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 50678
_Assigned_chem_shift_list.ID 2
_Assigned_chem_shift_list.Name 'human thrombin'
_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 .
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_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 '3D HN(CO)CA' . . . 50678 2
2 '3D HNCA' . . . 50678 2
3 '3D 15N-separated NOESY' . . . 50678 2
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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
1 $software_1 . . 50678 2
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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 . 1 . 1 19 19 SER H H 1 7.62154 . . . . . . . . 19 SER H . 50678 2
2 . 1 . 1 19 19 SER CA C 13 58.745 . . . . . . . . 19 SER CA . 50678 2
3 . 1 . 1 19 19 SER N N 15 112.12369 . . . . . . . . 19 SER N . 50678 2
4 . 1 . 1 38 38 VAL H H 1 10.04474 . . . . . . . . 38 VAL H . 50678 2
5 . 1 . 1 38 38 VAL CA C 13 60.231 . . . . . . . . 38 VAL CA . 50678 2
6 . 1 . 1 38 38 VAL N N 15 118.89065 . . . . . . . . 38 VAL N . 50678 2
7 . 1 . 1 39 39 GLU H H 1 9.29856 . . . . . . . . 39 GLU H . 50678 2
8 . 1 . 1 39 39 GLU N N 15 120.95013 . . . . . . . . 39 GLU N . 50678 2
9 . 1 . 1 41 41 SER H H 1 8.347 . . . . . . . . 41 SER H . 50678 2
10 . 1 . 1 41 41 SER CA C 13 56.165 . . . . . . . . 41 SER CA . 50678 2
11 . 1 . 1 41 41 SER N N 15 112.85008 . . . . . . . . 41 SER N . 50678 2
12 . 1 . 1 46 46 GLY H H 1 9.0841 . . . . . . . . 46 GLY H . 50678 2
13 . 1 . 1 46 46 GLY CA C 13 45.131 . . . . . . . . 46 GLY CA . 50678 2
14 . 1 . 1 46 46 GLY N N 15 113.3953 . . . . . . . . 46 GLY N . 50678 2
15 . 1 . 1 123 123 HIS H H 1 6.84951 . . . . . . . . 123 HIS H . 50678 2
16 . 1 . 1 123 123 HIS CA C 13 57.408 . . . . . . . . 123 HIS CA . 50678 2
17 . 1 . 1 123 123 HIS N N 15 129.98029 . . . . . . . . 123 HIS N . 50678 2
18 . 1 . 1 141 141 LEU H H 1 8.71397 . . . . . . . . 141 LEU H . 50678 2
19 . 1 . 1 141 141 LEU CA C 13 54.379 . . . . . . . . 141 LEU CA . 50678 2
20 . 1 . 1 141 141 LEU N N 15 127.90063 . . . . . . . . 141 LEU N . 50678 2
21 . 1 . 1 152 152 HIS H H 1 7.44535 . . . . . . . . 152 HIS H . 50678 2
22 . 1 . 1 152 152 HIS CA C 13 54.647 . . . . . . . . 152 HIS CA . 50678 2
23 . 1 . 1 152 152 HIS N N 15 126.00192 . . . . . . . . 152 HIS N . 50678 2
24 . 1 . 1 168 168 ALA H H 1 8.20814 . . . . . . . . 168 ALA H . 50678 2
25 . 1 . 1 168 168 ALA CA C 13 52.854 . . . . . . . . 168 ALA CA . 50678 2
26 . 1 . 1 168 168 ALA N N 15 123.23697 . . . . . . . . 168 ALA N . 50678 2
27 . 1 . 1 174 174 VAL H H 1 9.23665 . . . . . . . . 174 VAL H . 50678 2
28 . 1 . 1 174 174 VAL CA C 13 60.784 . . . . . . . . 174 VAL CA . 50678 2
29 . 1 . 1 174 174 VAL N N 15 128.8823 . . . . . . . . 174 VAL N . 50678 2
30 . 1 . 1 187 187 ASN H H 1 8.29201 . . . . . . . . 187 ASN H . 50678 2
31 . 1 . 1 187 187 ASN CA C 13 53.865 . . . . . . . . 187 ASN CA . 50678 2
32 . 1 . 1 187 187 ASN N N 15 115.84644 . . . . . . . . 187 ASN N . 50678 2
33 . 1 . 1 190 190 LYS H H 1 7.9951 . . . . . . . . 190 LYS H . 50678 2
34 . 1 . 1 190 190 LYS CA C 13 55.304 . . . . . . . . 190 LYS CA . 50678 2
35 . 1 . 1 190 190 LYS N N 15 119.48411 . . . . . . . . 190 LYS N . 50678 2
36 . 1 . 1 191 191 GLY H H 1 7.82904 . . . . . . . . 191 GLY H . 50678 2
37 . 1 . 1 191 191 GLY CA C 13 44.616 . . . . . . . . 191 GLY CA . 50678 2
38 . 1 . 1 191 191 GLY N N 15 108.55097 . . . . . . . . 191 GLY N . 50678 2
39 . 1 . 1 237 237 CYS H H 1 9.901 . . . . . . . . 237 CYS H . 50678 2
40 . 1 . 1 237 237 CYS CA C 13 56.428 . . . . . . . . 237 CYS CA . 50678 2
41 . 1 . 1 237 237 CYS N N 15 118.393 . . . . . . . . 237 CYS N . 50678 2
42 . 1 . 1 261 261 VAL H H 1 9.1206 . . . . . . . . 261 VAL H . 50678 2
43 . 1 . 1 261 261 VAL CA C 13 64.259 . . . . . . . . 261 VAL CA . 50678 2
44 . 1 . 1 261 261 VAL N N 15 127.33648 . . . . . . . . 261 VAL N . 50678 2
45 . 1 . 1 276 276 TYR H H 1 8.451 . . . . . . . . 276 TYR H . 50678 2
46 . 1 . 1 276 276 TYR CA C 13 55.617 . . . . . . . . 276 TYR CA . 50678 2
47 . 1 . 1 276 276 TYR N N 15 117.545 . . . . . . . . 276 TYR N . 50678 2
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