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 19862
_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_condition_AGC_major_isomer
_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 COSY' . . . 19862 1
2 '2D 1H-1H NOESY' . . . 19862 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.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 5.747 0.01 . 1 . . . . A 1 DC H1' . 19862 1
2 . 1 1 1 1 DC H2' H 1 2.080 0.01 . 1 . . . . A 1 DC H2' . 19862 1
3 . 1 1 1 1 DC H2'' H 1 2.463 0.01 . 1 . . . . A 1 DC H2'' . 19862 1
4 . 1 1 1 1 DC H3' H 1 4.586 0.01 . 1 . . . . A 1 DC H3' . 19862 1
5 . 1 1 1 1 DC H5 H 1 5.808 0.01 . 1 . . . . A 1 DC H5 . 19862 1
6 . 1 1 1 1 DC H6 H 1 7.754 0.01 . 1 . . . . A 1 DC H6 . 19862 1
7 . 1 1 2 2 DT H1' H 1 5.465 0.01 . 1 . . . . A 2 DT H1' . 19862 1
8 . 1 1 2 2 DT H2' H 1 2.043 0.01 . 1 . . . . A 2 DT H2' . 19862 1
9 . 1 1 2 2 DT H2'' H 1 2.282 0.01 . 1 . . . . A 2 DT H2'' . 19862 1
10 . 1 1 2 2 DT H3' H 1 4.805 0.01 . 1 . . . . A 2 DT H3' . 19862 1
11 . 1 1 2 2 DT H6 H 1 7.486 0.01 . 1 . . . . A 2 DT H6 . 19862 1
12 . 1 1 2 2 DT H71 H 1 1.638 0.01 . 1 . . . . A 2 DT H7 . 19862 1
13 . 1 1 2 2 DT H72 H 1 1.638 0.01 . 1 . . . . A 2 DT H7 . 19862 1
14 . 1 1 2 2 DT H73 H 1 1.638 0.01 . 1 . . . . A 2 DT H7 . 19862 1
15 . 1 1 3 3 DA H1' H 1 5.906 0.01 . 1 . . . . A 3 DA H1' . 19862 1
16 . 1 1 3 3 DA H2 H 1 7.275 0.01 . 1 . . . . A 3 DA H2 . 19862 1
17 . 1 1 3 3 DA H2' H 1 2.602 0.01 . 1 . . . . A 3 DA H2' . 19862 1
18 . 1 1 3 3 DA H2'' H 1 2.765 0.01 . 1 . . . . A 3 DA H2'' . 19862 1
19 . 1 1 3 3 DA H8 H 1 8.092 0.01 . 1 . . . . A 3 DA H8 . 19862 1
20 . 1 1 4 4 DA H1' H 1 5.986 0.01 . 1 . . . . A 4 DA H1' . 19862 1
21 . 1 1 4 4 DA H2 H 1 7.554 0.01 . 1 . . . . A 4 DA H2 . 19862 1
22 . 1 1 4 4 DA H2' H 1 2.681 0.01 . 1 . . . . A 4 DA H2' . 19862 1
23 . 1 1 4 4 DA H2'' H 1 2.837 0.01 . 1 . . . . A 4 DA H2'' . 19862 1
24 . 1 1 4 4 DA H3' H 1 5.042 0.01 . 1 . . . . A 4 DA H3' . 19862 1
25 . 1 1 4 4 DA H8 H 1 8.181 0.01 . 1 . . . . A 4 DA H8 . 19862 1
26 . 1 1 5 5 FAG H1' H 1 5.318 0.01 . 1 . . . . A 5 FAG H1' . 19862 1
27 . 1 1 5 5 FAG H2'1 H 1 1.916 0.01 . 1 . . . . A 5 FAG H2'1 . 19862 1
28 . 1 1 5 5 FAG H2'2 H 1 2.009 0.01 . 1 . . . . A 5 FAG H2'2 . 19862 1
29 . 1 1 5 5 FAG H2A1 H 1 1.771 0.01 . 1 . . . . A 5 FAG H2A1 . 19862 1
30 . 1 1 5 5 FAG H2A2 H 1 1.880 0.01 . 1 . . . . A 5 FAG H2A2 . 19862 1
