Content for NMR-STAR saveframe, "shift_set_1"
save_shift_set_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode shift_set_1
_Assigned_chem_shift_list.Entry_ID 4682
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $Ex-con_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 $sample_1 . 4682 1
. . 2 $sample_2 . 4682 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 . 2 2 1 1 RTL C16 C 13 29.1 0.15 . . . . . . . . . . 4682 1
2 . 2 2 1 1 RTL C17 C 13 30.3 0.15 . . . . . . . . . . 4682 1
3 . 2 2 1 1 RTL C18 C 13 22.6 0.15 . . . . . . . . . . 4682 1
4 . 2 2 1 1 RTL C19 C 13 14.4 0.15 . . . . . . . . . . 4682 1
5 . 2 2 1 1 RTL C4 C 13 35.6 0.15 . . . . . . . . . . 4682 1
6 . 2 2 1 1 RTL C8 C 13 135.7 0.15 . . . . . . . . . . 4682 1
7 . 2 2 1 1 RTL H10 H 1 6.09 0.025 . . . . . . . . . . 4682 1
8 . 2 2 1 1 RTL H11 H 1 6.33 0.025 . . . . . . . . . . 4682 1
9 . 2 2 1 1 RTL H12 H 1 6.56 0.025 . . . . . . . . . . 4682 1
10 . 2 2 1 1 RTL H14 H 1 5.73 0.025 . . . . . . . . . . 4682 1
11 . 2 2 1 1 RTL H151 H 1 3.56 0.025 . . . . . . . . . . 4682 1
12 . 2 2 1 1 RTL H152 H 1 2.95 0.025 . . . . . . . . . . 4682 1
13 . 2 2 1 1 RTL H16 H 1 1.09 0.025 . . . . . . . . . . 4682 1
14 . 2 2 1 1 RTL H17 H 1 1.08 0.025 . . . . . . . . . . 4682 1
15 . 2 2 1 1 RTL H18 H 1 1.58 0.025 . . . . . . . . . . 4682 1
16 . 2 2 1 1 RTL H19 H 1 1.99 0.025 . . . . . . . . . . 4682 1
17 . 2 2 1 1 RTL H20 H 1 0.40 0.025 . . . . . . . . . . 4682 1
18 . 2 2 1 1 RTL H21 H 1 1.65 0.025 . . . . . . . . . . 4682 1
19 . 2 2 1 1 RTL H22 H 1 1.65 0.025 . . . . . . . . . . 4682 1
20 . 2 2 1 1 RTL H31 H 1 1.85 0.025 . . . . . . . . . . 4682 1
21 . 2 2 1 1 RTL H32 H 1 1.85 0.025 . . . . . . . . . . 4682 1
22 . 2 2 1 1 RTL H41 H 1 2.10 0.025 . . . . . . . . . . 4682 1
23 . 2 2 1 1 RTL H42 H 1 2.10 0.025 . . . . . . . . . . 4682 1
24 . 2 2 1 1 RTL H7 H 1 6.67 0.025 . . . . . . . . . . 4682 1
25 . 2 2 1 1 RTL H8 H 1 6.32 0.025 . . . . . . . . . . 4682 1
stop_
save_