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 36623
_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 '1D 1H' 1 $sample_1 isotropic 36623 1
2 '2D 1H-1H NOESY' 1 $sample_1 isotropic 36623 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 DC H1' H 1 5.53 0.001 . 1 . . . . A 1 DC H1' . 36623 1
2 . 1 . 1 1 1 DC H2' H 1 1.80 0.001 . 1 . . . . A 1 DC H2' . 36623 1
3 . 1 . 1 1 1 DC H2'' H 1 2.26 0.000 . 1 . . . . A 1 DC H2'' . 36623 1
4 . 1 . 1 1 1 DC H3' H 1 4.56 0.000 . 1 . . . . A 1 DC H3' . 36623 1
5 . 1 . 1 1 1 DC H4' H 1 3.92 0.007 . 1 . . . . A 1 DC H4' . 36623 1
6 . 1 . 1 1 1 DC H5 H 1 5.84 0.000 . 1 . . . . A 1 DC H5 . 36623 1
7 . 1 . 1 1 1 DC H5' H 1 3.61 0.000 . 1 . . . . A 1 DC H5' . 36623 1
8 . 1 . 1 1 1 DC H5'' H 1 3.58 0.000 . 1 . . . . A 1 DC H5'' . 36623 1
9 . 1 . 1 1 1 DC H6 H 1 7.56 0.001 . 1 . . . . A 1 DC H6 . 36623 1
10 . 1 . 1 1 1 DC H41 H 1 6.87 0.000 . 1 . . . . A 1 DC H41 . 36623 1
11 . 1 . 1 1 1 DC H42 H 1 7.94 0.000 . 1 . . . . A 1 DC H42 . 36623 1
12 . 1 . 1 2 2 DA H1' H 1 6.10 0.001 . 1 . . . . A 2 DA H1' . 36623 1
13 . 1 . 1 2 2 DA H2 H 1 7.80 0.001 . 1 . . . . A 2 DA H2 . 36623 1
14 . 1 . 1 2 2 DA H2' H 1 2.64 0.001 . 1 . . . . A 2 DA H2' . 36623 1
15 . 1 . 1 2 2 DA H2'' H 1 2.77 0.000 . 1 . . . . A 2 DA H2'' . 36623 1
16 . 1 . 1 2 2 DA H3' H 1 4.90 0.000 . 1 . . . . A 2 DA H3' . 36623 1
17 . 1 . 1 2 2 DA H4' H 1 4.27 0.001 . 1 . . . . A 2 DA H4' . 36623 1
18 . 1 . 1 2 2 DA H5' H 1 4.01 0.020 . 1 . . . . A 2 DA H5' . 36623 1
19 . 1 . 1 2 2 DA H5'' H 1 3.86 0.001 . 1 . . . . A 2 DA H5'' . 36623 1
20 . 1 . 1 2 2 DA H8 H 1 8.24 0.001 . 1 . . . . A 2 DA H8 . 36623 1
21 . 1 . 1 2 2 DA H61 H 1 6.55 0.010 . 1 . . . . A 2 DA H61 . 36623 1
22 . 1 . 1 2 2 DA H62 H 1 7.34 0.000 . 1 . . . . A 2 DA H62 . 36623 1
23 . 1 . 1 3 3 DC H1' H 1 5.48 0.001 . 1 . . . . A 3 DC H1' . 36623 1
24 . 1 . 1 3 3 DC H2' H 1 1.88 0.000 . 1 . . . . A 3 DC H2' . 36623 1
25 . 1 . 1 3 3 DC H2'' H 1 2.22 0.001 . 1 . . . . A 3 DC H2'' . 36623 1
26 . 1 . 1 3 3 DC H3' H 1 4.89 0.000 . 1 . . . . A 3 DC H3' . 36623 1
27 . 1 . 1 3 3 DC H4' H 1 4.04 0.011 . 1 . . . . A 3 DC H4' . 36623 1
28 . 1 . 1 3 3 DC H5 H 1 5.21 0.001 . 1 . . . . A 3 DC H5 . 36623 1
29 . 1 . 1 3 3 DC H5' H 1 4.01 0.001 . 1 . . . . A 3 DC H5' . 36623 1
