Content for NMR-STAR saveframe, "assigned_chemical_shifts_2"
save_assigned_chemical_shifts_2
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_2
_Assigned_chem_shift_list.Entry_ID 51137
_Assigned_chem_shift_list.ID 2
_Assigned_chem_shift_list.Name assigned_chemical_shifts_283K
_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 2
_Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_2
_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' . . . 51137 2
2 '2D 1H-1H TOCSY' . . . 51137 2
3 '2D 1H-1H NOESY' . . . 51137 2
4 '2D 1H-13C HSQC' . . . 51137 2
5 '2D 1H-1H TOCSY' . . . 51137 2
6 '2D 1H-1H NOESY' . . . 51137 2
7 '2D 1H-1H NOESY' . . . 51137 2
9 '2D 1H-1H NOESY' . . . 51137 2
10 '2D 1H-15N HMQC' . . . 51137 2
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
1 $software_1 . . 51137 2
2 $software_2 . . 51137 2
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 5.797 0.023 . . . . . . . 252 G H1' . 51137 2
2 . 1 . 1 1 1 G H2' H 1 4.634 0.101 . . . . . . . 252 G H2' . 51137 2
3 . 1 . 1 1 1 G H3' H 1 4.681 0.012 . . . . . . . 252 G H3' . 51137 2
4 . 1 . 1 1 1 G H8 H 1 8.007 0.005 . . . . . . . 252 G H8 . 51137 2
5 . 1 . 1 1 1 G C1' C 13 92.255 0.000 . . . . . . . 252 G C1' . 51137 2
6 . 1 . 1 1 1 G C2' C 13 85.747 0.000 . . . . . . . 252 G C2' . 51137 2
7 . 1 . 1 1 1 G C3' C 13 75.336 0.000 . . . . . . . 252 G C3' . 51137 2
8 . 1 . 1 1 1 G C8 C 13 139.652 0.000 . . . . . . . 252 G C8 . 51137 2
9 . 1 . 1 2 2 A H1' H 1 6.008 0.004 . . . . . . . 253 A H1' . 51137 2
10 . 1 . 1 2 2 A H2 H 1 7.600 0.010 . . . . . . . 253 A H2 . 51137 2
11 . 1 . 1 2 2 A H2' H 1 4.758 0.004 . . . . . . . 253 A H2' . 51137 2
12 . 1 . 1 2 2 A H8 H 1 8.163 0.025 . . . . . . . 253 A H8 . 51137 2
13 . 1 . 1 2 2 A C1' C 13 92.699 0.000 . . . . . . . 253 A C1' . 51137 2
14 . 1 . 1 2 2 A C2 C 13 153.872 0.000 . . . . . . . 253 A C2 . 51137 2
15 . 1 . 1 2 2 A C2' C 13 75.341 0.000 . . . . . . . 253 A C2' . 51137 2
16 . 1 . 1 2 2 A C8 C 13 140.269 0.000 . . . . . . . 253 A C8 . 51137 2
17 . 1 . 1 3 3 C H1' H 1 5.464 0.007 . . . . . . . 254 C H1' . 51137 2
18 . 1 . 1 3 3 C H2' H 1 4.181 0.005 . . . . . . . 254 C H2' . 51137 2
19 . 1 . 1 3 3 C H5 H 1 5.280 0.004 . . . . . . . 254 C H5 . 51137 2
20 . 1 . 1 3 3 C H6 H 1 7.582 0.006 . . . . . . . 254 C H6 . 51137 2
21 . 1 . 1 3 3 C H41 H 1 8.407 0.005 . . . . . . . 254 C H41 . 51137 2
22 . 1 . 1 3 3 C H42 H 1 6.980 0.002 . . . . . . . 254 C H42 . 51137 2
23 . 1 . 1 3 3 C C1' C 13 93.790 0.000 . . . . . . . 254 C C1' . 51137 2
24 . 1 . 1 3 3 C C2' C 13 75.741 0.000 . . . . . . . 254 C C2' . 51137 2
25 . 1 . 1 3 3 C C5 C 13 97.107 0.000 . . . . . . . 254 C C5 . 51137 2
26 . 1 . 1 3 3 C C6 C 13 140.999 0.000 . . . . . . . 254 C C6 . 51137 2
27 . 1 . 1 4 4 C H1' H 1 5.557 0.002 . . . . . . . 255 C H1' . 51137 2
