Content for NMR-STAR saveframe, "assigned_chem_shift_list_2"
save_assigned_chem_shift_list_2
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_2
_Assigned_chem_shift_list.Entry_ID 18754
_Assigned_chem_shift_list.ID 2
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $45C
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_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 1H-13C HSQC' . . . 18754 2
2 '3D HCCH-TOCSY' . . . 18754 2
3 '3D 1H-13C NOESY aliphatic' . . . 18754 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.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 14 14 PRO HA H 1 4.597 0.013 . 1 . . . . 14 PRO HA . 18754 2
2 . 1 1 14 14 PRO HB2 H 1 2.328 0.012 . . . . . . 14 PRO HB2 . 18754 2
3 . 1 1 14 14 PRO HB3 H 1 2.180 0.010 . . . . . . 14 PRO HB3 . 18754 2
4 . 1 1 14 14 PRO HG2 H 1 1.897 0.044 . . . . . . 14 PRO HG2 . 18754 2
5 . 1 1 14 14 PRO HG3 H 1 1.878 0.045 . . . . . . 14 PRO HG3 . 18754 2
6 . 1 1 14 14 PRO HD2 H 1 3.529 0.049 . . . . . . 14 PRO HD2 . 18754 2
7 . 1 1 14 14 PRO HD3 H 1 3.361 0.435 . . . . . . 14 PRO HD3 . 18754 2
8 . 1 1 14 14 PRO CA C 13 62.91 0.050 . 1 . . . . 14 PRO CA . 18754 2
9 . 1 1 14 14 PRO CB C 13 34.34 0.080 . 1 . . . . 14 PRO CB . 18754 2
10 . 1 1 14 14 PRO CG C 13 24.73 0.030 . 1 . . . . 14 PRO CG . 18754 2
11 . 1 1 14 14 PRO CD C 13 50.23 0.100 . 1 . . . . 14 PRO CD . 18754 2
12 . 1 1 14 14 PRO N N 15 134.70 0.00 . 1 . . . . 14 PRO N . 18754 2
stop_
save_