Content for NMR-STAR saveframe, "chemical_shift_set_2"
save_chemical_shift_set_2
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chemical_shift_set_2
_Assigned_chem_shift_list.Entry_ID 5299
_Assigned_chem_shift_list.ID 2
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_cond_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference
_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
. . 5 $sample_5 . 5299 2
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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 SER HA H 1 4.470 0.03 . 1 . . . . . . . . 5299 2
2 . 2 2 1 1 SER CB C 13 64.200 0.12 . 1 . . . . . . . . 5299 2
3 . 2 2 1 1 SER HB2 H 1 3.810 0.03 . 2 . . . . . . . . 5299 2
4 . 2 2 1 1 SER HB3 H 1 3.910 0.03 . 2 . . . . . . . . 5299 2
5 . 2 2 2 2 TRP N N 15 121.050 0.15 . 1 . . . . . . . . 5299 2
6 . 2 2 2 2 TRP H H 1 8.290 0.03 . 1 . . . . . . . . 5299 2
7 . 2 2 2 2 TRP CA C 13 56.840 0.12 . 1 . . . . . . . . 5299 2
8 . 2 2 2 2 TRP HA H 1 5.530 0.03 . 1 . . . . . . . . 5299 2
9 . 2 2 2 2 TRP HB2 H 1 3.610 0.03 . 2 . . . . . . . . 5299 2
10 . 2 2 2 2 TRP HB3 H 1 3.010 0.03 . 2 . . . . . . . . 5299 2
11 . 2 2 2 2 TRP CD1 C 13 126.500 0.12 . 1 . . . . . . . . 5299 2
12 . 2 2 2 2 TRP HD1 H 1 7.430 0.03 . 1 . . . . . . . . 5299 2
13 . 2 2 2 2 TRP NE1 N 15 130.890 0.15 . 1 . . . . . . . . 5299 2
14 . 2 2 2 2 TRP HE1 H 1 10.210 0.03 . 1 . . . . . . . . 5299 2
15 . 2 2 2 2 TRP CZ2 C 13 114.560 0.12 . 1 . . . . . . . . 5299 2
16 . 2 2 2 2 TRP HZ2 H 1 7.170 0.03 . 1 . . . . . . . . 5299 2
17 . 2 2 2 2 TRP CH2 C 13 121.320 0.12 . 1 . . . . . . . . 5299 2
18 . 2 2 2 2 TRP HH2 H 1 7.530 0.03 . 1 . . . . . . . . 5299 2
19 . 2 2 2 2 TRP CZ3 C 13 118.590 0.12 . 1 . . . . . . . . 5299 2
20 . 2 2 2 2 TRP HZ3 H 1 6.710 0.03 . 1 . . . . . . . . 5299 2
21 . 2 2 2 2 TRP CE3 C 13 124.680 0.12 . 1 . . . . . . . . 5299 2
22 . 2 2 2 2 TRP HE3 H 1 6.980 0.03 . 1 . . . . . . . . 5299 2
23 . 2 2 3 3 TYR N N 15 119.130 0.15 . 1 . . . . . . . . 5299 2
24 . 2 2 3 3 TYR H H 1 9.380 0.03 . 1 . . . . . . . . 5299 2
25 . 2 2 3 3 TYR CA C 13 57.120 0.12 . 1 . . . . . . . . 5299 2
26 . 2 2 3 3 TYR HA H 1 5.570 0.03 . 1 . . . . . . . . 5299 2
27 . 2 2 3 3 TYR HB2 H 1 3.360 0.03 . 2 . . . . . . . . 5299 2
28 . 2 2 3 3 TYR HB3 H 1 2.790 0.03 . 2 . . . . . . . . 5299 2
29 . 2 2 3 3 TYR CD1 C 13 133.310 0.12 . 1 . . . . . . . . 5299 2
30 . 2 2 3 3 TYR HD1 H 1 6.730 0.03 . 1 . . . . . . . . 5299 2
31 . 2 2 3 3 TYR CE1 C 13 118.350 0.12 . 1 . . . . . . . . 5299 2