31 . 1 1 5 5 FAG H3' H 1 4.488 0.01 . 1 . . . . A 5 FAG H3' . 19862 1
32 . 1 1 5 5 FAG H31 H 1 2.579 0.01 . 1 . . . . A 5 FAG H31 . 19862 1
33 . 1 1 5 5 FAG H32 H 1 2.873 0.01 . 1 . . . . A 5 FAG H32 . 19862 1
34 . 1 1 5 5 FAG H5B H 1 5.802 0.01 . 1 . . . . A 5 FAG H5B . 19862 1
35 . 1 1 5 5 FAG H6A H 1 6.200 0.01 . 1 . . . . A 5 FAG H6A . 19862 1
36 . 1 1 5 5 FAG H7 H 1 3.572 0.01 . 1 . . . . A 5 FAG H7 . 19862 1
37 . 1 1 5 5 FAG H8 H 1 8.350 0.01 . 1 . . . . A 5 FAG H8 . 19862 1
38 . 1 1 5 5 FAG H8A H 1 5.723 0.01 . 1 . . . . A 5 FAG H8A . 19862 1
39 . 1 1 5 5 FAG H9 H 1 4.841 0.01 . 1 . . . . A 5 FAG H9 . 19862 1
40 . 1 1 5 5 FAG H9A H 1 3.700 0.01 . 1 . . . . A 5 FAG H9A . 19862 1
41 . 1 1 6 6 DC H1' H 1 6.108 0.01 . 1 . . . . A 6 DC H1' . 19862 1
42 . 1 1 6 6 DC H2' H 1 2.183 0.01 . 1 . . . . A 6 DC H2' . 19862 1
43 . 1 1 6 6 DC H2'' H 1 2.506 0.01 . 1 . . . . A 6 DC H2'' . 19862 1
44 . 1 1 6 6 DC H5 H 1 5.480 0.01 . 1 . . . . A 6 DC H5 . 19862 1
45 . 1 1 6 6 DC H6 H 1 7.458 0.01 . 1 . . . . A 6 DC H6 . 19862 1
46 . 1 1 7 7 DT H1' H 1 6.068 0.01 . 1 . . . . A 7 DT H1' . 19862 1
47 . 1 1 7 7 DT H2' H 1 2.181 0.01 . 1 . . . . A 7 DT H2' . 19862 1
48 . 1 1 7 7 DT H2'' H 1 2.574 0.01 . 1 . . . . A 7 DT H2'' . 19862 1
49 . 1 1 7 7 DT H6 H 1 7.446 0.01 . 1 . . . . A 7 DT H6 . 19862 1
50 . 1 1 7 7 DT H71 H 1 1.568 0.01 . 1 . . . . A 7 DT H7 . 19862 1
51 . 1 1 7 7 DT H72 H 1 1.568 0.01 . 1 . . . . A 7 DT H7 . 19862 1
52 . 1 1 7 7 DT H73 H 1 1.568 0.01 . 1 . . . . A 7 DT H7 . 19862 1
53 . 1 1 8 8 DT H1' H 1 6.035 0.01 . 1 . . . . A 8 DT H1' . 19862 1
54 . 1 1 8 8 DT H2' H 1 2.025 0.01 . 1 . . . . A 8 DT H2' . 19862 1
55 . 1 1 8 8 DT H2'' H 1 2.407 0.01 . 1 . . . . A 8 DT H2'' . 19862 1
56 . 1 1 8 8 DT H3' H 1 4.846 0.01 . 1 . . . . A 8 DT H3' . 19862 1
57 . 1 1 8 8 DT H6 H 1 7.413 0.01 . 1 . . . . A 8 DT H6 . 19862 1
58 . 1 1 8 8 DT H71 H 1 1.679 0.01 . 1 . . . . A 8 DT H7 . 19862 1
59 . 1 1 8 8 DT H72 H 1 1.679 0.01 . 1 . . . . A 8 DT H7 . 19862 1
60 . 1 1 8 8 DT H73 H 1 1.679 0.01 . 1 . . . . A 8 DT H7 . 19862 1
61 . 1 1 9 9 DC H1' H 1 5.635 0.01 . 1 . . . . A 9 DC H1' . 19862 1
62 . 1 1 9 9 DC H2' H 1 2.020 0.01 . 1 . . . . A 9 DC H2' . 19862 1
63 . 1 1 9 9 DC H2'' H 1 2.263 0.01 . 1 . . . . A 9 DC H2'' . 19862 1
64 . 1 1 9 9 DC H3' H 1 4.790 0.01 . 1 . . . . A 9 DC H3' . 19862 1
65 . 1 1 9 9 DC H5 H 1 5.750 0.01 . 1 . . . . A 9 DC H5 . 19862 1
