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 1592
_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 . 1592 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 1 1 MET HG2 H 1 2.62 . . 1 . . . . . . . . 1592 1
2 . 1 1 1 1 MET HG3 H 1 2.62 . . 1 . . . . . . . . 1592 1
3 . 1 1 1 1 MET HE1 H 1 2.12 . . 1 . . . . . . . . 1592 1
4 . 1 1 1 1 MET HE2 H 1 2.12 . . 1 . . . . . . . . 1592 1
5 . 1 1 1 1 MET HE3 H 1 2.12 . . 1 . . . . . . . . 1592 1
6 . 1 1 19 19 SER HB2 H 1 4.01 . . 1 . . . . . . . . 1592 1
7 . 1 1 19 19 SER HB3 H 1 4.01 . . 1 . . . . . . . . 1592 1
8 . 1 1 24 24 GLN HG2 H 1 2.31 . . 1 . . . . . . . . 1592 1
9 . 1 1 24 24 GLN HG3 H 1 2.31 . . 1 . . . . . . . . 1592 1
10 . 1 1 30 30 HIS HD2 H 1 7.27 . . 1 . . . . . . . . 1592 1
11 . 1 1 32 32 TYR HE1 H 1 6.8 . . 3 . . . . . . . . 1592 1
12 . 1 1 32 32 TYR HE2 H 1 6.83 . . 3 . . . . . . . . 1592 1
13 . 1 1 34 34 TYR HE1 H 1 6.8 . . 3 . . . . . . . . 1592 1
14 . 1 1 34 34 TYR HE2 H 1 6.83 . . 3 . . . . . . . . 1592 1
15 . 1 1 36 36 HIS HD2 H 1 7.27 . . 1 . . . . . . . . 1592 1
16 . 1 1 38 38 SER HB2 H 1 4.01 . . 1 . . . . . . . . 1592 1
17 . 1 1 38 38 SER HB3 H 1 4.01 . . 1 . . . . . . . . 1592 1
18 . 1 1 41 41 ASP HB2 H 1 2.62 . . 1 . . . . . . . . 1592 1
19 . 1 1 41 41 ASP HB3 H 1 2.62 . . 1 . . . . . . . . 1592 1
20 . 1 1 44 44 ARG HA H 1 3.71 . . 1 . . . . . . . . 1592 1
21 . 1 1 44 44 ARG HB2 H 1 1.8 . . 1 . . . . . . . . 1592 1
22 . 1 1 44 44 ARG HB3 H 1 1.8 . . 1 . . . . . . . . 1592 1
23 . 1 1 44 44 ARG HG2 H 1 1.71 . . 1 . . . . . . . . 1592 1
24 . 1 1 44 44 ARG HG3 H 1 1.71 . . 1 . . . . . . . . 1592 1
25 . 1 1 45 45 ALA HB1 H 1 1.42 . . 1 . . . . . . . . 1592 1
26 . 1 1 45 45 ALA HB2 H 1 1.42 . . 1 . . . . . . . . 1592 1
27 . 1 1 45 45 ALA HB3 H 1 1.42 . . 1 . . . . . . . . 1592 1
stop_
save_