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 31188
_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 0.01
_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' . . . 31188 1
2 '2D DQF-COSY' . . . 31188 1
3 '2D NOESY' . . . 31188 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 G H1 H 1 12.41 0.00 . 1 . . . . A 1 G H1 . 31188 1
2 . 1 . 1 1 1 G H1' H 1 5.63 0.00 . 1 . . . . A 1 G H1' . 31188 1
3 . 1 . 1 1 1 G H2' H 1 4.75 0.00 . 1 . . . . A 1 G H2' . 31188 1
4 . 1 . 1 1 1 G H3' H 1 4.63 0.00 . 1 . . . . A 1 G H3' . 31188 1
5 . 1 . 1 1 1 G H4' H 1 4.38 0.00 . 1 . . . . A 1 G H4' . 31188 1
6 . 1 . 1 1 1 G H5' H 1 4.03 0.00 . 1 . . . . A 1 G H5' . 31188 1
7 . 1 . 1 1 1 G H8 H 1 7.96 0.00 . 1 . . . . A 1 G H8 . 31188 1
8 . 1 . 1 2 2 A H1' H 1 6.04 0.00 . 1 . . . . A 2 A H1' . 31188 1
9 . 1 . 1 2 2 A H2 H 1 7.81 0.00 . 1 . . . . A 2 A H2 . 31188 1
10 . 1 . 1 2 2 A H2' H 1 4.49 0.00 . 1 . . . . A 2 A H2' . 31188 1
11 . 1 . 1 2 2 A H3' H 1 4.77 0.00 . 1 . . . . A 2 A H3' . 31188 1
12 . 1 . 1 2 2 A H4' H 1 4.53 0.00 . 1 . . . . A 2 A H4' . 31188 1
13 . 1 . 1 2 2 A H8 H 1 8.16 0.00 . 1 . . . . A 2 A H8 . 31188 1
14 . 1 . 1 3 3 C H1' H 1 5.43 0.00 . 1 . . . . A 3 C H1' . 31188 1
15 . 1 . 1 3 3 C H2' H 1 4.32 0.00 . 1 . . . . A 3 C H2' . 31188 1
16 . 1 . 1 3 3 C H3' H 1 4.52 0.00 . 1 . . . . A 3 C H3' . 31188 1
17 . 1 . 1 3 3 C H4' H 1 4.40 0.00 . 1 . . . . A 3 C H4' . 31188 1
18 . 1 . 1 3 3 C H5 H 1 5.18 0.00 . 1 . . . . A 3 C H5 . 31188 1
19 . 1 . 1 3 3 C H6 H 1 7.63 0.00 . 1 . . . . A 3 C H6 . 31188 1
20 . 1 . 1 3 3 C H41 H 1 8.247 0.00 . 1 . . . . A 3 C H41 . 31188 1
21 . 1 . 1 3 3 C H42 H 1 6.893 0.00 . 1 . . . . A 3 C H42 . 31188 1
22 . 1 . 1 4 4 A H1' H 1 5.88 0.00 . 1 . . . . A 4 A H1' . 31188 1
23 . 1 . 1 4 4 A H2 H 1 7.04 0.00 . 1 . . . . A 4 A H2 . 31188 1
24 . 1 . 1 4 4 A H2' H 1 4.55 0.00 . 1 . . . . A 4 A H2' . 31188 1
25 . 1 . 1 4 4 A H3' H 1 4.72 0.00 . 1 . . . . A 4 A H3' . 31188 1
26 . 1 . 1 4 4 A H4' H 1 4.47 0.00 . 1 . . . . A 4 A H4' . 31188 1
27 . 1 . 1 4 4 A H8 H 1 7.96 0.00 . 1 . . . . A 4 A H8 . 31188 1
28 . 1 . 1 5 5 G H1 H 1 13.48 0.00 . 1 . . . . A 5 G H1 . 31188 1
29 . 1 . 1 5 5 G H1' H 1 5.60 0.00 . 1 . . . . A 5 G H1' . 31188 1
30 . 1 . 1 5 5 G H2' H 1 4.32 0.00 . 1 . . . . A 5 G H2' . 31188 1