30 . 1 . 1 3 3 DC H5'' H 1 3.93 0.000 . 1 . . . . A 3 DC H5'' . 36623 1
31 . 1 . 1 3 3 DC H6 H 1 7.17 0.002 . 1 . . . . A 3 DC H6 . 36623 1
32 . 1 . 1 3 3 DC H41 H 1 6.43 0.004 . 1 . . . . A 3 DC H41 . 36623 1
33 . 1 . 1 3 3 DC H42 H 1 8.07 0.007 . 1 . . . . A 3 DC H42 . 36623 1
34 . 1 . 1 4 4 DG H1 H 1 12.66 0.002 . 1 . . . . A 4 DG H1 . 36623 1
35 . 1 . 1 4 4 DG H1' H 1 5.83 0.001 . 1 . . . . A 4 DG H1' . 36623 1
36 . 1 . 1 4 4 DG H2' H 1 2.48 0.005 . 1 . . . . A 4 DG H2' . 36623 1
37 . 1 . 1 4 4 DG H2'' H 1 2.60 0.000 . 1 . . . . A 4 DG H2'' . 36623 1
38 . 1 . 1 4 4 DG H3' H 1 4.83 0.001 . 1 . . . . A 4 DG H3' . 36623 1
39 . 1 . 1 4 4 DG H4' H 1 4.22 0.001 . 1 . . . . A 4 DG H4' . 36623 1
40 . 1 . 1 4 4 DG H5' H 1 4.06 0.000 . 1 . . . . A 4 DG H5' . 36623 1
41 . 1 . 1 4 4 DG H5'' H 1 3.97 0.000 . 1 . . . . A 4 DG H5'' . 36623 1
42 . 1 . 1 4 4 DG H8 H 1 7.76 0.002 . 1 . . . . A 4 DG H8 . 36623 1
43 . 1 . 1 4 4 DG H21 H 1 6.63 0.000 . 1 . . . . A 4 DG H21 . 36623 1
44 . 1 . 1 4 4 DG H22 H 1 7.33 0.000 . 1 . . . . A 4 DG H22 . 36623 1
45 . 1 . 1 5 5 DT H1' H 1 5.74 0.001 . 1 . . . . A 5 DT H1' . 36623 1
46 . 1 . 1 5 5 DT H2' H 1 1.78 0.000 . 1 . . . . A 5 DT H2' . 36623 1
47 . 1 . 1 5 5 DT H2'' H 1 2.20 0.003 . 1 . . . . A 5 DT H2'' . 36623 1
48 . 1 . 1 5 5 DT H3 H 1 13.75 0.000 . 1 . . . . A 5 DT H3 . 36623 1
49 . 1 . 1 5 5 DT H3' H 1 4.84 0.002 . 1 . . . . A 5 DT H3' . 36623 1
50 . 1 . 1 5 5 DT H4' H 1 4.08 0.001 . 1 . . . . A 5 DT H4' . 36623 1
51 . 1 . 1 5 5 DT H5' H 1 3.40 0.010 . 1 . . . . A 5 DT H5' . 36623 1
52 . 1 . 1 5 5 DT H5'' H 1 3.95 0.000 . 1 . . . . A 5 DT H5'' . 36623 1
53 . 1 . 1 5 5 DT H6 H 1 7.04 0.001 . 1 . . . . A 5 DT H6 . 36623 1
54 . 1 . 1 5 5 DT H71 H 1 1.41 0.002 . 1 . . . . A 5 DT H71 . 36623 1
55 . 1 . 1 5 5 DT H72 H 1 1.41 0.002 . 1 . . . . A 5 DT H72 . 36623 1
56 . 1 . 1 5 5 DT H73 H 1 1.41 0.002 . 1 . . . . A 5 DT H73 . 36623 1
57 . 1 . 1 6 6 DG H1' H 1 5.01 0.001 . 1 . . . . A 6 DG H1' . 36623 1
58 . 1 . 1 6 6 DG H2' H 1 2.24 0.009 . 1 . . . . A 6 DG H2' . 36623 1
59 . 1 . 1 6 6 DG H2'' H 1 2.47 0.003 . 1 . . . . A 6 DG H2'' . 36623 1
60 . 1 . 1 6 6 DG H3' H 1 4.53 0.004 . 1 . . . . A 6 DG H3' . 36623 1
61 . 1 . 1 6 6 DG H5' H 1 4.03 0.005 . 1 . . . . A 6 DG H5' . 36623 1
62 . 1 . 1 6 6 DG H5'' H 1 3.94 0.002 . 1 . . . . A 6 DG H5'' . 36623 1
