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 30198
_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 '2D 1H-1H NOESY' . . . 30198 1
2 '2D 1H-1H NOESY' . . . 30198 1
3 '2D DQF-COSY' . . . 30198 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 5.76493 . . . . . . . A 1 DC H1' . 30198 1
2 . 1 . 1 1 1 DC H2' H 1 1.96953 . . . . . . . A 1 DC H2' . 30198 1
3 . 1 . 1 1 1 DC H2'' H 1 2.40736 . . . . . . . A 1 DC H2'' . 30198 1
4 . 1 . 1 1 1 DC H3' H 1 4.70072 . . . . . . . A 1 DC H3' . 30198 1
5 . 1 . 1 1 1 DC H5 H 1 5.92119 . . . . . . . A 1 DC H5 . 30198 1
6 . 1 . 1 1 1 DC H6 H 1 7.63251 . . . . . . . A 1 DC H6 . 30198 1
7 . 1 . 1 2 2 DG H1' H 1 5.88909 . . . . . . . A 2 DG H1' . 30198 1
8 . 1 . 1 2 2 DG H2' H 1 2.65046 . . . . . . . A 2 DG H2' . 30198 1
9 . 1 . 1 2 2 DG H2'' H 1 2.72252 . . . . . . . A 2 DG H2'' . 30198 1
10 . 1 . 1 2 2 DG H3' H 1 4.96684 . . . . . . . A 2 DG H3' . 30198 1
11 . 1 . 1 2 2 DG H8 H 1 7.96021 . . . . . . . A 2 DG H8 . 30198 1
12 . 1 . 1 3 3 DC H1' H 1 6.0166 . . . . . . . A 3 DC H1' . 30198 1
13 . 1 . 1 3 3 DC H2' H 1 1.84534 . . . . . . . A 3 DC H2' . 30198 1
14 . 1 . 1 3 3 DC H2'' H 1 2.595 . . . . . . . A 3 DC H2'' . 30198 1
15 . 1 . 1 3 3 DC H3' H 1 4.85751 . . . . . . . A 3 DC H3' . 30198 1
16 . 1 . 1 3 3 DC H5 H 1 5.39741 . . . . . . . A 3 DC H5 . 30198 1
17 . 1 . 1 3 3 DC H6 H 1 7.38215 . . . . . . . A 3 DC H6 . 30198 1
18 . 1 . 1 4 4 8OG H1' H 1 5.14408 . . . . . . . A 4 8OG H1' . 30198 1
19 . 1 . 1 4 4 8OG H2' H 1 3.34432 . . . . . . . A 4 8OG H2' . 30198 1
20 . 1 . 1 4 4 8OG H2'' H 1 2.38815 . . . . . . . A 4 8OG H2'' . 30198 1
21 . 1 . 1 4 4 8OG H3' H 1 4.85392 . . . . . . . A 4 8OG H3' . 30198 1
22 . 1 . 1 5 5 DA H1' H 1 5.99607 . . . . . . . A 5 DA H1' . 30198 1
23 . 1 . 1 5 5 DA H2 H 1 7.23198 . . . . . . . A 5 DA H2 . 30198 1
24 . 1 . 1 5 5 DA H2' H 1 2.7002 . . . . . . . A 5 DA H2' . 30198 1
25 . 1 . 1 5 5 DA H2'' H 1 2.92828 . . . . . . . A 5 DA H2'' . 30198 1
26 . 1 . 1 5 5 DA H3' H 1 5.06151 . . . . . . . A 5 DA H3' . 30198 1
27 . 1 . 1 5 5 DA H8 H 1 8.19956 . . . . . . . A 5 DA H8 . 30198 1
28 . 1 . 1 6 6 DA H1' H 1 6.16747 . . . . . . . A 6 DA H1' . 30198 1
29 . 1 . 1 6 6 DA H2 H 1 7.61197 . . . . . . . A 6 DA H2 . 30198 1
30 . 1 . 1 6 6 DA H2' H 1 2.56536 . . . . . . . A 6 DA H2' . 30198 1
31 . 1 . 1 6 6 DA H2'' H 1 2.93081 . . . . . . . A 6 DA H2'' . 30198 1
32 . 1 . 1 6 6 DA H3' H 1 5.00414 . . . . . . . A 6 DA H3' . 30198 1
33 . 1 . 1 6 6 DA H8 H 1 8.13321 . . . . . . . A 6 DA H8 . 30198 1
34 . 1 . 1 7 7 DT H1' H 1 5.92019 . . . . . . . A 7 DT H1' . 30198 1
