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 6041
_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
1 '2D NOESY' . . . 6041 2
2 '2D TOCSY' . . . 6041 2
3 DQF-COSY . . . 6041 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.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 ARG HA H 1 4.073 0.005 . . . . . . . . . . . 6041 2
2 . 1 1 1 1 ARG HB2 H 1 2.084 0.007 . . . . . . . . . . . 6041 2
3 . 1 1 1 1 ARG HB3 H 1 1.957 0.004 . . . . . . . . . . . 6041 2
4 . 1 1 1 1 ARG HD2 H 1 3.261 0.008 . . . . . . . . . . . 6041 2
5 . 1 1 1 1 ARG HD3 H 1 3.313 0.001 . . . . . . . . . . . 6041 2
6 . 1 1 1 1 ARG HE H 1 7.155 0.003 . . . . . . . . . . . 6041 2
7 . 1 1 1 1 ARG HG2 H 1 1.808 0.007 . . . . . . . . . . . 6041 2
8 . 1 1 1 1 ARG HG3 H 1 1.720 0.006 . . . . . . . . . . . 6041 2
9 . 1 1 1 1 ARG H H 1 8.374 0.003 . . . . . . . . . . . 6041 2
10 . 1 1 2 2 ARG HA H 1 4.265 0.005 . . . . . . . . . . . 6041 2
11 . 1 1 2 2 ARG HB2 H 1 1.508 0.008 . . . . . . . . . . . 6041 2
12 . 1 1 2 2 ARG HD2 H 1 3.058 0.005 . . . . . . . . . . . 6041 2
13 . 1 1 2 2 ARG HE H 1 6.895 0.003 . . . . . . . . . . . 6041 2
14 . 1 1 2 2 ARG HG2 H 1 1.420 0.008 . . . . . . . . . . . 6041 2
15 . 1 1 2 2 ARG H H 1 8.203 0.004 . . . . . . . . . . . 6041 2
16 . 1 1 3 3 TRP HA H 1 4.751 0.001 . . . . . . . . . . . 6041 2
17 . 1 1 3 3 TRP HB2 H 1 3.278 0.002 . . . . . . . . . . . 6041 2
18 . 1 1 3 3 TRP HB3 H 1 3.336 0.003 . . . . . . . . . . . 6041 2
19 . 1 1 3 3 TRP HD1 H 1 7.374 0.004 . . . . . . . . . . . 6041 2
20 . 1 1 3 3 TRP HE1 H 1 9.734 0.006 . . . . . . . . . . . 6041 2
21 . 1 1 3 3 TRP HE3 H 1 7.704 0.003 . . . . . . . . . . . 6041 2
22 . 1 1 3 3 TRP HH2 H 1 7.012 0.005 . . . . . . . . . . . 6041 2
23 . 1 1 3 3 TRP HZ2 H 1 7.316 0.003 . . . . . . . . . . . 6041 2
24 . 1 1 3 3 TRP HZ3 H 1 7.092 0.004 . . . . . . . . . . . 6041 2
25 . 1 1 3 3 TRP H H 1 7.085 0.003 . . . . . . . . . . . 6041 2
26 . 1 1 4 4 TRP HA H 1 4.207 0.004 . . . . . . . . . . . 6041 2
27 . 1 1 4 4 TRP HB2 H 1 2.499 0.007 . . . . . . . . . . . 6041 2
28 . 1 1 4 4 TRP HB3 H 1 3.165 0.007 . . . . . . . . . . . 6041 2
29 . 1 1 4 4 TRP HD1 H 1 7.322 0.010 . . . . . . . . . . . 6041 2
30 . 1 1 4 4 TRP HE1 H 1 10.182 0.004 . . . . . . . . . . . 6041 2
31 . 1 1 4 4 TRP HE3 H 1 7.260 0.005 . . . . . . . . . . . 6041 2
32 . 1 1 4 4 TRP HH2 H 1 7.075 0.005 . . . . . . . . . . . 6041 2
33 . 1 1 4 4 TRP HZ2 H 1 7.490 0.003 . . . . . . . . . . . 6041 2
34 . 1 1 4 4 TRP HZ3 H 1 6.963 0.004 . . . . . . . . . . . 6041 2
35 . 1 1 4 4 TRP H H 1 8.721 0.003 . . . . . . . . . . . 6041 2
36 . 1 1 5 5 ARG HA H 1 3.890 0.004 . . . . . . . . . . . 6041 2
37 . 1 1 5 5 ARG HB2 H 1 0.090 0.004 . . . . . . . . . . . 6041 2
38 . 1 1 5 5 ARG HB3 H 1 1.284 0.006 . . . . . . . . . . . 6041 2
39 . 1 1 5 5 ARG HD2 H 1 2.406 0.003 . . . . . . . . . . . 6041 2
40 . 1 1 5 5 ARG HD3 H 1 2.173 0.005 . . . . . . . . . . . 6041 2
41 . 1 1 5 5 ARG HE H 1 6.528 0.002 . . . . . . . . . . . 6041 2
42 . 1 1 5 5 ARG HG2 H 1 0.315 0.005 . . . . . . . . . . . 6041 2
43 . 1 1 5 5 ARG HG3 H 1 -0.340 0.006 . . . . . . . . . . . 6041 2
44 . 1 1 5 5 ARG H H 1 6.098 0.002 . . . . . . . . . . . 6041 2
45 . 1 1 6 6 PHE HA H 1 4.841 0.002 . . . . . . . . . . . 6041 2
46 . 1 1 6 6 PHE HB2 H 1 3.330 0.003 . . . . . . . . . . . 6041 2
47 . 1 1 6 6 PHE HB3 H 1 3.882 0.006 . . . . . . . . . . . 6041 2
48 . 1 1 6 6 PHE HD1 H 1 7.372 0.006 . . . . . . . . . . . 6041 2
49 . 1 1 6 6 PHE HE1 H 1 7.415 0.006 . . . . . . . . . . . 6041 2
50 . 1 1 6 6 PHE HZ H 1 7.272 0.008 . . . . . . . . . . . 6041 2
51 . 1 1 6 6 PHE H H 1 8.249 0.003 . . . . . . . . . . . 6041 2
stop_
save_