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 30111
_Assigned_chem_shift_list.ID 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
1 '2D NOESY 250 ms' . . . 30111 1
6 '2D 1H-31P CORR' . . . 30111 1
7 '2D NOESY 150 ms' . . . 30111 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
4 $software_4 . . 30111 1
stop_
loop_
_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 . 1 1 1 1 DA H1' H 1 6.272 0.003 32 . . . . A 1 DA H1' . 30111 1
2 . 1 1 1 1 DA H2 H 1 8.042 0.005 15 . . . . A 1 DA H2 . 30111 1
3 . 1 1 1 1 DA H2' H 1 2.762 0.006 28 . . . . A 1 DA H2' . 30111 1
4 . 1 1 1 1 DA H2'' H 1 2.914 0.006 28 . . . . A 1 DA H2'' . 30111 1
5 . 1 1 1 1 DA H3' H 1 4.882 0.006 30 . . . . A 1 DA H3' . 30111 1
6 . 1 1 1 1 DA H4' H 1 4.300 0.005 21 . . . . A 1 DA H4' . 30111 1
7 . 1 1 1 1 DA H8 H 1 8.295 0.005 29 . . . . A 1 DA H8 . 30111 1
8 . 1 1 2 2 DT H1' H 1 6.077 0.004 37 . . . . A 2 DT H1' . 30111 1
9 . 1 1 2 2 DT H2' H 1 2.243 0.006 32 . . . . A 2 DT H2' . 30111 1
10 . 1 1 2 2 DT H2'' H 1 2.551 0.004 32 . . . . A 2 DT H2'' . 30111 1
11 . 1 1 2 2 DT H3' H 1 4.905 0.003 29 . . . . A 2 DT H3' . 30111 1
12 . 1 1 2 2 DT H4' H 1 4.302 0.004 22 . . . . A 2 DT H4' . 30111 1
13 . 1 1 2 2 DT H6 H 1 7.447 0.004 53 . . . . A 2 DT H6 . 30111 1
14 . 1 1 2 2 DT H71 H 1 1.358 0.005 42 . . . . A 2 DT H71 . 30111 1
15 . 1 1 2 2 DT H72 H 1 1.358 0.005 42 . . . . A 2 DT H71 . 30111 1
16 . 1 1 2 2 DT H73 H 1 1.358 0.005 42 . . . . A 2 DT H71 . 30111 1
17 . 1 1 2 2 DT P P 31 -0.77 . . . . . . A 2 DT P . 30111 1
18 . 1 1 3 3 DC H1' H 1 6.033 0.004 25 . . . . A 3 DC H1' . 30111 1
19 . 1 1 3 3 DC H2' H 1 2.186 0.005 28 . . . . A 3 DC H2' . 30111 1
20 . 1 1 3 3 DC H2'' H 1 2.497 0.007 28 . . . . A 3 DC H2'' . 30111 1
21 . 1 1 3 3 DC H3' H 1 4.842 0.003 5 . . . . A 3 DC H3' . 30111 1
22 . 1 1 3 3 DC H4' H 1 4.231 0.004 21 . . . . A 3 DC H4' . 30111 1
23 . 1 1 3 3 DC H5 H 1 5.629 0.004 33 . . . . A 3 DC H5 . 30111 1
24 . 1 1 3 3 DC H6 H 1 7.591 0.003 48 . . . . A 3 DC H6 . 30111 1
25 . 1 1 3 3 DC P P 31 -0.65 . . . . . . A 3 DC P . 30111 1
26 . 1 1 4 4 DC H1' H 1 5.575 0.002 21 . . . . A 4 DC H1' . 30111 1
27 . 1 1 4 4 DC H2' H 1 2.009 0.004 24 . . . . A 4 DC H2' . 30111 1
28 . 1 1 4 4 DC H2'' H 1 2.382 0.006 24 . . . . A 4 DC H2'' . 30111 1
29 . 1 1 4 4 DC H3' H 1 4.842 0.005 6 . . . . A 4 DC H3' . 30111 1
30 . 1 1 4 4 DC H4' H 1 4.122 0.001 21 . . . . A 4 DC H4' . 30111 1
31 . 1 1 4 4 DC H5 H 1 5.598 0.001 25 . . . . A 4 DC H5 . 30111 1
32 . 1 1 4 4 DC H6 H 1 7.429 0.005 41 . . . . A 4 DC H6 . 30111 1
