Content for NMR-STAR saveframe, "assigned_chemical_shifts_two"
save_assigned_chemical_shifts_two
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_two
_Assigned_chem_shift_list.Entry_ID 4248
_Assigned_chem_shift_list.ID 2
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_one
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_one
_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 $sample_one . 4248 2
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 . 2 2 1 1 DC H1' H 1 5.726 . . 1 . . . . . . . . 4248 2
2 . 2 2 1 1 DC H2'' H 1 1.900 . . 1 . . . . . . . . 4248 2
3 . 2 2 1 1 DC H2' H 1 2.415 . . 1 . . . . . . . . 4248 2
4 . 2 2 1 1 DC H3' H 1 4.437 . . 1 . . . . . . . . 4248 2
5 . 2 2 1 1 DC H4' H 1 4.087 . . 1 . . . . . . . . 4248 2
6 . 2 2 1 1 DC H5' H 1 3.777 . . 1 . . . . . . . . 4248 2
7 . 2 2 1 1 DC H5'' H 1 3.753 . . 1 . . . . . . . . 4248 2
8 . 2 2 1 1 DC H5 H 1 5.990 . . 1 . . . . . . . . 4248 2
9 . 2 2 1 1 DC H6 H 1 7.701 . . 1 . . . . . . . . 4248 2
10 . 2 2 2 2 DA H1' H 1 6.240 . . 1 . . . . . . . . 4248 2
11 . 2 2 2 2 DA H2'' H 1 2.820 . . 1 . . . . . . . . 4248 2
12 . 2 2 2 2 DA H2' H 1 2.909 . . 1 . . . . . . . . 4248 2
13 . 2 2 2 2 DA H3' H 1 5.504 . . 1 . . . . . . . . 4248 2
14 . 2 2 2 2 DA H4' H 1 4.439 . . 1 . . . . . . . . 4248 2
15 . 2 2 2 2 DA H5' H 1 4.179 . . 1 . . . . . . . . 4248 2
16 . 2 2 2 2 DA H5'' H 1 4.067 . . 1 . . . . . . . . 4248 2
17 . 2 2 2 2 DA H2 H 1 7.938 . . 1 . . . . . . . . 4248 2
18 . 2 2 2 2 DA H8 H 1 8.382 . . 1 . . . . . . . . 4248 2
19 . 2 2 3 3 DC H1' H 1 5.944 . . 1 . . . . . . . . 4248 2
20 . 2 2 3 3 DC H2'' H 1 2.195 . . 1 . . . . . . . . 4248 2
21 . 2 2 3 3 DC H2' H 1 2.501 . . 1 . . . . . . . . 4248 2
22 . 2 2 3 3 DC H3' H 1 4.797 . . 1 . . . . . . . . 4248 2
23 . 2 2 3 3 DC H4' H 1 4.240 . . 1 . . . . . . . . 4248 2
24 . 2 2 3 3 DC H5' H 1 3.602 . . 1 . . . . . . . . 4248 2
25 . 2 2 3 3 DC H5 H 1 5.325 . . 1 . . . . . . . . 4248 2
26 . 2 2 3 3 DC H6 H 1 7.387 . . 1 . . . . . . . . 4248 2
27 . 2 2 4 4 DC H1' H 1 5.982 . . 1 . . . . . . . . 4248 2
28 . 2 2 4 4 DC H2'' H 1 2.133 . . 1 . . . . . . . . 4248 2
29 . 2 2 4 4 DC H2' H 1 2.541 . . 1 . . . . . . . . 4248 2
30 . 2 2 4 4 DC H3' H 1 4.875 . . 1 . . . . . . . . 4248 2
31 . 2 2 4 4 DC H4' H 1 4.177 . . 1 . . . . . . . . 4248 2
32 . 2 2 4 4 DC H5 H 1 5.416 . . 1 . . . . . . . . 4248 2
33 . 2 2 4 4 DC H6 H 1 7.531 . . 1 . . . . . . . . 4248 2
34 . 2 2 5 5 DC H1' H 1 6.046 . . 1 . . . . . . . . 4248 2
35 . 2 2 5 5 DC H2'' H 1 2.400 . . 1 . . . . . . . . 4248 2
36 . 2 2 5 5 DC H2' H 1 1.950 . . 1 . . . . . . . . 4248 2
37 . 2 2 5 5 DC H3' H 1 4.893 . . 1 . . . . . . . . 4248 2
38 . 2 2 5 5 DC H4' H 1 4.048 . . 1 . . . . . . . . 4248 2