31 . 1 . 1 5 5 G H3' H 1 4.44 0.00 . 1 . . . . A 5 G H3' . 31188 1
32 . 1 . 1 5 5 G H4' H 1 4.41 0.00 . 1 . . . . A 5 G H4' . 31188 1
33 . 1 . 1 5 5 G H8 H 1 7.27 0.00 . 1 . . . . A 5 G H8 . 31188 1
34 . 1 . 1 6 6 C H1' H 1 5.50 0.00 . 1 . . . . A 6 C H1' . 31188 1
35 . 1 . 1 6 6 C H2' H 1 4.25 0.00 . 1 . . . . A 6 C H2' . 31188 1
36 . 1 . 1 6 6 C H3' H 1 4.35 0.00 . 1 . . . . A 6 C H3' . 31188 1
37 . 1 . 1 6 6 C H4' H 1 4.35 0.00 . 1 . . . . A 6 C H4' . 31188 1
38 . 1 . 1 6 6 C H5 H 1 5.13 0.00 . 1 . . . . A 6 C H5 . 31188 1
39 . 1 . 1 6 6 C H6 H 1 7.45 0.00 . 1 . . . . A 6 C H6 . 31188 1
40 . 1 . 1 6 6 C H41 H 1 8.314 0.00 . 1 . . . . A 6 C H41 . 31188 1
41 . 1 . 1 6 6 C H42 H 1 6.64 0.00 . 1 . . . . A 6 C H42 . 31188 1
42 . 1 . 1 7 7 U H1' H 1 5.56 0.00 . 1 . . . . A 7 U H1' . 31188 1
43 . 1 . 1 7 7 U H2' H 1 4.28 0.00 . 1 . . . . A 7 U H2' . 31188 1
44 . 1 . 1 7 7 U H3' H 1 4.47 0.00 . 1 . . . . A 7 U H3' . 31188 1
45 . 1 . 1 7 7 U H4' H 1 4.38 0.00 . 1 . . . . A 7 U H4' . 31188 1
46 . 1 . 1 7 7 U H6 H 1 7.64 0.00 . 1 . . . . A 7 U H6 . 31188 1
47 . 1 . 1 8 8 G H1 H 1 13.22 0.00 . 1 . . . . A 8 G H1 . 31188 1
48 . 1 . 1 8 8 G H1' H 1 5.63 0.00 . 1 . . . . A 8 G H1' . 31188 1
49 . 1 . 1 8 8 G H2' H 1 4.53 0.00 . 1 . . . . A 8 G H2' . 31188 1
50 . 1 . 1 8 8 G H8 H 1 7.80 0.00 . 1 . . . . A 8 G H8 . 31188 1
51 . 1 . 1 9 9 C H1' H 1 5.53 0.00 . 1 . . . . A 9 C H1' . 31188 1
52 . 1 . 1 9 9 C H2' H 1 4.35 0.00 . 1 . . . . A 9 C H2' . 31188 1
53 . 1 . 1 9 9 C H3' H 1 4.44 0.00 . 1 . . . . A 9 C H3' . 31188 1
54 . 1 . 1 9 9 C H5 H 1 5.19 0.00 . 1 . . . . A 9 C H5 . 31188 1
55 . 1 . 1 9 9 C H6 H 1 7.76 0.00 . 1 . . . . A 9 C H6 . 31188 1
56 . 1 . 1 9 9 C H41 H 1 8.553 0.00 . 1 . . . . A 9 C H41 . 31188 1
57 . 1 . 1 9 9 C H42 H 1 6.786 0.00 . 1 . . . . A 9 C H42 . 31188 1
58 . 1 . 1 10 10 U H1' H 1 5.53 0.00 . 1 . . . . A 10 U H1' . 31188 1
59 . 1 . 1 10 10 U H2' H 1 4.63 0.00 . 1 . . . . A 10 U H2' . 31188 1
60 . 1 . 1 10 10 U H3 H 1 13.64 0.00 . 1 . . . . A 10 U H3 . 31188 1
61 . 1 . 1 10 10 U H5 H 1 5.36 0.00 . 1 . . . . A 10 U H5 . 31188 1
62 . 1 . 1 10 10 U H6 H 1 7.95 0.00 . 1 . . . . A 10 U H6 . 31188 1
63 . 1 . 1 11 11 G H1 H 1 12.62 0.00 . 1 . . . . A 11 G H1 . 31188 1
64 . 1 . 1 11 11 G H1' H 1 5.78 0.00 . 1 . . . . A 11 G H1' . 31188 1