28 . 1 . 1 4 4 C H2' H 1 4.482 0.012 . . . . . . . 255 C H2' . 51137 2
29 . 1 . 1 4 4 C H5 H 1 5.374 0.006 . . . . . . . 255 C H5 . 51137 2
30 . 1 . 1 4 4 C H6 H 1 7.576 0.007 . . . . . . . 255 C H6 . 51137 2
31 . 1 . 1 4 4 C H41 H 1 8.306 0.005 . . . . . . . 255 C H41 . 51137 2
32 . 1 . 1 4 4 C H42 H 1 6.625 0.002 . . . . . . . 255 C H42 . 51137 2
33 . 1 . 1 4 4 C C1' C 13 93.620 0.000 . . . . . . . 255 C C1' . 51137 2
34 . 1 . 1 4 4 C C2' C 13 75.829 0.000 . . . . . . . 255 C C2' . 51137 2
35 . 1 . 1 4 4 C C5 C 13 98.348 0.000 . . . . . . . 255 C C5 . 51137 2
36 . 1 . 1 4 4 C C6 C 13 140.051 0.000 . . . . . . . 255 C C6 . 51137 2
37 . 1 . 1 5 5 G H1 H 1 10.563 0.003 . . . . . . . 256 G H1 . 51137 2
38 . 1 . 1 5 5 G H1' H 1 5.694 0.003 . . . . . . . 256 G H1' . 51137 2
39 . 1 . 1 5 5 G H2' H 1 4.409 0.012 . . . . . . . 256 G H2' . 51137 2
40 . 1 . 1 5 5 G H8 H 1 7.469 0.017 . . . . . . . 256 G H8 . 51137 2
41 . 1 . 1 5 5 G C1' C 13 93.574 0.000 . . . . . . . 256 G C1' . 51137 2
42 . 1 . 1 5 5 G C2' C 13 76.010 0.000 . . . . . . . 256 G C2' . 51137 2
43 . 1 . 1 5 5 G C8 C 13 135.842 0.000 . . . . . . . 256 G C8 . 51137 2
44 . 1 . 1 5 5 G N1 N 15 146.221 0.000 . . . . . . . 256 G N1 . 51137 2
45 . 1 . 1 6 6 A H1' H 1 5.681 0.009 . . . . . . . 257 A H1' . 51137 2
46 . 1 . 1 6 6 A H2 H 1 7.732 0.000 . . . . . . . 257 A H2 . 51137 2
47 . 1 . 1 6 6 A H2' H 1 4.792 0.110 . . . . . . . 257 A H2' . 51137 2
48 . 1 . 1 6 6 A H8 H 1 8.407 0.005 . . . . . . . 257 A H8 . 51137 2
49 . 1 . 1 6 6 A C1' C 13 92.705 0.000 . . . . . . . 257 A C1' . 51137 2
50 . 1 . 1 6 6 A C2 C 13 154.187 0.000 . . . . . . . 257 A C2 . 51137 2
51 . 1 . 1 6 6 A C2' C 13 76.740 1.355 . . . . . . . 257 A C2' . 51137 2
52 . 1 . 1 6 6 A C8 C 13 142.332 0.000 . . . . . . . 257 A C8 . 51137 2
53 . 1 . 1 7 7 A H1' H 1 5.384 0.006 . . . . . . . 258 A H1' . 51137 2
54 . 1 . 1 7 7 A H2 H 1 7.746 0.016 . . . . . . . 258 A H2 . 51137 2
55 . 1 . 1 7 7 A H2' H 1 4.300 0.003 . . . . . . . 258 A H2' . 51137 2
56 . 1 . 1 7 7 A H8 H 1 7.935 0.004 . . . . . . . 258 A H8 . 51137 2
57 . 1 . 1 7 7 A C1' C 13 92.774 0.000 . . . . . . . 258 A C1' . 51137 2
58 . 1 . 1 7 7 A C2 C 13 154.187 0.000 . . . . . . . 258 A C2 . 51137 2
59 . 1 . 1 7 7 A C2' C 13 76.145 0.000 . . . . . . . 258 A C2' . 51137 2
60 . 1 . 1 7 7 A C8 C 13 140.241 0.000 . . . . . . . 258 A C8 . 51137 2
61 . 1 . 1 8 8 A H1' H 1 6.000 0.006 . . . . . . . 259 A H1' . 51137 2
62 . 1 . 1 8 8 A H2 H 1 8.110 0.003 . . . . . . . 259 A H2 . 51137 2
63 . 1 . 1 8 8 A H2' H 1 4.564 0.009 . . . . . . . 259 A H2' . 51137 2
64 . 1 . 1 8 8 A H8 H 1 8.199 0.004 . . . . . . . 259 A H8 . 51137 2
65 . 1 . 1 8 8 A C1' C 13 92.037 0.000 . . . . . . . 259 A C1' . 51137 2
66 . 1 . 1 8 8 A C2 C 13 155.495 0.000 . . . . . . . 259 A C2 . 51137 2
67 . 1 . 1 8 8 A C2' C 13 76.616 0.000 . . . . . . . 259 A C2' . 51137 2
