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 15613
_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 $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
1 '2D 1H-1H TOCSY' . . . 15613 1
3 '2D 1H-1H NOESY' . . . 15613 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
3 $AMIX . . 15613 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 5.88 . . . . . . . 1 A H1' . 15613 1
2 . 1 1 1 1 DA H2 H 1 7.5 . . . . . . . 1 A H2 . 15613 1
3 . 1 1 1 1 DA H2' H 1 2.5 . . . . . . . 1 A H2' . 15613 1
4 . 1 1 1 1 DA H2'' H 1 2.71 . . . . . . . 1 A H2'' . 15613 1
5 . 1 1 1 1 DA H3' H 1 4.79 . . . . . . . 1 A H3' . 15613 1
6 . 1 1 1 1 DA H4' H 1 4.11 . . . . . . . 1 A H4' . 15613 1
7 . 1 1 1 1 DA H8 H 1 8.03 . . . . . . . 1 A H8 . 15613 1
8 . 1 1 2 2 DA H1' H 1 6.21 . . . . . . . 2 A H1' . 15613 1
9 . 1 1 2 2 DA H2 H 1 7.48 . . . . . . . 2 A H2 . 15613 1
10 . 1 1 2 2 DA H2' H 1 2.6 . . . . . . . 2 A H2' . 15613 1
11 . 1 1 2 2 DA H2'' H 1 2.91 . . . . . . . 2 A H2'' . 15613 1
12 . 1 1 2 2 DA H3' H 1 4.8 . . . . . . . 2 A H3' . 15613 1
13 . 1 1 2 2 DA H4' H 1 4.41 . . . . . . . 2 A H4' . 15613 1
14 . 1 1 2 2 DA H8 H 1 8.18 . . . . . . . 2 A H8 . 15613 1
15 . 1 1 3 3 DT H3 H 1 13.59 . . . . . . . 3 T NH . 15613 1
16 . 1 1 3 3 DT H1' H 1 5.82 . . . . . . . 3 T H1' . 15613 1
17 . 1 1 3 3 DT H2' H 1 1.97 . . . . . . . 3 T H2' . 15613 1
18 . 1 1 3 3 DT H2'' H 1 2.41 . . . . . . . 3 T H2'' . 15613 1
19 . 1 1 3 3 DT H3' H 1 4.75 . . . . . . . 3 T H3' . 15613 1
20 . 1 1 3 3 DT H4' H 1 4.15 . . . . . . . 3 T H4' . 15613 1
21 . 1 1 3 3 DT H6 H 1 7.03 . . . . . . . 3 T H6 . 15613 1
22 . 1 1 3 3 DT H71 H 1 1.3 . . . . . . . 3 T H7 . 15613 1
23 . 1 1 3 3 DT H72 H 1 1.3 . . . . . . . 3 T H7 . 15613 1
24 . 1 1 3 3 DT H73 H 1 1.3 . . . . . . . 3 T H7 . 15613 1
25 . 1 1 4 4 DC H1' H 1 6.27 . . . . . . . 4 C H1' . 15613 1
26 . 1 1 4 4 DC H2' H 1 1.93 . . . . . . . 4 C H2' . 15613 1
27 . 1 1 4 4 DC H2'' H 1 2.43 . . . . . . . 4 C H2'' . 15613 1
28 . 1 1 4 4 DC H3' H 1 4.8 . . . . . . . 4 C H3' . 15613 1
29 . 1 1 4 4 DC H4' H 1 3.98 . . . . . . . 4 C H4' . 15613 1
30 . 1 1 4 4 DC H5 H 1 5.32 . . . . . . . 4 C H5 . 15613 1
31 . 1 1 4 4 DC H6 H 1 7.4 . . . . . . . 4 C H6 . 15613 1
32 . 1 1 4 4 DC H41 H 1 6.42 . . . . . . . 4 C H41 . 15613 1
