Content for NMR-STAR saveframe, "assigned_chem_shift_list_1"
save_assigned_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 25723
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $D2O_conditions
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_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
3 '2D 1H-1H NOESY 250 ms' . . . 25723 1
8 '2D 1H-31P CORR' . . . 25723 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 $SPARKY . . 25723 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 6.215 0.002 . 1 . . . A 1 DA H1' . 25723 1
2 . 1 1 1 1 DA H2 H 1 7.995 0.001 . 1 . . . A 1 DA H2 . 25723 1
3 . 1 1 1 1 DA H2' H 1 2.637 0.003 . 1 . . . A 1 DA H2' . 25723 1
4 . 1 1 1 1 DA H2'' H 1 2.790 0.004 . 1 . . . A 1 DA H2'' . 25723 1
5 . 1 1 1 1 DA H3' H 1 4.872 0.001 . 1 . . . A 1 DA H3' . 25723 1
6 . 1 1 1 1 DA H4' H 1 4.269 0.001 . 1 . . . A 1 DA H4' . 25723 1
7 . 1 1 1 1 DA H5' H 1 3.772 0.001 . 1 . . . A 1 DA H5' . 25723 1
8 . 1 1 1 1 DA H5'' H 1 3.772 0.001 . 1 . . . A 1 DA H5'' . 25723 1
9 . 1 1 1 1 DA H8 H 1 8.173 0.002 . 1 . . . A 1 DA H8 . 25723 1
10 . 1 1 2 2 DT H1' H 1 5.536 0.002 . 1 . . . A 2 DT H1' . 25723 1
11 . 1 1 2 2 DT H2' H 1 2.068 0.004 . 1 . . . A 2 DT H2' . 25723 1
12 . 1 1 2 2 DT H2'' H 1 2.301 0.002 . 1 . . . A 2 DT H2'' . 25723 1
13 . 1 1 2 2 DT H3' H 1 4.832 0.002 . 1 . . . A 2 DT H3' . 25723 1
14 . 1 1 2 2 DT H4' H 1 4.142 0.001 . 1 . . . A 2 DT H4' . 25723 1
15 . 1 1 2 2 DT H6 H 1 7.318 0.002 . 1 . . . A 2 DT H6 . 25723 1
16 . 1 1 2 2 DT H71 H 1 1.446 0.001 . 1 . . . A 2 DT H7 . 25723 1
17 . 1 1 2 2 DT H72 H 1 1.446 0.001 . 1 . . . A 2 DT H7 . 25723 1
18 . 1 1 2 2 DT H73 H 1 1.446 0.001 . 1 . . . A 2 DT H7 . 25723 1
19 . 1 1 2 2 DT P P 31 -0.567 0.000 . 1 . . . A 2 DT P . 25723 1
20 . 1 1 3 3 DG H1' H 1 5.491 0.001 . 1 . . . A 3 DG H1' . 25723 1
21 . 1 1 3 3 DG H2' H 1 2.653 0.013 . 1 . . . A 3 DG H2' . 25723 1
22 . 1 1 3 3 DG H2'' H 1 2.682 0.006 . 1 . . . A 3 DG H2'' . 25723 1
23 . 1 1 3 3 DG H3' H 1 4.960 0.001 . 1 . . . A 3 DG H3' . 25723 1
24 . 1 1 3 3 DG H4' H 1 4.318 0.001 . 1 . . . A 3 DG H4' . 25723 1
25 . 1 1 3 3 DG H8 H 1 7.841 0.001 . 1 . . . A 3 DG H8 . 25723 1
