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 34698
_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
13 '2D 1H-13C HSQC aromatic' . . . 34698 2
14 '2D 1H-13C HSQC aliphatic' . . . 34698 2
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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 . 3 . 2 1 1 PHE CA C 13 58.967 0 . 1 . . . . C 201 PHE CA . 34698 2
2 . 3 . 2 1 1 PHE CB C 13 39.219 0.008 . 1 . . . . C 201 PHE CB . 34698 2
3 . 3 . 2 1 1 PHE CD1 C 13 133.066 0 . 1 . . . . C 201 PHE CD1 . 34698 2
4 . 3 . 2 1 1 PHE CD2 C 13 133.066 0 . 1 . . . . C 201 PHE CD2 . 34698 2
5 . 3 . 2 1 1 PHE CE1 C 13 131.439 0 . 1 . . . . C 201 PHE CE1 . 34698 2
6 . 3 . 2 1 1 PHE CE2 C 13 131.439 0 . 1 . . . . C 201 PHE CE2 . 34698 2
7 . 3 . 2 1 1 PHE CZ C 13 129.053 0 . 1 . . . . C 201 PHE CZ . 34698 2
8 . 3 . 2 1 1 PHE HA H 1 3.99 0 . 1 . . . . C 201 PHE HA . 34698 2
9 . 3 . 2 1 1 PHE HB2 H 1 3.124 0 . 2 . . . . C 201 PHE HB2 . 34698 2
10 . 3 . 2 1 1 PHE HB3 H 1 3.271 0 . 2 . . . . C 201 PHE HB3 . 34698 2
11 . 3 . 2 1 1 PHE HD1 H 1 7.224 0 . 1 . . . . C 201 PHE HD1 . 34698 2
12 . 3 . 2 1 1 PHE HD2 H 1 7.224 0 . 1 . . . . C 201 PHE HD2 . 34698 2
13 . 3 . 2 1 1 PHE HE1 H 1 7.013 0 . 1 . . . . C 201 PHE HE1 . 34698 2
14 . 3 . 2 1 1 PHE HE2 H 1 7.013 0 . 1 . . . . C 201 PHE HE2 . 34698 2
15 . 3 . 2 1 1 PHE HZ H 1 6.94 0 . 1 . . . . C 201 PHE HZ . 34698 2
stop_
save_