33 . 1 1 5 5 DT H3 H 1 14 . . . . . . . 5 T NH . 15613 1
34 . 1 1 5 5 DT H1' H 1 5.51 . . . . . . . 5 T H1' . 15613 1
35 . 1 1 5 5 DT H2' H 1 1.9 . . . . . . . 5 T H2' . 15613 1
36 . 1 1 5 5 DT H2'' H 1 1.93 . . . . . . . 5 T H2'' . 15613 1
37 . 1 1 5 5 DT H3' H 1 4.82 . . . . . . . 5 T H3' . 15613 1
38 . 1 1 5 5 DT H4' H 1 4.18 . . . . . . . 5 T H4' . 15613 1
39 . 1 1 5 5 DT H5' H 1 3.67 . . . . . . . 5 T H5' . 15613 1
40 . 1 1 5 5 DT H6 H 1 7.18 . . . . . . . 5 T H6 . 15613 1
41 . 1 1 5 5 DT H71 H 1 1.51 . . . . . . . 5 T H7 . 15613 1
42 . 1 1 5 5 DT H72 H 1 1.51 . . . . . . . 5 T H7 . 15613 1
43 . 1 1 5 5 DT H73 H 1 1.51 . . . . . . . 5 T H7 . 15613 1
44 . 1 1 6 6 DT H3 H 1 13.47 . . . . . . . 6 T NH . 15613 1
45 . 1 1 6 6 DT H1' H 1 5.71 . . . . . . . 6 T H1' . 15613 1
46 . 1 1 6 6 DT H2' H 1 1.87 . . . . . . . 6 T H2' . 15613 1
47 . 1 1 6 6 DT H2'' H 1 2.13 . . . . . . . 6 T H2'' . 15613 1
48 . 1 1 6 6 DT H3' H 1 4.6 . . . . . . . 6 T H3' . 15613 1
49 . 1 1 6 6 DT H4' H 1 4.16 . . . . . . . 6 T H4' . 15613 1
50 . 1 1 6 6 DT H5' H 1 3.16 . . . . . . . 6 T H5' . 15613 1
51 . 1 1 6 6 DT H6 H 1 7.17 . . . . . . . 6 T H6 . 15613 1
52 . 1 1 6 6 DT H71 H 1 1.52 . . . . . . . 6 T H7 . 15613 1
53 . 1 1 6 6 DT H72 H 1 1.52 . . . . . . . 6 T H7 . 15613 1
54 . 1 1 6 6 DT H73 H 1 1.52 . . . . . . . 6 T H7 . 15613 1
55 . 1 1 7 7 DT H3 H 1 13.16 . . . . . . . 7 T NH . 15613 1
56 . 1 1 7 7 DT H1' H 1 5.81 . . . . . . . 7 T H1' . 15613 1
57 . 1 1 7 7 DT H2' H 1 2.3 . . . . . . . 7 T H2' . 15613 1
58 . 1 1 7 7 DT H2'' H 1 2.46 . . . . . . . 7 T H2'' . 15613 1
59 . 1 1 7 7 DT H3' H 1 4.81 . . . . . . . 7 T H3' . 15613 1
60 . 1 1 7 7 DT H4' H 1 4.07 . . . . . . . 7 T H4' . 15613 1
61 . 1 1 7 7 DT H5' H 1 3.15 . . . . . . . 7 T H5' . 15613 1
62 . 1 1 7 7 DT H6 H 1 7.24 . . . . . . . 7 T H6 . 15613 1
63 . 1 1 7 7 DT H71 H 1 1.48 . . . . . . . 7 T H7 . 15613 1
64 . 1 1 7 7 DT H72 H 1 1.48 . . . . . . . 7 T H7 . 15613 1
65 . 1 1 7 7 DT H73 H 1 1.48 . . . . . . . 7 T H7 . 15613 1
66 . 1 1 8 8 DA H1' H 1 5.6 . . . . . . . 8 A H1' . 15613 1
67 . 1 1 8 8 DA H2 H 1 6.9 . . . . . . . 8 A H2 . 15613 1
68 . 1 1 8 8 DA H2' H 1 2.65 . . . . . . . 8 A H2' . 15613 1