35 . 1 . 1 7 7 DT H2' H 1 1.98018 . . . . . . . A 7 DT H2' . 30198 1
36 . 1 . 1 7 7 DT H2'' H 1 2.55576 . . . . . . . A 7 DT H2'' . 30198 1
37 . 1 . 1 7 7 DT H3' H 1 4.8352 . . . . . . . A 7 DT H3' . 30198 1
38 . 1 . 1 7 7 DT H6 H 1 7.10671 . . . . . . . A 7 DT H6 . 30198 1
39 . 1 . 1 7 7 DT H71 H 1 1.26667 . . . . . . . A 7 DT H71 . 30198 1
40 . 1 . 1 7 7 DT H72 H 1 1.26667 . . . . . . . A 7 DT H72 . 30198 1
41 . 1 . 1 7 7 DT H73 H 1 1.26667 . . . . . . . A 7 DT H73 . 30198 1
42 . 1 . 1 8 8 DT H1' H 1 6.1025 . . . . . . . A 8 DT H1' . 30198 1
43 . 1 . 1 8 8 DT H2' H 1 2.10332 . . . . . . . A 8 DT H2' . 30198 1
44 . 1 . 1 8 8 DT H2'' H 1 2.59877 . . . . . . . A 8 DT H2'' . 30198 1
45 . 1 . 1 8 8 DT H3' H 1 4.89334 . . . . . . . A 8 DT H3' . 30198 1
46 . 1 . 1 8 8 DT H6 H 1 7.39713 . . . . . . . A 8 DT H6 . 30198 1
47 . 1 . 1 8 8 DT H71 H 1 1.52375 . . . . . . . A 8 DT H71 . 30198 1
48 . 1 . 1 8 8 DT H72 H 1 1.52375 . . . . . . . A 8 DT H72 . 30198 1
49 . 1 . 1 8 8 DT H73 H 1 1.52375 . . . . . . . A 8 DT H73 . 30198 1
50 . 1 . 1 9 9 5CM H1' H 1 5.65334 . . . . . . . A 9 5CM H1' . 30198 1
51 . 1 . 1 9 9 5CM H2' H 1 2.03405 . . . . . . . A 9 5CM H2' . 30198 1
52 . 1 . 1 9 9 5CM H2'' H 1 2.34513 . . . . . . . A 9 5CM H2'' . 30198 1
53 . 1 . 1 9 9 5CM H3' H 1 4.85602 . . . . . . . A 9 5CM H3' . 30198 1
54 . 1 . 1 9 9 5CM H5A1 H 1 1.72909 . . . . . . . A 9 5CM H5A1 . 30198 1
55 . 1 . 1 9 9 5CM H5A2 H 1 1.72909 . . . . . . . A 9 5CM H5A2 . 30198 1
56 . 1 . 1 9 9 5CM H5A3 H 1 1.72909 . . . . . . . A 9 5CM H5A3 . 30198 1
57 . 1 . 1 9 9 5CM H6 H 1 7.25068 . . . . . . . A 9 5CM H6 . 30198 1
58 . 1 . 1 10 10 DG H1' H 1 5.83349 . . . . . . . A 10 DG H1' . 30198 1
59 . 1 . 1 10 10 DG H2' H 1 2.65983 . . . . . . . A 10 DG H2' . 30198 1
60 . 1 . 1 10 10 DG H3' H 1 4.96905 . . . . . . . A 10 DG H3' . 30198 1
61 . 1 . 1 10 10 DG H8 H 1 7.85825 . . . . . . . A 10 DG H8 . 30198 1
62 . 1 . 1 11 11 DC H1' H 1 5.76798 . . . . . . . A 11 DC H1' . 30198 1
63 . 1 . 1 11 11 DC H2' H 1 1.88219 . . . . . . . A 11 DC H2' . 30198 1
64 . 1 . 1 11 11 DC H2'' H 1 2.33298 . . . . . . . A 11 DC H2'' . 30198 1
65 . 1 . 1 11 11 DC H3' H 1 4.79676 . . . . . . . A 11 DC H3' . 30198 1
66 . 1 . 1 11 11 DC H5 H 1 5.42977 . . . . . . . A 11 DC H5 . 30198 1
67 . 1 . 1 11 11 DC H6 H 1 7.31823 . . . . . . . A 11 DC H6 . 30198 1
68 . 1 . 1 12 12 DG H1' H 1 6.15658 . . . . . . . A 12 DG H1' . 30198 1
69 . 1 . 1 12 12 DG H2' H 1 2.60225 . . . . . . . A 12 DG H2' . 30198 1
70 . 1 . 1 12 12 DG H2'' H 1 2.36107 . . . . . . . A 12 DG H2'' . 30198 1
71 . 1 . 1 12 12 DG H3' H 1 4.66706 . . . . . . . A 12 DG H3' . 30198 1
