Content for NMR-STAR saveframe, "assigned_chemical_shifts_six"
save_assigned_chemical_shifts_six
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_six
_Assigned_chem_shift_list.Entry_ID 4011
_Assigned_chem_shift_list.ID 6
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_one
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_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
;
This save frame contains the set of peak assignments for residues
P570, A571 and G572 arising from the cis conformer of P570.
;
_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 . 4011 6
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 62 62 PRO HA H 1 4.55 . . 1 . . . . . . . . 4011 6
2 . 1 1 62 62 PRO HB2 H 1 2.38 . . 1 . . . . . . . . 4011 6
3 . 1 1 62 62 PRO HB3 H 1 2.38 . . 1 . . . . . . . . 4011 6
4 . 1 1 62 62 PRO HD3 H 1 3.78 . . 1 . . . . . . . . 4011 6
5 . 1 1 62 62 PRO HD2 H 1 3.78 . . 1 . . . . . . . . 4011 6
6 . 1 1 63 63 ALA H H 1 7.62 . . 1 . . . . . . . . 4011 6
7 . 1 1 63 63 ALA HA H 1 3.83 . . 1 . . . . . . . . 4011 6
8 . 1 1 63 63 ALA HB1 H 1 1.22 . . 1 . . . . . . . . 4011 6
9 . 1 1 63 63 ALA HB2 H 1 1.22 . . 1 . . . . . . . . 4011 6
10 . 1 1 63 63 ALA HB3 H 1 1.22 . . 1 . . . . . . . . 4011 6
11 . 1 1 63 63 ALA N N 15 124.8 . . 1 . . . . . . . . 4011 6
12 . 1 1 64 64 GLY H H 1 7.3 . . 1 . . . . . . . . 4011 6
13 . 1 1 64 64 GLY HA2 H 1 4.01 . . 2 . . . . . . . . 4011 6
14 . 1 1 64 64 GLY HA3 H 1 3.6 . . 2 . . . . . . . . 4011 6
15 . 1 1 64 64 GLY N N 15 110.3 . . 1 . . . . . . . . 4011 6
stop_
save_