33 . 1 1 4 4 DC P P 31 -0.51 . . . . . . A 4 DC P . 30111 1
34 . 1 1 5 5 DG H1' H 1 5.671 0.003 24 . . . . A 5 DG H1' . 30111 1
35 . 1 1 5 5 DG H2' H 1 2.724 0.005 24 . . . . A 5 DG H2' . 30111 1
36 . 1 1 5 5 DG H2'' H 1 2.757 0.002 24 . . . . A 5 DG H2'' . 30111 1
37 . 1 1 5 5 DG H3' H 1 4.996 0.003 25 . . . . A 5 DG H3' . 30111 1
38 . 1 1 5 5 DG H4' H 1 4.355 0.004 22 . . . . A 5 DG H4' . 30111 1
39 . 1 1 5 5 DG H8 H 1 7.874 0.003 40 . . . . A 5 DG H8 . 30111 1
40 . 1 1 5 5 DG P P 31 -0.36 . . . . . . A 5 DG P . 30111 1
41 . 1 1 6 6 DG H1' H 1 5.941 0.005 29 . . . . A 6 DG H1' . 30111 1
42 . 1 1 6 6 DG H2' H 1 2.521 0.008 28 . . . . A 6 DG H2' . 30111 1
43 . 1 1 6 6 DG H2'' H 1 2.742 0.004 28 . . . . A 6 DG H2'' . 30111 1
44 . 1 1 6 6 DG H3' H 1 4.925 0.003 29 . . . . A 6 DG H3' . 30111 1
45 . 1 1 6 6 DG H4' H 1 4.390 0.004 21 . . . . A 6 DG H4' . 30111 1
46 . 1 1 6 6 DG H8 H 1 7.703 0.004 48 . . . . A 6 DG H8 . 30111 1
47 . 1 1 6 6 DG P P 31 -0.43 . . . . . . A 6 DG P . 30111 1
48 . 1 1 7 7 DT H1' H 1 5.616 0.004 25 . . . . A 7 DT H1' . 30111 1
49 . 1 1 7 7 DT H2' H 1 1.988 0.005 24 . . . . A 7 DT H2' . 30111 1
50 . 1 1 7 7 DT H2'' H 1 2.318 0.006 24 . . . . A 7 DT H2'' . 30111 1
51 . 1 1 7 7 DT H3' H 1 4.836 0.001 5 . . . . A 7 DT H3' . 30111 1
52 . 1 1 7 7 DT H4' H 1 4.141 0.002 21 . . . . A 7 DT H4' . 30111 1
53 . 1 1 7 7 DT H6 H 1 7.228 0.004 45 . . . . A 7 DT H6 . 30111 1
54 . 1 1 7 7 DT H71 H 1 1.463 0.004 36 . . . . A 7 DT H71 . 30111 1
55 . 1 1 7 7 DT H72 H 1 1.463 0.004 36 . . . . A 7 DT H71 . 30111 1
56 . 1 1 7 7 DT H73 H 1 1.463 0.004 36 . . . . A 7 DT H71 . 30111 1
57 . 1 1 7 7 DT P P 31 -0.80 . . . . . . A 7 DT P . 30111 1
58 . 1 1 8 8 DA H1' H 1 6.079 0.003 29 . . . . A 8 DA H1' . 30111 1
59 . 1 1 8 8 DA H2 H 1 7.544 0.002 17 . . . . A 8 DA H2 . 30111 1
60 . 1 1 8 8 DA H2' H 1 2.692 0.009 24 . . . . A 8 DA H2' . 30111 1
61 . 1 1 8 8 DA H2'' H 1 2.880 0.005 24 . . . . A 8 DA H2'' . 30111 1
62 . 1 1 8 8 DA H3' H 1 5.021 0.003 27 . . . . A 8 DA H3' . 30111 1
63 . 1 1 8 8 DA H4' H 1 4.396 0.006 22 . . . . A 8 DA H4' . 30111 1
64 . 1 1 8 8 DA H8 H 1 8.195 0.004 41 . . . . A 8 DA H8 . 30111 1
65 . 1 1 8 8 DA P P 31 -0.59 . . . . . . A 8 DA P . 30111 1
66 . 1 1 9 9 DG H1' H 1 6.027 0.005 25 . . . . A 9 DG H1' . 30111 1
67 . 1 1 9 9 DG H2' H 1 2.270 0.004 20 . . . . A 9 DG H2' . 30111 1
68 . 1 1 9 9 DG H2'' H 1 2.432 0.006 20 . . . . A 9 DG H2'' . 30111 1
69 . 1 1 9 9 DG H3' H 1 4.629 0.004 21 . . . . A 9 DG H3' . 30111 1
70 . 1 1 9 9 DG H4' H 1 4.185 0.003 21 . . . . A 9 DG H4' . 30111 1
71 . 1 1 9 9 DG H8 H 1 7.715 0.003 40 . . . . A 9 DG H8 . 30111 1