65 . 1 . 1 11 11 G H2' H 1 4.42 0.00 . 1 . . . . A 11 G H2' . 31188 1
66 . 1 . 1 11 11 G H3' H 1 4.58 0.00 . 1 . . . . A 11 G H3' . 31188 1
67 . 1 . 1 11 11 G H4' H 1 4.48 0.00 . 1 . . . . A 11 G H4' . 31188 1
68 . 1 . 1 11 11 G H8 H 1 7.76 0.00 . 1 . . . . A 11 G H8 . 31188 1
69 . 1 . 1 12 12 U H1' H 1 5.48 0.00 . 1 . . . . A 12 U H1' . 31188 1
70 . 1 . 1 12 12 U H2' H 1 4.20 0.00 . 1 . . . . A 12 U H2' . 31188 1
71 . 1 . 1 12 12 U H3 H 1 14.62 0.00 . 1 . . . . A 12 U H3 . 31188 1
72 . 1 . 1 12 12 U H3' H 1 4.46 0.00 . 1 . . . . A 12 U H3' . 31188 1
73 . 1 . 1 12 12 U H4' H 1 4.38 0.00 . 1 . . . . A 12 U H4' . 31188 1
74 . 1 . 1 12 12 U H5 H 1 5.12 0.00 . 1 . . . . A 12 U H5 . 31188 1
75 . 1 . 1 12 12 U H6 H 1 7.80 0.00 . 1 . . . . A 12 U H6 . 31188 1
76 . 1 . 1 13 13 C H1' H 1 5.83 0.00 . 1 . . . . A 13 C H1' . 31188 1
77 . 1 . 1 13 13 C H2' H 1 3.92 0.00 . 1 . . . . A 13 C H2' . 31188 1
78 . 1 . 1 13 13 C H3' H 1 4.17 0.00 . 1 . . . . A 13 C H3' . 31188 1
79 . 1 . 1 13 13 C H4' H 1 4.44 0.00 . 1 . . . . A 13 C H4' . 31188 1
80 . 1 . 1 13 13 C H5 H 1 5.63 0.00 . 1 . . . . A 13 C H5 . 31188 1
81 . 1 . 1 13 13 C H6 H 1 7.75 0.00 . 1 . . . . A 13 C H6 . 31188 1
82 . 1 . 1 13 13 C H41 H 1 8.359 0.00 . 1 . . . . A 13 C H41 . 31188 1
83 . 1 . 1 13 13 C H42 H 1 7.029 0.00 . 1 . . . . A 13 C H42 . 31188 1
84 . 3 . 2 1 1 MQC H1 H 1 8.72 0.00 . 1 . . . . B 101 MQC H1 . 31188 1
85 . 3 . 2 1 1 MQC H16 H 1 2.49 0.00 . 1 . . . . B 101 MQC H16 . 31188 1
86 . 3 . 2 1 1 MQC H17 H 1 2.49 0.00 . 1 . . . . B 101 MQC H17 . 31188 1
87 . 3 . 2 1 1 MQC H18 H 1 3.77 0.00 . 1 . . . . B 101 MQC H18 . 31188 1
88 . 3 . 2 1 1 MQC H19 H 1 3.77 0.00 . 1 . . . . B 101 MQC H19 . 31188 1
89 . 3 . 2 1 1 MQC H2 H 1 8.06 0.00 . 1 . . . . B 101 MQC H2 . 31188 1
90 . 3 . 2 1 1 MQC H20 H 1 3.77 0.00 . 1 . . . . B 101 MQC H20 . 31188 1
91 . 3 . 2 1 1 MQC H3 H 1 7.81 0.00 . 1 . . . . B 101 MQC H3 . 31188 1
92 . 3 . 2 1 1 MQC H4 H 1 6.74 0.00 . 1 . . . . B 101 MQC H4 . 31188 1
93 . 3 . 2 1 1 MQC H5 H 1 6.89 0.00 . 1 . . . . B 101 MQC H5 . 31188 1
94 . 3 . 2 1 1 MQC H6 H 1 6.92 0.00 . 1 . . . . B 101 MQC H6 . 31188 1
95 . 3 . 2 1 1 MQC H7 H 1 7.38 0.00 . 1 . . . . B 101 MQC H7 . 31188 1
96 . 3 . 2 1 1 MQC H8 H 1 6.95 0.00 . 1 . . . . B 101 MQC H8 . 31188 1
stop_
save_