69 . 1 1 8 8 DA H2'' H 1 2.69 . . . . . . . 8 A H2'' . 15613 1
70 . 1 1 8 8 DA H3' H 1 4.93 . . . . . . . 8 A H3' . 15613 1
71 . 1 1 8 8 DA H4' H 1 4.12 . . . . . . . 8 A H4' . 15613 1
72 . 1 1 8 8 DA H8 H 1 8.05 . . . . . . . 8 A H8 . 15613 1
73 . 1 1 9 9 DA H1' H 1 5.48 . . . . . . . 9 A H1' . 15613 1
74 . 1 1 9 9 DA H2 H 1 7.26 . . . . . . . 9 A H2 . 15613 1
75 . 1 1 9 9 DA H2' H 1 2.44 . . . . . . . 9 A H2' . 15613 1
76 . 1 1 9 9 DA H2'' H 1 2.69 . . . . . . . 9 A H2'' . 15613 1
77 . 1 1 9 9 DA H3' H 1 4.91 . . . . . . . 9 A H3' . 15613 1
78 . 1 1 9 9 DA H4' H 1 4.12 . . . . . . . 9 A H4' . 15613 1
79 . 1 1 9 9 DA H8 H 1 7.95 . . . . . . . 9 A H8 . 15613 1
80 . 1 1 10 10 DA H1' H 1 5.82 . . . . . . . 10 A H1' . 15613 1
81 . 1 1 10 10 DA H2 H 1 7.84 . . . . . . . 10 A H2 . 15613 1
82 . 1 1 10 10 DA H2' H 1 2.27 . . . . . . . 10 A H2' . 15613 1
83 . 1 1 10 10 DA H2'' H 1 2.46 . . . . . . . 10 A H2'' . 15613 1
84 . 1 1 10 10 DA H3' H 1 4.83 . . . . . . . 10 A H3' . 15613 1
85 . 1 1 10 10 DA H4' H 1 4.16 . . . . . . . 10 A H4' . 15613 1
86 . 1 1 10 10 DA H8 H 1 7.83 . . . . . . . 10 A H8 . 15613 1
87 . 1 1 10 10 DA H61 H 1 6.01 . . . . . . . 10 A H61 . 15613 1
88 . 1 1 11 11 DG H1 H 1 12.8 . . . . . . . 11 G NH . 15613 1
89 . 1 1 11 11 DG H1' H 1 5.83 . . . . . . . 11 G H1' . 15613 1
90 . 1 1 11 11 DG H2' H 1 2.6 . . . . . . . 11 G H2' . 15613 1
91 . 1 1 11 11 DG H2'' H 1 2.74 . . . . . . . 11 G H2'' . 15613 1
92 . 1 1 11 11 DG H3' H 1 4.96 . . . . . . . 11 G H3' . 15613 1
93 . 1 1 11 11 DG H4' H 1 4.13 . . . . . . . 11 G H4' . 15613 1
94 . 1 1 11 11 DG H8 H 1 8.2 . . . . . . . 11 G H8 . 15613 1
95 . 1 1 11 11 DG H21 H 1 8.32 . . . . . . . 11 G H21 . 15613 1
96 . 1 1 12 12 DA H1' H 1 6.19 . . . . . . . 12 A H1' . 15613 1
97 . 1 1 12 12 DA H2 H 1 7.96 . . . . . . . 12 A H2 . 15613 1
98 . 1 1 12 12 DA H2' H 1 2.39 . . . . . . . 12 A H2' . 15613 1
99 . 1 1 12 12 DA H2'' H 1 2.62 . . . . . . . 12 A H2'' . 15613 1
100 . 1 1 12 12 DA H3' H 1 4.89 . . . . . . . 12 A H3' . 15613 1
101 . 1 1 12 12 DA H4' H 1 4.16 . . . . . . . 12 A H4' . 15613 1
102 . 1 1 12 12 DA H8 H 1 7.93 . . . . . . . 12 A H8 . 15613 1
103 . 1 1 13 13 DT H1' H 1 6.06 . . . . . . . 13 T H1' . 15613 1
104 . 1 1 13 13 DT H2' H 1 1.98 . . . . . . . 13 T H2' . 15613 1