68 . 1 . 1 8 8 A C8 C 13 140.534 0.000 . . . . . . . 259 A C8 . 51137 2
69 . 1 . 1 9 9 G H1 H 1 12.487 0.021 . . . . . . . 260 G H1 . 51137 2
70 . 1 . 1 9 9 G H1' H 1 3.507 0.023 . . . . . . . 260 G H1' . 51137 2
71 . 1 . 1 9 9 G H2' H 1 4.418 0.002 . . . . . . . 260 G H2' . 51137 2
72 . 1 . 1 9 9 G H3' H 1 4.126 0.004 . . . . . . . 260 G H3' . 51137 2
73 . 1 . 1 9 9 G H5' H 1 4.333 0.002 . . . . . . . 260 G H5' . 51137 2
74 . 1 . 1 9 9 G H5'' H 1 4.192 0.005 . . . . . . . 260 G H5'' . 51137 2
75 . 1 . 1 9 9 G H8 H 1 7.849 0.006 . . . . . . . 260 G H8 . 51137 2
76 . 1 . 1 9 9 G C1' C 13 92.806 0.000 . . . . . . . 260 G C1' . 51137 2
77 . 1 . 1 9 9 G C2' C 13 75.172 0.000 . . . . . . . 260 G C2' . 51137 2
78 . 1 . 1 9 9 G C3' C 13 74.282 0.000 . . . . . . . 260 G C3' . 51137 2
79 . 1 . 1 9 9 G C5' C 13 69.707 0.006 . . . . . . . 260 G C5' . 51137 2
80 . 1 . 1 9 9 G C8 C 13 137.102 0.000 . . . . . . . 260 G C8 . 51137 2
81 . 1 . 1 9 9 G N1 N 15 147.280 0.000 . . . . . . . 260 G N1 . 51137 2
82 . 1 . 1 10 10 G H1 H 1 13.252 0.003 . . . . . . . 261 G H1 . 51137 2
83 . 1 . 1 10 10 G H1' H 1 5.780 0.002 . . . . . . . 261 G H1' . 51137 2
84 . 1 . 1 10 10 G H2' H 1 4.420 0.004 . . . . . . . 261 G H2' . 51137 2
85 . 1 . 1 10 10 G H8 H 1 7.126 0.006 . . . . . . . 261 G H8 . 51137 2
86 . 1 . 1 10 10 G C1' C 13 93.087 0.000 . . . . . . . 261 G C1' . 51137 2
87 . 1 . 1 10 10 G C2' C 13 74.605 0.000 . . . . . . . 261 G C2' . 51137 2
88 . 1 . 1 10 10 G C8 C 13 136.110 0.000 . . . . . . . 261 G C8 . 51137 2
89 . 1 . 1 10 10 G N1 N 15 148.332 0.000 . . . . . . . 261 G N1 . 51137 2
90 . 1 . 1 11 11 U H1' H 1 5.576 0.008 . . . . . . . 262 U H1' . 51137 2
91 . 1 . 1 11 11 U H2' H 1 4.297 0.013 . . . . . . . 262 U H2' . 51137 2
92 . 1 . 1 11 11 U H3 H 1 13.597 0.008 . . . . . . . 262 U H3 . 51137 2
93 . 1 . 1 11 11 U H5 H 1 5.023 0.012 . . . . . . . 262 U H5 . 51137 2
94 . 1 . 1 11 11 U H6 H 1 7.552 0.007 . . . . . . . 262 U H6 . 51137 2
95 . 1 . 1 11 11 U C1' C 13 93.598 0.000 . . . . . . . 262 U C1' . 51137 2
96 . 1 . 1 11 11 U C2' C 13 75.648 0.000 . . . . . . . 262 U C2' . 51137 2
97 . 1 . 1 11 11 U C6 C 13 141.095 0.000 . . . . . . . 262 U C6 . 51137 2
98 . 1 . 1 11 11 U N3 N 15 161.502 0.000 . . . . . . . 262 U N3 . 51137 2
99 . 1 . 1 12 12 A H1' H 1 6.021 0.003 . . . . . . . 263 A H1' . 51137 2
100 . 1 . 1 12 12 A H2 H 1 7.717 0.002 . . . . . . . 263 A H2 . 51137 2
101 . 1 . 1 12 12 A H2' H 1 4.217 0.005 . . . . . . . 263 A H2' . 51137 2
102 . 1 . 1 12 12 A H8 H 1 8.228 0.006 . . . . . . . 263 A H8 . 51137 2
103 . 1 . 1 12 12 A C1' C 13 90.587 0.000 . . . . . . . 263 A C1' . 51137 2
104 . 1 . 1 12 12 A C2 C 13 154.854 0.000 . . . . . . . 263 A C2 . 51137 2
105 . 1 . 1 12 12 A C8 C 13 140.792 0.000 . . . . . . . 263 A C8 . 51137 2
stop_
save_