26 . 1 1 3 3 DG P P 31 -0.028 0.000 . 1 . . . A 3 DG P . 25723 1
27 . 1 1 4 4 DG H1' H 1 5.714 0.002 . 1 . . . A 4 DG H1' . 25723 1
28 . 1 1 4 4 DG H2' H 1 2.528 0.004 . 1 . . . A 4 DG H2' . 25723 1
29 . 1 1 4 4 DG H2'' H 1 2.861 0.002 . 1 . . . A 4 DG H2'' . 25723 1
30 . 1 1 4 4 DG H3' H 1 4.987 0.002 . 1 . . . A 4 DG H3' . 25723 1
31 . 1 1 4 4 DG H4' H 1 4.336 0.002 . 1 . . . A 4 DG H4' . 25723 1
32 . 1 1 4 4 DG H8 H 1 7.685 0.004 . 1 . . . A 4 DG H8 . 25723 1
33 . 1 1 4 4 DG P P 31 0.020 0.000 . 1 . . . A 4 DG P . 25723 1
34 . 1 1 5 5 4EN H1' H 1 6.035 0.001 . 1 . . . A 5 UB H1' . 25723 1
35 . 1 1 5 5 4EN H2' H 1 2.552 0.002 . 1 . . . A 5 UB H2' . 25723 1
36 . 1 1 5 5 4EN H2'' H 1 2.758 0.003 . 1 . . . A 5 UB H2'' . 25723 1
37 . 1 1 5 5 4EN H3' H 1 4.961 0.002 . 1 . . . A 5 UB H3' . 25723 1
38 . 1 1 5 5 4EN H4' H 1 4.415 0.005 . 1 . . . A 5 UB H4' . 25723 1
39 . 1 1 5 5 4EN H7 H 1 8.108 0.001 . 1 . . . A 5 UB H7 . 25723 1
40 . 1 1 5 5 4EN P P 31 -0.198 0.000 . 1 . . . A 5 UB P . 25723 1
41 . 1 1 6 6 DG H1' H 1 5.768 0.002 . 1 . . . A 6 DG H1' . 25723 1
42 . 1 1 6 6 DG H2' H 1 2.543 0.004 . 1 . . . A 6 DG H2' . 25723 1
43 . 1 1 6 6 DG H2'' H 1 2.627 0.004 . 1 . . . A 6 DG H2'' . 25723 1
44 . 1 1 6 6 DG H3' H 1 4.935 0.003 . 1 . . . A 6 DG H3' . 25723 1
45 . 1 1 6 6 DG H4' H 1 4.394 0.002 . 1 . . . A 6 DG H4' . 25723 1
46 . 1 1 6 6 DG H8 H 1 7.660 0.001 . 1 . . . A 6 DG H8 . 25723 1
47 . 1 1 6 6 DG P P 31 -1.037 0.000 . 1 . . . A 6 DG P . 25723 1
48 . 1 1 7 7 DC H1' H 1 5.903 0.002 . 1 . . . A 7 DC H1' . 25723 1
49 . 1 1 7 7 DC H2' H 1 2.098 0.002 . 1 . . . A 7 DC H2' . 25723 1
50 . 1 1 7 7 DC H2'' H 1 2.507 0.008 . 1 . . . A 7 DC H2'' . 25723 1
51 . 1 1 7 7 DC H3' H 1 4.698 0.001 . 1 . . . A 7 DC H3' . 25723 1
52 . 1 1 7 7 DC H4' H 1 4.190 0.002 . 1 . . . A 7 DC H4' . 25723 1
53 . 1 1 7 7 DC H5 H 1 5.279 0.002 . 1 . . . A 7 DC H5 . 25723 1
54 . 1 1 7 7 DC H6 H 1 7.386 0.002 . 1 . . . A 7 DC H6 . 25723 1
55 . 1 1 7 7 DC P P 31 -0.296 0.000 . 1 . . . A 7 DC P . 25723 1
56 . 1 1 8 8 DT H1' H 1 6.141 0.004 . 1 . . . A 8 DT H1' . 25723 1
57 . 1 1 8 8 DT H2' H 1 2.198 0.007 . 1 . . . A 8 DT H2' . 25723 1