66 . 1 1 9 9 DC H6 H 1 7.493 0.01 . 1 . . . . A 9 DC H6 . 19862 1
67 . 1 1 10 10 DA H1' H 1 6.296 0.01 . 1 . . . . A 10 DA H1' . 19862 1
68 . 1 1 10 10 DA H2 H 1 7.759 0.01 . 1 . . . . A 10 DA H2 . 19862 1
69 . 1 1 10 10 DA H2' H 1 2.687 0.01 . 1 . . . . A 10 DA H2' . 19862 1
70 . 1 1 10 10 DA H2'' H 1 2.439 0.01 . 1 . . . . A 10 DA H2'' . 19862 1
71 . 1 1 10 10 DA H3' H 1 4.686 0.01 . 1 . . . . A 10 DA H3' . 19862 1
72 . 1 1 10 10 DA H8 H 1 8.241 0.01 . 1 . . . . A 10 DA H8 . 19862 1
73 . 2 2 1 1 DT H1' H 1 5.719 0.01 . 1 . . . . . 11 DT H1' . 19862 1
74 . 2 2 1 1 DT H2' H 1 1.708 0.01 . 1 . . . . . 11 DT H2' . 19862 1
75 . 2 2 1 1 DT H2'' H 1 2.148 0.01 . 1 . . . . . 11 DT H2'' . 19862 1
76 . 2 2 1 1 DT H3' H 1 4.575 0.01 . 1 . . . . . 11 DT H3' . 19862 1
77 . 2 2 1 1 DT H6 H 1 7.318 0.01 . 1 . . . . . 11 DT H6 . 19862 1
78 . 2 2 1 1 DT H71 H 1 1.572 0.01 . 1 . . . . . 11 DT H7 . 19862 1
79 . 2 2 1 1 DT H72 H 1 1.572 0.01 . 1 . . . . . 11 DT H7 . 19862 1
80 . 2 2 1 1 DT H73 H 1 1.572 0.01 . 1 . . . . . 11 DT H7 . 19862 1
81 . 2 2 2 2 DG H1' H 1 5.276 0.01 . 1 . . . . . 12 DG H1' . 19862 1
82 . 2 2 2 2 DG H2' H 1 2.696 0.01 . 1 . . . . . 12 DG H2' . 19862 1
83 . 2 2 2 2 DG H2'' H 1 2.732 0.01 . 1 . . . . . 12 DG H2'' . 19862 1
84 . 2 2 2 2 DG H8 H 1 7.949 0.01 . 1 . . . . . 12 DG H8 . 19862 1
85 . 2 2 3 3 DA H1' H 1 5.827 0.01 . 1 . . . . . 13 DA H1' . 19862 1
86 . 2 2 3 3 DA H2 H 1 7.320 0.01 . 1 . . . . . 13 DA H2 . 19862 1
87 . 2 2 3 3 DA H2' H 1 2.721 0.01 . 1 . . . . . 13 DA H2' . 19862 1
88 . 2 2 3 3 DA H2'' H 1 2.838 0.01 . 1 . . . . . 13 DA H2'' . 19862 1
89 . 2 2 3 3 DA H3' H 1 5.037 0.01 . 1 . . . . . 13 DA H3' . 19862 1
90 . 2 2 3 3 DA H8 H 1 8.189 0.01 . 1 . . . . . 13 DA H8 . 19862 1
91 . 2 2 4 4 DA H1' H 1 5.976 0.01 . 1 . . . . . 14 DA H1' . 19862 1
92 . 2 2 4 4 DA H2 H 1 7.553 0.01 . 1 . . . . . 14 DA H2 . 19862 1
93 . 2 2 4 4 DA H2' H 1 2.559 0.01 . 1 . . . . . 14 DA H2' . 19862 1
94 . 2 2 4 4 DA H2'' H 1 2.801 0.01 . 1 . . . . . 14 DA H2'' . 19862 1
95 . 2 2 4 4 DA H3' H 1 5.001 0.01 . 1 . . . . . 14 DA H3' . 19862 1
96 . 2 2 4 4 DA H8 H 1 7.993 0.01 . 1 . . . . . 14 DA H8 . 19862 1
97 . 2 2 5 5 DG H1' H 1 5.759 0.01 . 1 . . . . . 15 DG H1' . 19862 1
98 . 2 2 5 5 DG H2' H 1 2.323 0.01 . 1 . . . . . 15 DG H2' . 19862 1
99 . 2 2 5 5 DG H2'' H 1 2.688 0.01 . 1 . . . . . 15 DG H2'' . 19862 1