72 . 1 1 9 9 DG P P 31 -0.53 . . . . . . A 9 DG P . 30111 1
73 . 2 2 1 1 DC H1' H 1 5.896 0.005 29 . . . . B 10 DC H1' . 30111 1
74 . 2 2 1 1 DC H2' H 1 2.186 0.008 32 . . . . B 10 DC H2' . 30111 1
75 . 2 2 1 1 DC H2'' H 1 2.568 0.006 28 . . . . B 10 DC H2'' . 30111 1
76 . 2 2 1 1 DC H3' H 1 4.682 0.004 33 . . . . B 10 DC H3' . 30111 1
77 . 2 2 1 1 DC H4' H 1 4.115 0.006 21 . . . . B 10 DC H4' . 30111 1
78 . 2 2 1 1 DC H5 H 1 5.961 0.006 17 . . . . B 10 DC H5 . 30111 1
79 . 2 2 1 1 DC H6 H 1 7.877 0.005 32 . . . . B 10 DC H6 . 30111 1
80 . 2 2 2 2 DT H1' H 1 5.726 0.005 33 . . . . B 11 DT H1' . 30111 1
81 . 2 2 2 2 DT H2' H 1 2.262 0.003 28 . . . . B 11 DT H2' . 30111 1
82 . 2 2 2 2 DT H2'' H 1 2.562 0.004 28 . . . . B 11 DT H2'' . 30111 1
83 . 2 2 2 2 DT H3' H 1 4.921 0.002 26 . . . . B 11 DT H3' . 30111 1
84 . 2 2 2 2 DT H4' H 1 4.213 0.004 22 . . . . B 11 DT H4' . 30111 1
85 . 2 2 2 2 DT H6 H 1 7.592 0.005 48 . . . . B 11 DT H6 . 30111 1
86 . 2 2 2 2 DT H71 H 1 1.743 0.004 38 . . . . B 11 DT H71 . 30111 1
87 . 2 2 2 2 DT H72 H 1 1.743 0.004 38 . . . . B 11 DT H71 . 30111 1
88 . 2 2 2 2 DT H73 H 1 1.743 0.004 38 . . . . B 11 DT H71 . 30111 1
89 . 2 2 2 2 DT P P 31 -0.73 . . . . . . B 11 DT P . 30111 1
90 . 2 2 3 3 DA H1' H 1 6.264 0.005 36 . . . . B 12 DA H1' . 30111 1
91 . 2 2 3 3 DA H2 H 1 7.574 0.004 9 . . . . B 12 DA H2 . 30111 1
92 . 2 2 3 3 DA H2' H 1 2.768 0.007 28 . . . . B 12 DA H2' . 30111 1
93 . 2 2 3 3 DA H2'' H 1 2.923 0.006 28 . . . . B 12 DA H2'' . 30111 1
94 . 2 2 3 3 DA H3' H 1 5.060 0.004 27 . . . . B 12 DA H3' . 30111 1
95 . 2 2 3 3 DA H4' H 1 4.463 0.004 23 . . . . B 12 DA H4' . 30111 1
96 . 2 2 3 3 DA H8 H 1 8.352 0.003 49 . . . . B 12 DA H8 . 30111 1
97 . 2 2 3 3 DA P P 31 -0.51 . . . . . . B 12 DA P . 30111 1
98 . 2 2 4 4 DC H1' H 1 5.830 0.004 29 . . . . B 13 DC H1' . 30111 1
99 . 2 2 4 4 DC H2' H 1 2.005 0.004 32 . . . . B 13 DC H2' . 30111 1
100 . 2 2 4 4 DC H2'' H 1 2.403 0.005 32 . . . . B 13 DC H2'' . 30111 1
101 . 2 2 4 4 DC H3' H 1 4.773 0.004 30 . . . . B 13 DC H3' . 30111 1
102 . 2 2 4 4 DC H4' H 1 4.209 0.003 21 . . . . B 13 DC H4' . 30111 1
103 . 2 2 4 4 DC H5 H 1 5.275 0.004 33 . . . . B 13 DC H5 . 30111 1
104 . 2 2 4 4 DC H6 H 1 7.306 0.004 49 . . . . B 13 DC H6 . 30111 1
105 . 2 2 4 4 DC P P 31 -0.66 . . . . . . B 13 DC P . 30111 1
106 . 2 2 5 5 DC H1' H 1 5.514 0.005 25 . . . . B 14 DC H1' . 30111 1
107 . 2 2 5 5 DC H2' H 1 1.891 0.004 28 . . . . B 14 DC H2' . 30111 1
108 . 2 2 5 5 DC H2'' H 1 2.291 0.004 28 . . . . B 14 DC H2'' . 30111 1