58 . 1 1 8 8 DT H2'' H 1 2.540 0.006 . 1 . . . A 8 DT H2'' . 25723 1
59 . 1 1 8 8 DT H3' H 1 4.882 0.001 . 1 . . . A 8 DT H3' . 25723 1
60 . 1 1 8 8 DT H4' H 1 4.180 0.002 . 1 . . . A 8 DT H4' . 25723 1
61 . 1 1 8 8 DT H6 H 1 7.515 0.001 . 1 . . . A 8 DT H6 . 25723 1
62 . 1 1 8 8 DT H71 H 1 1.671 0.001 . 1 . . . A 8 DT H7 . 25723 1
63 . 1 1 8 8 DT H72 H 1 1.671 0.001 . 1 . . . A 8 DT H7 . 25723 1
64 . 1 1 8 8 DT H73 H 1 1.671 0.001 . 1 . . . A 8 DT H7 . 25723 1
65 . 1 1 8 8 DT P P 31 -0.686 0.000 . 1 . . . A 8 DT P . 25723 1
66 . 1 1 9 9 DC H1' H 1 6.297 0.001 . 1 . . . A 9 DC H1' . 25723 1
67 . 1 1 9 9 DC H2' H 1 2.288 0.000 . 1 . . . A 9 DC H2' . 25723 1
68 . 1 1 9 9 DC H2'' H 1 2.288 0.001 . 1 . . . A 9 DC H2'' . 25723 1
69 . 1 1 9 9 DC H3' H 1 4.590 0.001 . 1 . . . A 9 DC H3' . 25723 1
70 . 1 1 9 9 DC H4' H 1 4.034 0.003 . 1 . . . A 9 DC H4' . 25723 1
71 . 1 1 9 9 DC H5 H 1 5.829 0.003 . 1 . . . A 9 DC H5 . 25723 1
72 . 1 1 9 9 DC H6 H 1 7.677 0.003 . 1 . . . A 9 DC H6 . 25723 1
73 . 1 1 9 9 DC P P 31 -0.309 0.000 . 1 . . . A 9 DC P . 25723 1
74 . 2 2 1 1 DG H1' H 1 5.572 0.001 . 1 . . . B 10 DG H1' . 25723 1
75 . 2 2 1 1 DG H2' H 1 2.512 0.002 . 1 . . . B 10 DG H2' . 25723 1
76 . 2 2 1 1 DG H2'' H 1 2.708 0.003 . 1 . . . B 10 DG H2'' . 25723 1
77 . 2 2 1 1 DG H3' H 1 4.843 0.001 . 1 . . . B 10 DG H3' . 25723 1
78 . 2 2 1 1 DG H4' H 1 4.172 0.001 . 1 . . . B 10 DG H4' . 25723 1
79 . 2 2 1 1 DG H5' H 1 3.676 0.000 . 1 . . . B 10 DG H5' . 25723 1
80 . 2 2 1 1 DG H5'' H 1 3.676 0.000 . 1 . . . B 10 DG H5'' . 25723 1
81 . 2 2 1 1 DG H8 H 1 7.888 0.001 . 1 . . . B 10 DG H8 . 25723 1
82 . 2 2 2 2 DA H1' H 1 6.072 0.002 . 1 . . . B 11 DA H1' . 25723 1
83 . 2 2 2 2 DA H2 H 1 7.838 0.001 . 1 . . . B 11 DA H2 . 25723 1
84 . 2 2 2 2 DA H2' H 1 2.788 0.003 . 1 . . . B 11 DA H2' . 25723 1
85 . 2 2 2 2 DA H2'' H 1 2.927 0.002 . 1 . . . B 11 DA H2'' . 25723 1
86 . 2 2 2 2 DA H3' H 1 5.071 0.001 . 1 . . . B 11 DA H3' . 25723 1
87 . 2 2 2 2 DA H4' H 1 4.441 0.001 . 1 . . . B 11 DA H4' . 25723 1
88 . 2 2 2 2 DA H5' H 1 4.184 0.002 . 1 . . . B 11 DA H5' . 25723 1
89 . 2 2 2 2 DA H5'' H 1 4.085 0.000 . 1 . . . B 11 DA H5'' . 25723 1