100 . 2 2 5 5 DG H8 H 1 7.425 0.01 . 1 . . . . . 15 DG H8 . 19862 1
101 . 2 2 6 6 DC H1' H 1 5.726 0.01 . 1 . . . . . 16 DC H1' . 19862 1
102 . 2 2 6 6 DC H2' H 1 2.118 0.01 . 1 . . . . . 16 DC H2' . 19862 1
103 . 2 2 6 6 DC H2'' H 1 2.202 0.01 . 1 . . . . . 16 DC H2'' . 19862 1
104 . 2 2 6 6 DC H3' H 1 4.768 0.01 . 1 . . . . . 16 DC H3' . 19862 1
105 . 2 2 6 6 DC H5 H 1 5.160 0.01 . 1 . . . . . 16 DC H5 . 19862 1
106 . 2 2 6 6 DC H6 H 1 7.052 0.01 . 1 . . . . . 16 DC H6 . 19862 1
107 . 2 2 7 7 DT H1' H 1 5.975 0.01 . 1 . . . . . 17 DT H1' . 19862 1
108 . 2 2 7 7 DT H2' H 1 2.405 0.01 . 1 . . . . . 17 DT H2' . 19862 1
109 . 2 2 7 7 DT H2'' H 1 2.498 0.01 . 1 . . . . . 17 DT H2'' . 19862 1
110 . 2 2 7 7 DT H3' H 1 4.824 0.01 . 1 . . . . . 17 DT H3' . 19862 1
111 . 2 2 7 7 DT H6 H 1 7.604 0.01 . 1 . . . . . 17 DT H6 . 19862 1
112 . 2 2 7 7 DT H71 H 1 1.772 0.01 . 1 . . . . . 17 DT H7 . 19862 1
113 . 2 2 7 7 DT H72 H 1 1.772 0.01 . 1 . . . . . 17 DT H7 . 19862 1
114 . 2 2 7 7 DT H73 H 1 1.772 0.01 . 1 . . . . . 17 DT H7 . 19862 1
115 . 2 2 8 8 DT H1' H 1 5.539 0.01 . 1 . . . . . 18 DT H1' . 19862 1
116 . 2 2 8 8 DT H2' H 1 2.077 0.01 . 1 . . . . . 18 DT H2' . 19862 1
117 . 2 2 8 8 DT H2'' H 1 2.345 0.01 . 1 . . . . . 18 DT H2'' . 19862 1
118 . 2 2 8 8 DT H3' H 1 4.822 0.01 . 1 . . . . . 18 DT H3' . 19862 1
119 . 2 2 8 8 DT H6 H 1 7.443 0.01 . 1 . . . . . 18 DT H6 . 19862 1
120 . 2 2 8 8 DT H71 H 1 1.681 0.01 . 1 . . . . . 18 DT H7 . 19862 1
121 . 2 2 8 8 DT H72 H 1 1.681 0.01 . 1 . . . . . 18 DT H7 . 19862 1
122 . 2 2 8 8 DT H73 H 1 1.681 0.01 . 1 . . . . . 18 DT H7 . 19862 1
123 . 2 2 9 9 DA H1' H 1 6.068 0.01 . 1 . . . . . 19 DA H1' . 19862 1
124 . 2 2 9 9 DA H2 H 1 7.499 0.01 . 1 . . . . . 19 DA H2 . 19862 1
125 . 2 2 9 9 DA H2' H 1 2.731 0.01 . 1 . . . . . 19 DA H2' . 19862 1
126 . 2 2 9 9 DA H2'' H 1 2.886 0.01 . 1 . . . . . 19 DA H2'' . 19862 1
127 . 2 2 9 9 DA H3' H 1 5.037 0.01 . 1 . . . . . 19 DA H3' . 19862 1
128 . 2 2 9 9 DA H8 H 1 8.242 0.01 . 1 . . . . . 19 DA H8 . 19862 1
129 . 2 2 10 10 DG H1' H 1 5.964 0.01 . 1 . . . . . 20 DG H1' . 19862 1
130 . 2 2 10 10 DG H2' H 1 2.414 0.01 . 1 . . . . . 20 DG H2' . 19862 1
131 . 2 2 10 10 DG H2'' H 1 2.242 0.01 . 1 . . . . . 20 DG H2'' . 19862 1
132 . 2 2 10 10 DG H3' H 1 4.614 0.01 . 1 . . . . . 20 DG H3' . 19862 1
133 . 2 2 10 10 DG H8 H 1 7.687 0.01 . 1 . . . . . 20 DG H8 . 19862 1
stop_
save_