Content for NMR-STAR saveframe, "assigned_chemical_shifts_4"
save_assigned_chemical_shifts_4
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_4
_Assigned_chem_shift_list.Entry_ID 50384
_Assigned_chem_shift_list.ID 4
_Assigned_chem_shift_list.Name CB1_dpc_d2o
_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
8 '2D 1H-1H COSY' . . . 50384 4
9 '2D 1H-1H TOCSY' . . . 50384 4
10 '2D 1H-13C HSQC aliphatic' . . . 50384 4
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_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
2 $software_2 . . 50384 4
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_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 . 2 . 2 2 2 THR HA H 1 4.266 0.000 . 1 . . . . . 1 THR HA . 50384 4
2 . 2 . 2 2 2 THR HB H 1 4.110 0.000 . 1 . . . . . 1 THR HB . 50384 4
3 . 2 . 2 2 2 THR CA C 13 62.816 0.000 . 1 . . . . . 1 THR CA . 50384 4
4 . 2 . 2 2 2 THR CB C 13 69.831 0.000 . 1 . . . . . 1 THR CB . 50384 4
5 . 2 . 2 3 3 VAL HA H 1 4.126 0.000 . 1 . . . . . 2 VAL HA . 50384 4
6 . 2 . 2 3 3 VAL CA C 13 62.127 0.000 . 1 . . . . . 2 VAL CA . 50384 4
7 . 2 . 2 5 5 PRO HA H 1 4.368 0.000 . 1 . . . . . 4 PRO HA . 50384 4
8 . 2 . 2 5 5 PRO CA C 13 65.371 0.000 . 1 . . . . . 4 PRO CA . 50384 4
9 . 2 . 2 6 6 ILE HA H 1 3.821 0.000 . 1 . . . . . 5 ILE HA . 50384 4
10 . 2 . 2 6 6 ILE CA C 13 64.387 0.000 . 1 . . . . . 5 ILE CA . 50384 4
11 . 2 . 2 7 7 ILE HA H 1 3.668 0.000 . 1 . . . . . 6 ILE HA . 50384 4
12 . 2 . 2 7 7 ILE CA C 13 64.124 0.000 . 1 . . . . . 6 ILE CA . 50384 4
13 . 2 . 2 8 8 TYR HA H 1 4.124 0.000 . 1 . . . . . 7 TYR HA . 50384 4
14 . 2 . 2 8 8 TYR CA C 13 60.955 0.000 . 1 . . . . . 7 TYR CA . 50384 4
15 . 2 . 2 9 9 ALA HA H 1 4.073 0.000 . 1 . . . . . 8 ALA HA . 50384 4
16 . 2 . 2 9 9 ALA CA C 13 54.718 0.000 . 1 . . . . . 8 ALA CA . 50384 4
17 . 2 . 2 10 10 LEU HA H 1 4.076 0.000 . 1 . . . . . 9 LEU HA . 50384 4
18 . 2 . 2 10 10 LEU CA C 13 57.125 0.000 . 1 . . . . . 9 LEU CA . 50384 4
19 . 2 . 2 11 11 ARG HA H 1 4.174 0.000 . 1 . . . . . 10 ARG HA . 50384 4
20 . 2 . 2 11 11 ARG CA C 13 57.663 0.000 . 1 . . . . . 10 ARG CA . 50384 4
21 . 2 . 2 12 12 SER HA H 1 4.334 0.000 . 1 . . . . . 11 SER HA . 50384 4
22 . 2 . 2 12 12 SER HB2 H 1 3.794 0.000 . 2 . . . . . 11 SER HB2 . 50384 4
23 . 2 . 2 12 12 SER HB3 H 1 3.864 0.000 . 2 . . . . . 11 SER HB3 . 50384 4
24 . 2 . 2 12 12 SER CA C 13 59.309 0.000 . 1 . . . . . 11 SER CA . 50384 4
25 . 2 . 2 12 12 SER CB C 13 63.835 0.022 . 1 . . . . . 11 SER CB . 50384 4
26 . 2 . 2 13 13 LYS HA H 1 4.261 0.000 . 1 . . . . . 12 LYS HA . 50384 4
27 . 2 . 2 13 13 LYS CA C 13 56.310 0.000 . 1 . . . . . 12 LYS CA . 50384 4
28 . 2 . 2 14 14 ASP HA H 1 4.679 0.001 . 1 . . . . . 13 ASP HA . 50384 4
29 . 2 . 2 14 14 ASP CA C 13 53.814 0.000 . 1 . . . . . 13 ASP CA . 50384 4
30 . 2 . 2 15 15 LEU HA H 1 4.076 0.000 . 1 . . . . . 14 LEU HA . 50384 4
31 . 2 . 2 15 15 LEU CA C 13 57.125 0.000 . 1 . . . . . 14 LEU CA . 50384 4
32 . 2 . 2 16 16 ARG HA H 1 3.965 0.000 . 1 . . . . . 15 ARG HA . 50384 4
33 . 2 . 2 16 16 ARG CA C 13 58.811 0.000 . 1 . . . . . 15 ARG CA . 50384 4
34 . 2 . 2 17 17 HIS HA H 1 4.588 0.000 . 1 . . . . . 16 HIS HA . 50384 4
35 . 2 . 2 17 17 HIS CA C 13 56.626 0.000 . 1 . . . . . 16 HIS CA . 50384 4
36 . 2 . 2 18 18 ALA HA H 1 4.086 0.000 . 1 . . . . . 17 ALA HA . 50384 4
37 . 2 . 2 18 18 ALA CA C 13 53.964 0.000 . 1 . . . . . 17 ALA CA . 50384 4
38 . 2 . 2 19 19 PHE HA H 1 4.518 0.000 . 1 . . . . . 18 PHE HA . 50384 4
39 . 2 . 2 19 19 PHE CA C 13 58.139 0.000 . 1 . . . . . 18 PHE CA . 50384 4
40 . 2 . 2 20 20 ARG HA H 1 4.244 0.000 . 1 . . . . . 19 ARG HA . 50384 4
41 . 2 . 2 20 20 ARG CA C 13 56.049 0.000 . 1 . . . . . 19 ARG CA . 50384 4
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save_