90 . 2 2 2 2 DA H8 H 1 8.208 0.005 . 1 . . . B 11 DA H8 . 25723 1
91 . 2 2 2 2 DA P P 31 -0.348 0.000 . 1 . . . B 11 DA P . 25723 1
92 . 2 2 3 3 DG H1' H 1 5.831 0.002 . 1 . . . B 12 DG H1' . 25723 1
93 . 2 2 3 3 DG H2' H 1 2.547 0.003 . 1 . . . B 12 DG H2' . 25723 1
94 . 2 2 3 3 DG H2'' H 1 2.655 0.005 . 1 . . . B 12 DG H2'' . 25723 1
95 . 2 2 3 3 DG H3' H 1 4.981 0.002 . 1 . . . B 12 DG H3' . 25723 1
96 . 2 2 3 3 DG H4' H 1 4.423 0.001 . 1 . . . B 12 DG H4' . 25723 1
97 . 2 2 3 3 DG H8 H 1 7.704 0.005 . 1 . . . B 12 DG H8 . 25723 1
98 . 2 2 3 3 DG P P 31 -0.461 0.000 . 1 . . . B 12 DG P . 25723 1
99 . 2 2 4 4 DC H1' H 1 6.000 0.002 . 1 . . . B 13 DC H1' . 25723 1
100 . 2 2 4 4 DC H2' H 1 1.936 0.002 . 1 . . . B 13 DC H2' . 25723 1
101 . 2 2 4 4 DC H2'' H 1 2.510 0.004 . 1 . . . B 13 DC H2'' . 25723 1
102 . 2 2 4 4 DC H3' H 1 4.804 0.003 . 1 . . . B 13 DC H3' . 25723 1
103 . 2 2 4 4 DC H4' H 1 4.220 0.001 . 1 . . . B 13 DC H4' . 25723 1
104 . 2 2 4 4 DC H5 H 1 5.222 0.002 . 1 . . . B 13 DC H5 . 25723 1
105 . 2 2 4 4 DC H6 H 1 7.326 0.003 . 1 . . . B 13 DC H6 . 25723 1
106 . 2 2 4 4 DC P P 31 -0.400 0.000 . 1 . . . B 13 DC P . 25723 1
107 . 2 2 5 5 DT H1' H 1 5.771 0.004 . 1 . . . B 14 DT H1' . 25723 1
108 . 2 2 5 5 DT H2' H 1 2.266 0.017 . 1 . . . B 14 DT H2' . 25723 1
109 . 2 2 5 5 DT H2'' H 1 2.327 0.004 . 1 . . . B 14 DT H2'' . 25723 1
110 . 2 2 5 5 DT H3' H 1 4.855 0.006 . 1 . . . B 14 DT H3' . 25723 1
111 . 2 2 5 5 DT H4' H 1 4.195 0.001 . 1 . . . B 14 DT H4' . 25723 1
112 . 2 2 5 5 DT H6 H 1 7.432 0.002 . 1 . . . B 14 DT H6 . 25723 1
113 . 2 2 5 5 DT H71 H 1 1.594 0.002 . 1 . . . B 14 DT H7 . 25723 1
114 . 2 2 5 5 DT H72 H 1 1.594 0.002 . 1 . . . B 14 DT H7 . 25723 1
115 . 2 2 5 5 DT H73 H 1 1.594 0.002 . 1 . . . B 14 DT H7 . 25723 1
116 . 2 2 5 5 DT P P 31 -0.672 0.000 . 1 . . . B 14 DT P . 25723 1
117 . 2 2 6 6 DC H1' H 1 6.012 0.002 . 1 . . . B 15 DC H1' . 25723 1
118 . 2 2 6 6 DC H2' H 1 2.223 0.003 . 1 . . . B 15 DC H2' . 25723 1
119 . 2 2 6 6 DC H2'' H 1 2.462 0.004 . 1 . . . B 15 DC H2'' . 25723 1
120 . 2 2 6 6 DC H3' H 1 4.881 0.001 . 1 . . . B 15 DC H3' . 25723 1
121 . 2 2 6 6 DC H4' H 1 4.218 0.002 . 1 . . . B 15 DC H4' . 25723 1