105 . 1 1 13 13 DT H2'' H 1 2.4 . . . . . . . 13 T H2'' . 15613 1
106 . 1 1 13 13 DT H3' H 1 4.67 . . . . . . . 13 T H3' . 15613 1
107 . 1 1 13 13 DT H4' H 1 4 . . . . . . . 13 T H4' . 15613 1
108 . 1 1 13 13 DT H6 H 1 7.07 . . . . . . . 13 T H6 . 15613 1
109 . 1 1 13 13 DT H71 H 1 1.11 . . . . . . . 13 T H7 . 15613 1
110 . 1 1 13 13 DT H72 H 1 1.11 . . . . . . . 13 T H7 . 15613 1
111 . 1 1 13 13 DT H73 H 1 1.11 . . . . . . . 13 T H7 . 15613 1
112 . 1 1 14 14 DT H1' H 1 6.24 . . . . . . . 14 T H1' . 15613 1
113 . 1 1 14 14 DT H2' H 1 2.19 . . . . . . . 14 T H2' . 15613 1
114 . 1 1 14 14 DT H2'' H 1 2.18 . . . . . . . 14 T H2'' . 15613 1
115 . 1 1 14 14 DT H3' H 1 4.52 . . . . . . . 14 T H3' . 15613 1
116 . 1 1 14 14 DT H4' H 1 4.04 . . . . . . . 14 T H4' . 15613 1
117 . 1 1 14 14 DT H5' H 1 3.19 . . . . . . . 14 T H5' . 15613 1
118 . 1 1 14 14 DT H6 H 1 7.3 . . . . . . . 14 T H6 . 15613 1
119 . 1 1 14 14 DT H71 H 1 1.49 . . . . . . . 14 T H7 . 15613 1
120 . 1 1 14 14 DT H72 H 1 1.49 . . . . . . . 14 T H7 . 15613 1
121 . 1 1 14 14 DT H73 H 1 1.49 . . . . . . . 14 T H7 . 15613 1
122 . 2 2 1 1 PZD H1A H 1 4.13 . . . . . . . . PZD H1A . 15613 1
123 . 2 2 1 1 PZD H4A H 1 3.98 . . . . . . . . PZD H4A . 15613 1
124 . 2 2 1 1 PZD H5A H 1 3.84 . . . . . . . . PZD H5A . 15613 1
125 . 2 2 1 1 PZD H8A H 1 7.17 . . . . . . . . PZD H8A . 15613 1
126 . 2 2 1 1 PZD H9A H 1 6.6 . . . . . . . . PZD H9A . 15613 1
127 . 2 2 1 1 PZD H10A H 1 7.45 . . . . . . . . PZD H10A . 15613 1
128 . 2 2 1 1 PZD H11A H 1 7.47 . . . . . . . . PZD H11A . 15613 1
129 . 2 2 1 1 PZD H12A H 1 7.79 . . . . . . . . PZD H12A . 15613 1
130 . 2 2 1 1 PZD H13A H 1 7.8 . . . . . . . . PZD H13A . 15613 1
131 . 2 2 1 1 PZD H14A H 1 7.85 . . . . . . . . PZD H14A . 15613 1
132 . 2 2 1 1 PZD H15A H 1 8.2 . . . . . . . . PZD H15A . 15613 1
133 . 2 2 1 1 PZD H16A H 1 7.6 . . . . . . . . PZD H16A . 15613 1
134 . 2 2 1 1 PZD H17A H 1 8.05 . . . . . . . . PZD H17A . 15613 1
135 . 2 2 1 1 PZD H18A H 1 3.99 . . . . . . . . PZD H18A . 15613 1
136 . 2 2 1 1 PZD H19A H 1 4.03 . . . . . . . . PZD H19A . 15613 1
137 . 2 2 1 1 PZD H20A H 1 5.84 . . . . . . . . PZD H20A . 15613 1
138 . 2 2 1 1 PZD H21A H 1 8.3 . . . . . . . . PZD H21A . 15613 1
stop_
save_