72 . 1 . 1 12 12 DG H8 H 1 7.93653 . . . . . . . A 12 DG H8 . 30198 1
73 . 2 . 1 1 1 DC H1' H 1 5.76493 . . . . . . . B 13 DC H1' . 30198 1
74 . 2 . 1 1 1 DC H2' H 1 1.96953 . . . . . . . B 13 DC H2' . 30198 1
75 . 2 . 1 1 1 DC H2'' H 1 2.40736 . . . . . . . B 13 DC H2'' . 30198 1
76 . 2 . 1 1 1 DC H3' H 1 4.70072 . . . . . . . B 13 DC H3' . 30198 1
77 . 2 . 1 1 1 DC H5 H 1 5.92119 . . . . . . . B 13 DC H5 . 30198 1
78 . 2 . 1 1 1 DC H6 H 1 7.63251 . . . . . . . B 13 DC H6 . 30198 1
79 . 2 . 1 2 2 DG H1' H 1 5.88909 . . . . . . . B 14 DG H1' . 30198 1
80 . 2 . 1 2 2 DG H2' H 1 2.65046 . . . . . . . B 14 DG H2' . 30198 1
81 . 2 . 1 2 2 DG H2'' H 1 2.72252 . . . . . . . B 14 DG H2'' . 30198 1
82 . 2 . 1 2 2 DG H3' H 1 4.96684 . . . . . . . B 14 DG H3' . 30198 1
83 . 2 . 1 2 2 DG H8 H 1 7.96021 . . . . . . . B 14 DG H8 . 30198 1
84 . 2 . 1 3 3 DC H1' H 1 6.0166 . . . . . . . B 15 DC H1' . 30198 1
85 . 2 . 1 3 3 DC H2' H 1 1.84534 . . . . . . . B 15 DC H2' . 30198 1
86 . 2 . 1 3 3 DC H2'' H 1 2.595 . . . . . . . B 15 DC H2'' . 30198 1
87 . 2 . 1 3 3 DC H3' H 1 4.85751 . . . . . . . B 15 DC H3' . 30198 1
88 . 2 . 1 3 3 DC H5 H 1 5.39741 . . . . . . . B 15 DC H5 . 30198 1
89 . 2 . 1 3 3 DC H6 H 1 7.38215 . . . . . . . B 15 DC H6 . 30198 1
90 . 2 . 1 4 4 8OG H1' H 1 5.14408 . . . . . . . B 16 8OG H1' . 30198 1
91 . 2 . 1 4 4 8OG H2' H 1 3.34432 . . . . . . . B 16 8OG H2' . 30198 1
92 . 2 . 1 4 4 8OG H2'' H 1 2.38815 . . . . . . . B 16 8OG H2'' . 30198 1
93 . 2 . 1 4 4 8OG H3' H 1 4.85392 . . . . . . . B 16 8OG H3' . 30198 1
94 . 2 . 1 5 5 DA H1' H 1 5.99607 . . . . . . . B 17 DA H1' . 30198 1
95 . 2 . 1 5 5 DA H2 H 1 7.23198 . . . . . . . B 17 DA H2 . 30198 1
96 . 2 . 1 5 5 DA H2' H 1 2.7002 . . . . . . . B 17 DA H2' . 30198 1
97 . 2 . 1 5 5 DA H2'' H 1 2.92828 . . . . . . . B 17 DA H2'' . 30198 1
98 . 2 . 1 5 5 DA H3' H 1 5.06151 . . . . . . . B 17 DA H3' . 30198 1
99 . 2 . 1 5 5 DA H8 H 1 8.19956 . . . . . . . B 17 DA H8 . 30198 1
100 . 2 . 1 6 6 DA H1' H 1 6.16747 . . . . . . . B 18 DA H1' . 30198 1
101 . 2 . 1 6 6 DA H2 H 1 7.61197 . . . . . . . B 18 DA H2 . 30198 1
102 . 2 . 1 6 6 DA H2' H 1 2.56536 . . . . . . . B 18 DA H2' . 30198 1
103 . 2 . 1 6 6 DA H2'' H 1 2.93081 . . . . . . . B 18 DA H2'' . 30198 1
104 . 2 . 1 6 6 DA H3' H 1 5.00414 . . . . . . . B 18 DA H3' . 30198 1
105 . 2 . 1 6 6 DA H8 H 1 8.13321 . . . . . . . B 18 DA H8 . 30198 1
106 . 2 . 1 7 7 DT H1' H 1 5.92019 . . . . . . . B 19 DT H1' . 30198 1
107 . 2 . 1 7 7 DT H2' H 1 1.98018 . . . . . . . B 19 DT H2' . 30198 1
108 . 2 . 1 7 7 DT H2'' H 1 2.55576 . . . . . . . B 19 DT H2'' . 30198 1