122 . 2 2 6 6 DC H5 H 1 5.764 0.003 . 1 . . . B 15 DC H5 . 25723 1
123 . 2 2 6 6 DC H6 H 1 7.622 0.002 . 1 . . . B 15 DC H6 . 25723 1
124 . 2 2 6 6 DC P P 31 0.001 0.000 . 1 . . . B 15 DC P . 25723 1
125 . 2 2 7 7 DC H1' H 1 5.450 0.002 . 1 . . . B 16 DC H1' . 25723 1
126 . 2 2 7 7 DC H2' H 1 1.994 0.002 . 1 . . . B 16 DC H2' . 25723 1
127 . 2 2 7 7 DC H2'' H 1 2.323 0.002 . 1 . . . B 16 DC H2'' . 25723 1
128 . 2 2 7 7 DC H3' H 1 4.837 0.001 . 1 . . . B 16 DC H3' . 25723 1
129 . 2 2 7 7 DC H4' H 1 4.097 0.001 . 1 . . . B 16 DC H4' . 25723 1
130 . 2 2 7 7 DC H5 H 1 5.701 0.002 . 1 . . . B 16 DC H5 . 25723 1
131 . 2 2 7 7 DC H6 H 1 7.469 0.002 . 1 . . . B 16 DC H6 . 25723 1
132 . 2 2 7 7 DC P P 31 -0.447 0.000 . 1 . . . B 16 DC P . 25723 1
133 . 2 2 8 8 DA H1' H 1 6.328 0.002 . 1 . . . B 17 DA H1' . 25723 1
134 . 2 2 8 8 DA H2 H 1 7.924 0.001 . 1 . . . B 17 DA H2 . 25723 1
135 . 2 2 8 8 DA H2' H 1 2.811 0.005 . 1 . . . B 17 DA H2' . 25723 1
136 . 2 2 8 8 DA H2'' H 1 2.886 0.005 . 1 . . . B 17 DA H2'' . 25723 1
137 . 2 2 8 8 DA H3' H 1 5.034 0.001 . 1 . . . B 17 DA H3' . 25723 1
138 . 2 2 8 8 DA H4' H 1 4.422 0.001 . 1 . . . B 17 DA H4' . 25723 1
139 . 2 2 8 8 DA H5' H 1 4.144 0.001 . 1 . . . B 17 DA H5' . 25723 1
140 . 2 2 8 8 DA H5'' H 1 4.094 0.000 . 1 . . . B 17 DA H5'' . 25723 1
141 . 2 2 8 8 DA H8 H 1 8.362 0.001 . 1 . . . B 17 DA H8 . 25723 1
142 . 2 2 8 8 DA P P 31 -0.109 0.000 . 1 . . . B 17 DA P . 25723 1
143 . 2 2 9 9 DT H1' H 1 6.126 0.001 . 1 . . . B 18 DT H1' . 25723 1
144 . 2 2 9 9 DT H2' H 1 2.176 0.002 . 1 . . . B 18 DT H2' . 25723 1
145 . 2 2 9 9 DT H2'' H 1 2.176 0.002 . 1 . . . B 18 DT H2'' . 25723 1
146 . 2 2 9 9 DT H3' H 1 4.526 0.001 . 1 . . . B 18 DT H3' . 25723 1
147 . 2 2 9 9 DT H4' H 1 4.037 0.001 . 1 . . . B 18 DT H4' . 25723 1
148 . 2 2 9 9 DT H6 H 1 7.301 0.001 . 1 . . . B 18 DT H6 . 25723 1
149 . 2 2 9 9 DT H71 H 1 1.596 0.002 . 1 . . . B 18 DT H7 . 25723 1
150 . 2 2 9 9 DT H72 H 1 1.596 0.002 . 1 . . . B 18 DT H7 . 25723 1
151 . 2 2 9 9 DT H73 H 1 1.596 0.002 . 1 . . . B 18 DT H7 . 25723 1
152 . 2 2 9 9 DT P P 31 -0.474 0.000 . 1 . . . B 18 DT P . 25723 1
stop_
save_