39 . 2 2 5 5 DC H5 H 1 5.715 . . 1 . . . . . . . . 4248 2
40 . 2 2 5 5 DC H6 H 1 7.515 . . 1 . . . . . . . . 4248 2
41 . 2 2 6 6 DT H1' H 1 6.325 . . 1 . . . . . . . . 4248 2
42 . 2 2 6 6 DT H2'' H 1 2.268 . . 1 . . . . . . . . 4248 2
43 . 2 2 6 6 DT H2' H 1 1.898 . . 1 . . . . . . . . 4248 2
44 . 2 2 6 6 DT H3' H 1 5.022 . . 1 . . . . . . . . 4248 2
45 . 2 2 6 6 DT H4' H 1 3.676 . . 1 . . . . . . . . 4248 2
46 . 2 2 6 6 DT H5' H 1 3.993 . . 2 . . . . . . . . 4248 2
47 . 2 2 6 6 DT H5'' H 1 4.132 . . 2 . . . . . . . . 4248 2
48 . 2 2 6 6 DT H6 H 1 7.334 . . 1 . . . . . . . . 4248 2
49 . 2 2 6 6 DT H71 H 1 2.028 . . 1 . . . . . . . . 4248 2
50 . 2 2 6 6 DT H72 H 1 2.028 . . 1 . . . . . . . . 4248 2
51 . 2 2 6 6 DT H73 H 1 2.028 . . 1 . . . . . . . . 4248 2
52 . 2 2 7 7 DT H1' H 1 6.202 . . 1 . . . . . . . . 4248 2
53 . 2 2 7 7 DT H2'' H 1 1.683 . . 1 . . . . . . . . 4248 2
54 . 2 2 7 7 DT H2' H 1 1.411 . . 1 . . . . . . . . 4248 2
55 . 2 2 7 7 DT H3' H 1 4.835 . . 1 . . . . . . . . 4248 2
56 . 2 2 7 7 DT H4' H 1 3.917 . . 1 . . . . . . . . 4248 2
57 . 2 2 7 7 DT H5' H 1 4.219 . . 2 . . . . . . . . 4248 2
58 . 2 2 7 7 DT H5'' H 1 4.061 . . 2 . . . . . . . . 4248 2
59 . 2 2 7 7 DT H6 H 1 7.022 . . 1 . . . . . . . . 4248 2
60 . 2 2 7 7 DT H71 H 1 1.976 . . 1 . . . . . . . . 4248 2
61 . 2 2 7 7 DT H72 H 1 1.976 . . 1 . . . . . . . . 4248 2
62 . 2 2 7 7 DT H73 H 1 1.976 . . 1 . . . . . . . . 4248 2
63 . 2 2 8 8 DT H1' H 1 5.465 . . 1 . . . . . . . . 4248 2
64 . 2 2 8 8 DT H2'' H 1 2.563 . . 1 . . . . . . . . 4248 2
65 . 2 2 8 8 DT H2' H 1 2.129 . . 1 . . . . . . . . 4248 2
66 . 2 2 8 8 DT H3' H 1 4.799 . . 1 . . . . . . . . 4248 2
67 . 2 2 8 8 DT H4' H 1 3.833 . . 1 . . . . . . . . 4248 2
68 . 2 2 8 8 DT H6 H 1 7.247 . . 1 . . . . . . . . 4248 2
69 . 2 2 8 8 DT H71 H 1 1.909 . . 1 . . . . . . . . 4248 2
70 . 2 2 8 8 DT H72 H 1 1.909 . . 1 . . . . . . . . 4248 2
71 . 2 2 8 8 DT H73 H 1 1.909 . . 1 . . . . . . . . 4248 2
72 . 2 2 9 9 DG H1' H 1 5.533 . . 1 . . . . . . . . 4248 2
73 . 2 2 9 9 DG H2'' H 1 2.857 . . 1 . . . . . . . . 4248 2
74 . 2 2 9 9 DG H2' H 1 2.772 . . 1 . . . . . . . . 4248 2
75 . 2 2 9 9 DG H3' H 1 5.366 . . 1 . . . . . . . . 4248 2
76 . 2 2 9 9 DG H4' H 1 3.829 . . 1 . . . . . . . . 4248 2
77 . 2 2 9 9 DG H5' H 1 4.493 . . 2 . . . . . . . . 4248 2
78 . 2 2 9 9 DG H5'' H 1 3.620 . . 2 . . . . . . . . 4248 2
79 . 2 2 9 9 DG H8 H 1 8.015 . . 1 . . . . . . . . 4248 2
80 . 2 2 10 10 DA H1' H 1 6.298 . . 1 . . . . . . . . 4248 2
81 . 2 2 10 10 DA H2'' H 1 3.125 . . 1 . . . . . . . . 4248 2
82 . 2 2 10 10 DA H2' H 1 2.958 . . 1 . . . . . . . . 4248 2
83 . 2 2 10 10 DA H3' H 1 5.198 . . 1 . . . . . . . . 4248 2