32 . 2 2 3 3 TYR HE1 H 1 6.620 0.03 . 1 . . . . . . . . 5299 2
33 . 2 2 3 3 TYR CE2 C 13 118.350 0.12 . 1 . . . . . . . . 5299 2
34 . 2 2 3 3 TYR HE2 H 1 6.620 0.03 . 1 . . . . . . . . 5299 2
35 . 2 2 3 3 TYR CD2 C 13 133.310 0.12 . 1 . . . . . . . . 5299 2
36 . 2 2 3 3 TYR HD2 H 1 6.730 0.03 . 1 . . . . . . . . 5299 2
37 . 2 2 4 4 SER N N 15 116.760 0.15 . 1 . . . . . . . . 5299 2
38 . 2 2 4 4 SER H H 1 9.930 0.03 . 1 . . . . . . . . 5299 2
39 . 2 2 4 4 SER CA C 13 56.140 0.12 . 1 . . . . . . . . 5299 2
40 . 2 2 4 4 SER HA H 1 6.090 0.03 . 1 . . . . . . . . 5299 2
41 . 2 2 4 4 SER CB C 13 66.380 0.12 . 1 . . . . . . . . 5299 2
42 . 2 2 4 4 SER HB2 H 1 4.130 0.03 . 2 . . . . . . . . 5299 2
43 . 2 2 4 4 SER HB3 H 1 3.670 0.03 . 2 . . . . . . . . 5299 2
44 . 2 2 5 5 TYR N N 15 126.920 0.15 . 1 . . . . . . . . 5299 2
45 . 2 2 5 5 TYR H H 1 7.960 0.03 . 1 . . . . . . . . 5299 2
46 . 2 2 5 5 TYR CA C 13 52.440 0.12 . 1 . . . . . . . . 5299 2
47 . 2 2 5 5 TYR HA H 1 5.110 0.03 . 1 . . . . . . . . 5299 2
48 . 2 2 5 5 TYR CD1 C 13 132.590 0.12 . 1 . . . . . . . . 5299 2
49 . 2 2 5 5 TYR HD1 H 1 6.180 0.03 . 1 . . . . . . . . 5299 2
50 . 2 2 5 5 TYR CE1 C 13 117.750 0.12 . 1 . . . . . . . . 5299 2
51 . 2 2 5 5 TYR HE1 H 1 6.480 0.03 . 1 . . . . . . . . 5299 2
52 . 2 2 5 5 TYR CE2 C 13 117.750 0.12 . 1 . . . . . . . . 5299 2
53 . 2 2 5 5 TYR HE2 H 1 6.480 0.03 . 1 . . . . . . . . 5299 2
54 . 2 2 5 5 TYR CD2 C 13 132.590 0.12 . 1 . . . . . . . . 5299 2
55 . 2 2 5 5 TYR HD2 H 1 6.180 0.03 . 1 . . . . . . . . 5299 2
56 . 2 2 6 6 PRO HD2 H 1 3.650 0.03 . 2 . . . . . . . . 5299 2
57 . 2 2 8 8 PRO HA H 1 4.390 0.03 . 1 . . . . . . . . 5299 2
58 . 2 2 8 8 PRO HB2 H 1 2.370 0.03 . 2 . . . . . . . . 5299 2
59 . 2 2 8 8 PRO HB3 H 1 1.970 0.03 . 2 . . . . . . . . 5299 2
60 . 2 2 8 8 PRO HD2 H 1 3.060 0.03 . 2 . . . . . . . . 5299 2
61 . 2 2 9 9 GLN N N 15 121.720 0.15 . 1 . . . . . . . . 5299 2
62 . 2 2 9 9 GLN H H 1 8.400 0.03 . 1 . . . . . . . . 5299 2
63 . 2 2 9 9 GLN CA C 13 62.630 0.12 . 1 . . . . . . . . 5299 2
64 . 2 2 9 9 GLN HA H 1 4.270 0.03 . 1 . . . . . . . . 5299 2
65 . 2 2 9 9 GLN HB2 H 1 1.790 0.03 . 2 . . . . . . . . 5299 2
66 . 2 2 9 9 GLN HG2 H 1 2.250 0.03 . 2 . . . . . . . . 5299 2
67 . 2 2 9 9 GLN HG3 H 1 2.000 0.03 . 2 . . . . . . . . 5299 2
68 . 2 2 10 10 ARG N N 15 124.240 0.15 . 1 . . . . . . . . 5299 2
69 . 2 2 10 10 ARG H H 1 8.450 0.03 . 1 . . . . . . . . 5299 2
70 . 2 2 10 10 ARG HD2 H 1 3.050 0.03 . 2 . . . . . . . . 5299 2
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