 . 1 11 11 DG P P 31 0.200 0.001 3 1 . . . . A 11 DG P . 34436 1
117 . 1 . 1 12 12 DG H1 H 1 11.613 0.002 12 1 . . . . A 12 DG H1 . 34436 1
118 . 1 . 1 12 12 DG H1' H 1 6.378 0.001 31 1 . . . . A 12 DG H1' . 34436 1
119 . 1 . 1 12 12 DG H2' H 1 2.621 0.004 27 1 . . . . A 12 DG H2' . 34436 1
120 . 1 . 1 12 12 DG H2'' H 1 2.422 0.005 30 1 . . . . A 12 DG H2'' . 34436 1
121 . 1 . 1 12 12 DG H3' H 1 4.697 0.003 24 1 . . . . A 12 DG H3' . 34436 1
122 . 1 . 1 12 12 DG H4' H 1 4.382 0.003 20 1 . . . . A 12 DG H4' . 34436 1
123 . 1 . 1 12 12 DG H5' H 1 4.237 0.003 24 2 . . . . A 12 DG H5' . 34436 1
124 . 1 . 1 12 12 DG H5'' H 1 4.237 0.003 24 2 . . . . A 12 DG H5'' . 34436 1
125 . 1 . 1 12 12 DG H8 H 1 8.062 0.001 34 1 . . . . A 12 DG H8 . 34436 1
126 . 1 . 1 12 12 DG P P 31 -0.445 0.000 3 1 . . . . A 12 DG P . 34436 1
stop_
save_