Content for NMR-STAR saveframe, "chemical_shift_assignment_data_set_one"
save_chemical_shift_assignment_data_set_one
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode 'chemical_shift_assignment_data_set_one'
_Assigned_chem_shift_list.Entry_ID 363
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_condition_set_one
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_par_set_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 . 363 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.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 29 29 LEU HG H 1 .68 . . 1 . . . . . . . . 363 1
2 . 1 1 29 29 LEU HD11 H 1 -.83 . . 1 . . . . . . . . 363 1
3 . 1 1 29 29 LEU HD12 H 1 -.83 . . 1 . . . . . . . . 363 1
4 . 1 1 29 29 LEU HD13 H 1 -.83 . . 1 . . . . . . . . 363 1
5 . 1 1 29 29 LEU HD21 H 1 .35 . . 1 . . . . . . . . 363 1
6 . 1 1 29 29 LEU HD22 H 1 .35 . . 1 . . . . . . . . 363 1
7 . 1 1 29 29 LEU HD23 H 1 .35 . . 1 . . . . . . . . 363 1
8 . 1 1 33 33 PHE HD1 H 1 7.13 . . 1 . . . . . . . . 363 1
9 . 1 1 33 33 PHE HD2 H 1 7.13 . . 1 . . . . . . . . 363 1
10 . 1 1 33 33 PHE HE1 H 1 6.62 . . 1 . . . . . . . . 363 1
11 . 1 1 33 33 PHE HE2 H 1 6.62 . . 1 . . . . . . . . 363 1
12 . 1 1 33 33 PHE HZ H 1 5.71 . . 1 . . . . . . . . 363 1
13 . 1 1 43 43 PHE HD1 H 1 7.31 . . 1 . . . . . . . . 363 1
14 . 1 1 43 43 PHE HD2 H 1 7.31 . . 1 . . . . . . . . 363 1
15 . 1 1 43 43 PHE HE1 H 1 6.18 . . 1 . . . . . . . . 363 1
16 . 1 1 43 43 PHE HE2 H 1 6.18 . . 1 . . . . . . . . 363 1
17 . 1 1 43 43 PHE HZ H 1 4.75 . . 1 . . . . . . . . 363 1
18 . 1 1 46 46 PHE HD1 H 1 5.91 . . 1 . . . . . . . . 363 1
19 . 1 1 46 46 PHE HD2 H 1 5.91 . . 1 . . . . . . . . 363 1
20 . 1 1 46 46 PHE HE1 H 1 5.49 . . 1 . . . . . . . . 363 1
21 . 1 1 46 46 PHE HE2 H 1 5.49 . . 1 . . . . . . . . 363 1
22 . 1 1 46 46 PHE HZ H 1 4.59 . . 1 . . . . . . . . 363 1
23 . 1 1 68 68 VAL HA H 1 3.27 . . 1 . . . . . . . . 363 1
24 . 1 1 68 68 VAL HB H 1 1.1 . . 1 . . . . . . . . 363 1
25 . 1 1 68 68 VAL HG11 H 1 -.02 . . 1 . . . . . . . . 363 1
26 . 1 1 68 68 VAL HG12 H 1 -.02 . . 1 . . . . . . . . 363 1
27 . 1 1 68 68 VAL HG13 H 1 -.02 . . 1 . . . . . . . . 363 1
28 . 1 1 68 68 VAL HG21 H 1 -1.98 . . 1 . . . . . . . . 363 1
29 . 1 1 68 68 VAL HG22 H 1 -1.98 . . 1 . . . . . . . . 363 1
30 . 1 1 68 68 VAL HG23 H 1 -1.98 . . 1 . . . . . . . . 363 1
31 . 1 1 97 97 HIS HE1 H 1 7.83 . . 1 . . . . . . . . 363 1
stop_
save_