84 . 2 2 10 10 DA H4' H 1 4.476 . . 1 . . . . . . . . 4248 2
85 . 2 2 10 10 DA H5' H 1 4.014 . . 2 . . . . . . . . 4248 2
86 . 2 2 10 10 DA H2 H 1 7.513 . . 1 . . . . . . . . 4248 2
87 . 2 2 10 10 DA H8 H 1 8.233 . . 1 . . . . . . . . 4248 2
88 . 2 2 11 11 DA H1' H 1 5.781 . . 1 . . . . . . . . 4248 2
89 . 2 2 11 11 DA H2' H 1 2.784 . . 1 . . . . . . . . 4248 2
90 . 2 2 11 11 DA H2'' H 1 2.471 . . 1 . . . . . . . . 4248 2
91 . 2 2 11 11 DA H3' H 1 5.108 . . 1 . . . . . . . . 4248 2
92 . 2 2 11 11 DA H4' H 1 4.461 . . 1 . . . . . . . . 4248 2
93 . 2 2 11 11 DA H2 H 1 7.395 . . 1 . . . . . . . . 4248 2
94 . 2 2 11 11 DA H8 H 1 8.000 . . 1 . . . . . . . . 4248 2
95 . 2 2 12 12 DG H1' H 1 5.473 . . 1 . . . . . . . . 4248 2
96 . 2 2 12 12 DG H2' H 1 2.379 . . 1 . . . . . . . . 4248 2
97 . 2 2 12 12 DG H2'' H 1 1.160 . . 1 . . . . . . . . 4248 2
98 . 2 2 12 12 DG H3' H 1 4.244 . . 1 . . . . . . . . 4248 2
99 . 2 2 12 12 DG H4' H 1 3.604 . . 1 . . . . . . . . 4248 2
100 . 2 2 12 12 DG H5' H 1 2.901 . . 2 . . . . . . . . 4248 2
101 . 2 2 12 12 DG H8 H 1 7.341 . . 1 . . . . . . . . 4248 2
102 . 2 2 13 13 DC H1' H 1 5.866 . . 1 . . . . . . . . 4248 2
103 . 2 2 13 13 DC H2'' H 1 2.517 . . 1 . . . . . . . . 4248 2
104 . 2 2 13 13 DC H2' H 1 2.212 . . 1 . . . . . . . . 4248 2
105 . 2 2 13 13 DC H3' H 1 4.649 . . 1 . . . . . . . . 4248 2
106 . 2 2 13 13 DC H4' H 1 4.144 . . 1 . . . . . . . . 4248 2
107 . 2 2 13 13 DC H5' H 1 3.962 . . 2 . . . . . . . . 4248 2
108 . 2 2 13 13 DC H5'' H 1 3.533 . . 2 . . . . . . . . 4248 2
109 . 2 2 13 13 DC H5 H 1 4.870 . . 1 . . . . . . . . 4248 2
110 . 2 2 13 13 DC H6 H 1 7.324 . . 1 . . . . . . . . 4248 2
111 . 2 2 14 14 DT H1' H 1 6.237 . . 1 . . . . . . . . 4248 2
112 . 2 2 14 14 DT H2'' H 1 2.595 . . 1 . . . . . . . . 4248 2
113 . 2 2 14 14 DT H2' H 1 2.269 . . 1 . . . . . . . . 4248 2
114 . 2 2 14 14 DT H3' H 1 4.923 . . 1 . . . . . . . . 4248 2
115 . 2 2 14 14 DT H4' H 1 4.260 . . 1 . . . . . . . . 4248 2
116 . 2 2 14 14 DT H6 H 1 7.619 . . 1 . . . . . . . . 4248 2
117 . 2 2 14 14 DT H71 H 1 1.590 . . 1 . . . . . . . . 4248 2
118 . 2 2 14 14 DT H72 H 1 1.590 . . 1 . . . . . . . . 4248 2
119 . 2 2 14 14 DT H73 H 1 1.590 . . 1 . . . . . . . . 4248 2
120 . 2 2 15 15 DC H1' H 1 6.337 . . 1 . . . . . . . . 4248 2
121 . 2 2 15 15 DC H2' H 1 2.319 . . 1 . . . . . . . . 4248 2
122 . 2 2 15 15 DC H2'' H 1 2.319 . . 1 . . . . . . . . 4248 2
123 . 2 2 15 15 DC H3' H 1 4.606 . . 1 . . . . . . . . 4248 2
124 . 2 2 15 15 DC H4' H 1 4.072 . . 1 . . . . . . . . 4248 2
125 . 2 2 15 15 DC H5' H 1 4.221 . . 2 . . . . . . . . 4248 2
126 . 2 2 15 15 DC H5 H 1 5.875 . . 1 . . . . . . . . 4248 2
127 . 2 2 15 15 DC H6 H 1 7.726 . . 1 . . . . . . . . 4248 2
stop_
save_