Content for NMR-STAR saveframe, "assigned_chemical_shifts_2"
save_assigned_chemical_shifts_2
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_2
_Assigned_chem_shift_list.Entry_ID 31068
_Assigned_chem_shift_list.ID 2
_Assigned_chem_shift_list.Name .
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1
_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 CC DARR' . . . 31068 2
2 '2D NCO' . . . 31068 2
3 '2D NCA' . . . 31068 2
4 '2D CC DARR' . . . 31068 2
5 '2D CC FPRFDR' . . . 31068 2
6 '2D CACO CTUC-COSY' . . . 31068 2
7 '4D HN[HH]NH RFDR' . . . 31068 2
8 '3D N[HH]NH RFDR' . . . 31068 2
9 '3D CA[HH]NH RFDR' . . . 31068 2
10 '3D CAN[H]H RFDR' . . . 31068 2
11 '3D CO[CA]NH RFDR' . . . 31068 2
12 '3D CA[CO]NH RFDR' . . . 31068 2
13 '3D CONH' . . . 31068 2
14 '3D CANH' . . . 31068 2
15 '1D C FSREDOR' . . . 31068 2
16 '3D NCACX PAR' . . . 31068 2
17 '3D CCC RFDR THEN PAR' . . . 31068 2
18 '2D CC PAR' . . . 31068 2
19 '3D CANCO' . . . 31068 2
20 '3D NCOCA SPC5' . . . 31068 2
21 '3D NCOCX DARR' . . . 31068 2
22 '3D NCACX DARR' . . . 31068 2
23 '2D NCO' . . . 31068 2
24 '2D NCA' . . . 31068 2
25 '2D CC DARR' . . . 31068 2
26 '3D CANCO' . . . 31068 2
27 '3D NCOCX DARR' . . . 31068 2
28 '3D NCACX DARR' . . . 31068 2
29 '2D CC SPC7' . . . 31068 2
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_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 76 76 ALA C C 13 174.682 0.065 . 1 . . . . A 76 ALA C . 31068 2
2 . 1 . 1 76 76 ALA CA C 13 49.627 0.060 . 1 . . . . A 76 ALA CA . 31068 2
3 . 1 . 1 76 76 ALA CB C 13 20.316 0.063 . 1 . . . . A 76 ALA CB . 31068 2
4 . 1 . 1 76 76 ALA N N 15 131.095 0.247 . 1 . . . . A 76 ALA N . 31068 2
5 . 1 . 1 77 77 VAL CB C 13 36.376 0.000 . 1 . . . . A 77 VAL CB . 31068 2
6 . 1 . 1 77 77 VAL CG1 C 13 24.498 0.012 . 1 . . . . A 77 VAL CG1 . 31068 2
7 . 1 . 1 78 78 ALA CA C 13 50.123 0.072 . 1 . . . . A 78 ALA CA . 31068 2
8 . 1 . 1 78 78 ALA N N 15 128.806 0.000 . 1 . . . . A 78 ALA N . 31068 2
9 . 1 . 1 87 87 SER C C 13 174.484 0.100 . 1 . . . . A 87 SER C . 31068 2
10 . 1 . 1 87 87 SER CA C 13 55.385 0.088 . 1 . . . . A 87 SER CA . 31068 2
11 . 1 . 1 87 87 SER CB C 13 66.738 0.138 . 1 . . . . A 87 SER CB . 31068 2
12 . 1 . 1 94 94 PHE CG C 13 129.251 0.098 . 1 . . . . A 94 PHE CG . 31068 2
stop_
save_