63 . 1 . 1 6 6 DG H8 H 1 7.78 0.007 . 1 . . . . A 6 DG H8 . 36623 1
64 . 2 . 1 1 1 DC H1' H 1 5.53 0.001 . 1 . . . . B 7 DC H1' . 36623 1
65 . 2 . 1 1 1 DC H2' H 1 1.80 0.001 . 1 . . . . B 7 DC H2' . 36623 1
66 . 2 . 1 1 1 DC H2'' H 1 2.26 0.000 . 1 . . . . B 7 DC H2'' . 36623 1
67 . 2 . 1 1 1 DC H3' H 1 4.56 0.000 . 1 . . . . B 7 DC H3' . 36623 1
68 . 2 . 1 1 1 DC H4' H 1 3.92 0.007 . 1 . . . . B 7 DC H4' . 36623 1
69 . 2 . 1 1 1 DC H5 H 1 5.84 0.000 . 1 . . . . B 7 DC H5 . 36623 1
70 . 2 . 1 1 1 DC H5' H 1 3.61 0.000 . 1 . . . . B 7 DC H5' . 36623 1
71 . 2 . 1 1 1 DC H5'' H 1 3.58 0.000 . 1 . . . . B 7 DC H5'' . 36623 1
72 . 2 . 1 1 1 DC H6 H 1 7.56 0.001 . 1 . . . . B 7 DC H6 . 36623 1
73 . 2 . 1 1 1 DC H41 H 1 6.87 0.000 . 1 . . . . B 7 DC H41 . 36623 1
74 . 2 . 1 1 1 DC H42 H 1 7.94 0.000 . 1 . . . . B 7 DC H42 . 36623 1
75 . 2 . 1 2 2 DA H1' H 1 6.10 0.001 . 1 . . . . B 8 DA H1' . 36623 1
76 . 2 . 1 2 2 DA H2 H 1 7.80 0.001 . 1 . . . . B 8 DA H2 . 36623 1
77 . 2 . 1 2 2 DA H2' H 1 2.64 0.001 . 1 . . . . B 8 DA H2' . 36623 1
78 . 2 . 1 2 2 DA H2'' H 1 2.77 0.000 . 1 . . . . B 8 DA H2'' . 36623 1
79 . 2 . 1 2 2 DA H3' H 1 4.90 0.000 . 1 . . . . B 8 DA H3' . 36623 1
80 . 2 . 1 2 2 DA H4' H 1 4.27 0.001 . 1 . . . . B 8 DA H4' . 36623 1
81 . 2 . 1 2 2 DA H5' H 1 4.01 0.020 . 1 . . . . B 8 DA H5' . 36623 1
82 . 2 . 1 2 2 DA H5'' H 1 3.86 0.001 . 1 . . . . B 8 DA H5'' . 36623 1
83 . 2 . 1 2 2 DA H8 H 1 8.24 0.001 . 1 . . . . B 8 DA H8 . 36623 1
84 . 2 . 1 2 2 DA H61 H 1 6.55 0.010 . 1 . . . . B 8 DA H61 . 36623 1
85 . 2 . 1 2 2 DA H62 H 1 7.34 0.000 . 1 . . . . B 8 DA H62 . 36623 1
86 . 2 . 1 3 3 DC H1' H 1 5.48 0.001 . 1 . . . . B 9 DC H1' . 36623 1
87 . 2 . 1 3 3 DC H2' H 1 1.88 0.000 . 1 . . . . B 9 DC H2' . 36623 1
88 . 2 . 1 3 3 DC H2'' H 1 2.22 0.001 . 1 . . . . B 9 DC H2'' . 36623 1
89 . 2 . 1 3 3 DC H3' H 1 4.89 0.000 . 1 . . . . B 9 DC H3' . 36623 1
90 . 2 . 1 3 3 DC H4' H 1 4.04 0.011 . 1 . . . . B 9 DC H4' . 36623 1
91 . 2 . 1 3 3 DC H5 H 1 5.21 0.001 . 1 . . . . B 9 DC H5 . 36623 1
92 . 2 . 1 3 3 DC H5' H 1 4.01 0.001 . 1 . . . . B 9 DC H5' . 36623 1
93 . 2 . 1 3 3 DC H5'' H 1 3.93 0.000 . 1 . . . . B 9 DC H5'' . 36623 1
94 . 2 . 1 3 3 DC H6 H 1 7.17 0.002 . 1 . . . . B 9 DC H6 . 36623 1