109 . 2 2 5 5 DC H3' H 1 4.798 0.004 30 . . . . B 14 DC H3' . 30111 1
110 . 2 2 5 5 DC H4' H 1 4.053 0.002 21 . . . . B 14 DC H4' . 30111 1
111 . 2 2 5 5 DC H5 H 1 5.488 0.004 37 . . . . B 14 DC H5 . 30111 1
112 . 2 2 5 5 DC H6 H 1 7.344 0.004 45 . . . . B 14 DC H6 . 30111 1
113 . 2 2 5 5 DC P P 31 -0.54 . . . . . . B 14 DC P . 30111 1
114 . 2 2 6 6 DG H1' H 1 5.540 0.006 25 . . . . B 15 DG H1' . 30111 1
115 . 2 2 6 6 DG H2' H 1 2.638 0.007 24 . . . . B 15 DG H2' . 30111 1
116 . 2 2 6 6 DG H2'' H 1 2.723 0.003 24 . . . . B 15 DG H2'' . 30111 1
117 . 2 2 6 6 DG H3' H 1 4.971 0.003 25 . . . . B 15 DG H3' . 30111 1
118 . 2 2 6 6 DG H4' H 1 4.308 0.005 23 . . . . B 15 DG H4' . 30111 1
119 . 2 2 6 6 DG H8 H 1 7.812 0.004 45 . . . . B 15 DG H8 . 30111 1
120 . 2 2 6 6 DG P P 31 -0.43 . . . . . . B 15 DG P . 30111 1
121 . 2 2 7 7 DG H1' H 1 5.674 0.004 24 . . . . B 16 DG H1' . 30111 1
122 . 2 2 7 7 DG H2' H 1 2.608 0.005 24 . . . . B 16 DG H2' . 30111 1
123 . 2 2 7 7 DG H2'' H 1 2.742 0.004 24 . . . . B 16 DG H2'' . 30111 1
124 . 2 2 7 7 DG H3' H 1 5.000 0.004 25 . . . . B 16 DG H3' . 30111 1
125 . 2 2 7 7 DG H4' H 1 4.380 0.003 21 . . . . B 16 DG H4' . 30111 1
126 . 2 2 7 7 DG H8 H 1 7.728 0.002 45 . . . . B 16 DG H8 . 30111 1
127 . 2 2 7 7 DG P P 31 -0.43 . . . . . . B 16 DG P . 30111 1
128 . 2 2 8 8 DA H1' H 1 6.273 0.005 32 . . . . B 17 DA H1' . 30111 1
129 . 2 2 8 8 DA H2 H 1 8.008 0.002 17 . . . . B 17 DA H2 . 30111 1
130 . 2 2 8 8 DA H2' H 1 2.631 0.005 28 . . . . B 17 DA H2' . 30111 1
131 . 2 2 8 8 DA H2'' H 1 2.889 0.004 28 . . . . B 17 DA H2'' . 30111 1
132 . 2 2 8 8 DA H3' H 1 4.970 0.004 30 . . . . B 17 DA H3' . 30111 1
133 . 2 2 8 8 DA H4' H 1 4.435 0.003 27 . . . . B 17 DA H4' . 30111 1
134 . 2 2 8 8 DA H8 H 1 8.177 0.004 49 . . . . B 17 DA H8 . 30111 1
135 . 2 2 8 8 DA P P 31 -0.43 . . . . . . B 17 DA P . 30111 1
136 . 2 2 9 9 DT H1' H 1 6.119 0.005 29 . . . . B 18 DT H1' . 30111 1
137 . 2 2 9 9 DT H2' H 1 2.135 0.005 20 . . . . B 18 DT H2' . 30111 1
138 . 2 2 9 9 DT H2'' H 1 2.135 0.005 20 . . . . B 18 DT H2'' . 30111 1
139 . 2 2 9 9 DT H3' H 1 4.511 0.004 20 . . . . B 18 DT H3' . 30111 1
140 . 2 2 9 9 DT H4' H 1 4.032 0.062 17 . . . . B 18 DT H4' . 30111 1
141 . 2 2 9 9 DT H6 H 1 7.221 0.004 41 . . . . B 18 DT H6 . 30111 1
142 . 2 2 9 9 DT H71 H 1 1.452 0.005 40 . . . . B 18 DT H71 . 30111 1
143 . 2 2 9 9 DT H72 H 1 1.452 0.005 40 . . . . B 18 DT H71 . 30111 1
144 . 2 2 9 9 DT H73 H 1 1.452 0.005 40 . . . . B 18 DT H71 . 30111 1
145 . 2 2 9 9 DT P P 31 -0.67 . . . . . . B 18 DT P . 30111 1
stop_
save_