109 . 2 . 1 7 7 DT H3' H 1 4.8352 . . . . . . . B 19 DT H3' . 30198 1
110 . 2 . 1 7 7 DT H6 H 1 7.10671 . . . . . . . B 19 DT H6 . 30198 1
111 . 2 . 1 7 7 DT H71 H 1 1.26667 . . . . . . . B 19 DT H71 . 30198 1
112 . 2 . 1 7 7 DT H72 H 1 1.26667 . . . . . . . B 19 DT H72 . 30198 1
113 . 2 . 1 7 7 DT H73 H 1 1.26667 . . . . . . . B 19 DT H73 . 30198 1
114 . 2 . 1 8 8 DT H1' H 1 6.1025 . . . . . . . B 20 DT H1' . 30198 1
115 . 2 . 1 8 8 DT H2' H 1 2.10332 . . . . . . . B 20 DT H2' . 30198 1
116 . 2 . 1 8 8 DT H2'' H 1 2.59877 . . . . . . . B 20 DT H2'' . 30198 1
117 . 2 . 1 8 8 DT H3' H 1 4.89334 . . . . . . . B 20 DT H3' . 30198 1
118 . 2 . 1 8 8 DT H6 H 1 7.39713 . . . . . . . B 20 DT H6 . 30198 1
119 . 2 . 1 8 8 DT H71 H 1 1.52375 . . . . . . . B 20 DT H71 . 30198 1
120 . 2 . 1 8 8 DT H72 H 1 1.52375 . . . . . . . B 20 DT H72 . 30198 1
121 . 2 . 1 8 8 DT H73 H 1 1.52375 . . . . . . . B 20 DT H73 . 30198 1
122 . 2 . 1 9 9 5CM H1' H 1 5.65334 . . . . . . . B 21 5CM H1' . 30198 1
123 . 2 . 1 9 9 5CM H2' H 1 2.03405 . . . . . . . B 21 5CM H2' . 30198 1
124 . 2 . 1 9 9 5CM H2'' H 1 2.34513 . . . . . . . B 21 5CM H2'' . 30198 1
125 . 2 . 1 9 9 5CM H3' H 1 4.85602 . . . . . . . B 21 5CM H3' . 30198 1
126 . 2 . 1 9 9 5CM H5A1 H 1 1.72909 . . . . . . . B 21 5CM H5A1 . 30198 1
127 . 2 . 1 9 9 5CM H5A2 H 1 1.72909 . . . . . . . B 21 5CM H5A2 . 30198 1
128 . 2 . 1 9 9 5CM H5A3 H 1 1.72909 . . . . . . . B 21 5CM H5A3 . 30198 1
129 . 2 . 1 9 9 5CM H6 H 1 7.25068 . . . . . . . B 21 5CM H6 . 30198 1
130 . 2 . 1 10 10 DG H1' H 1 5.83349 . . . . . . . B 22 DG H1' . 30198 1
131 . 2 . 1 10 10 DG H2' H 1 2.65983 . . . . . . . B 22 DG H2' . 30198 1
132 . 2 . 1 10 10 DG H3' H 1 4.96905 . . . . . . . B 22 DG H3' . 30198 1
133 . 2 . 1 10 10 DG H8 H 1 7.85825 . . . . . . . B 22 DG H8 . 30198 1
134 . 2 . 1 11 11 DC H1' H 1 5.76798 . . . . . . . B 23 DC H1' . 30198 1
135 . 2 . 1 11 11 DC H2' H 1 1.88219 . . . . . . . B 23 DC H2' . 30198 1
136 . 2 . 1 11 11 DC H2'' H 1 2.33298 . . . . . . . B 23 DC H2'' . 30198 1
137 . 2 . 1 11 11 DC H3' H 1 4.79676 . . . . . . . B 23 DC H3' . 30198 1
138 . 2 . 1 11 11 DC H5 H 1 5.42977 . . . . . . . B 23 DC H5 . 30198 1
139 . 2 . 1 11 11 DC H6 H 1 7.31823 . . . . . . . B 23 DC H6 . 30198 1
140 . 2 . 1 12 12 DG H1' H 1 6.15658 . . . . . . . B 24 DG H1' . 30198 1
141 . 2 . 1 12 12 DG H2' H 1 2.60225 . . . . . . . B 24 DG H2' . 30198 1
142 . 2 . 1 12 12 DG H2'' H 1 2.36107 . . . . . . . B 24 DG H2'' . 30198 1
143 . 2 . 1 12 12 DG H3' H 1 4.66706 . . . . . . . B 24 DG H3' . 30198 1
144 . 2 . 1 12 12 DG H8 H 1 7.93653 . . . . . . . B 24 DG H8 . 30198 1
stop_
save_