95 . 2 . 1 3 3 DC H41 H 1 6.43 0.004 . 1 . . . . B 9 DC H41 . 36623 1
96 . 2 . 1 3 3 DC H42 H 1 8.07 0.007 . 1 . . . . B 9 DC H42 . 36623 1
97 . 2 . 1 4 4 DG H1 H 1 12.66 0.002 . 1 . . . . B 10 DG H1 . 36623 1
98 . 2 . 1 4 4 DG H1' H 1 5.83 0.001 . 1 . . . . B 10 DG H1' . 36623 1
99 . 2 . 1 4 4 DG H2' H 1 2.48 0.005 . 1 . . . . B 10 DG H2' . 36623 1
100 . 2 . 1 4 4 DG H2'' H 1 2.60 0.000 . 1 . . . . B 10 DG H2'' . 36623 1
101 . 2 . 1 4 4 DG H3' H 1 4.83 0.001 . 1 . . . . B 10 DG H3' . 36623 1
102 . 2 . 1 4 4 DG H4' H 1 4.22 0.001 . 1 . . . . B 10 DG H4' . 36623 1
103 . 2 . 1 4 4 DG H5' H 1 4.06 0.000 . 1 . . . . B 10 DG H5' . 36623 1
104 . 2 . 1 4 4 DG H5'' H 1 3.97 0.000 . 1 . . . . B 10 DG H5'' . 36623 1
105 . 2 . 1 4 4 DG H8 H 1 7.76 0.002 . 1 . . . . B 10 DG H8 . 36623 1
106 . 2 . 1 4 4 DG H21 H 1 6.63 0.000 . 1 . . . . B 10 DG H21 . 36623 1
107 . 2 . 1 4 4 DG H22 H 1 7.33 0.000 . 1 . . . . B 10 DG H22 . 36623 1
108 . 2 . 1 5 5 DT H1' H 1 5.74 0.001 . 1 . . . . B 11 DT H1' . 36623 1
109 . 2 . 1 5 5 DT H2' H 1 1.78 0.000 . 1 . . . . B 11 DT H2' . 36623 1
110 . 2 . 1 5 5 DT H2'' H 1 2.20 0.003 . 1 . . . . B 11 DT H2'' . 36623 1
111 . 2 . 1 5 5 DT H3 H 1 13.75 0.000 . 1 . . . . B 11 DT H3 . 36623 1
112 . 2 . 1 5 5 DT H3' H 1 4.84 0.002 . 1 . . . . B 11 DT H3' . 36623 1
113 . 2 . 1 5 5 DT H4' H 1 4.08 0.001 . 1 . . . . B 11 DT H4' . 36623 1
114 . 2 . 1 5 5 DT H5' H 1 3.40 0.010 . 1 . . . . B 11 DT H5' . 36623 1
115 . 2 . 1 5 5 DT H5'' H 1 3.95 0.000 . 1 . . . . B 11 DT H5'' . 36623 1
116 . 2 . 1 5 5 DT H6 H 1 7.04 0.001 . 1 . . . . B 11 DT H6 . 36623 1
117 . 2 . 1 5 5 DT H71 H 1 1.41 0.002 . 1 . . . . B 11 DT H71 . 36623 1
118 . 2 . 1 5 5 DT H72 H 1 1.41 0.002 . 1 . . . . B 11 DT H72 . 36623 1
119 . 2 . 1 5 5 DT H73 H 1 1.41 0.002 . 1 . . . . B 11 DT H73 . 36623 1
120 . 2 . 1 6 6 DG H1' H 1 5.01 0.001 . 1 . . . . B 12 DG H1' . 36623 1
121 . 2 . 1 6 6 DG H2' H 1 2.24 0.009 . 1 . . . . B 12 DG H2' . 36623 1
122 . 2 . 1 6 6 DG H2'' H 1 2.47 0.003 . 1 . . . . B 12 DG H2'' . 36623 1
123 . 2 . 1 6 6 DG H3' H 1 4.53 0.004 . 1 . . . . B 12 DG H3' . 36623 1
124 . 2 . 1 6 6 DG H5' H 1 4.03 0.005 . 1 . . . . B 12 DG H5' . 36623 1
125 . 2 . 1 6 6 DG H5'' H 1 3.94 0.002 . 1 . . . . B 12 DG H5'' . 36623 1
126 . 2 . 1 6 6 DG H8 H 1 7.78 0.007 . 1 . . . . B 12 DG H8 . 36623 1
stop_
save_