Content for NMR-STAR saveframe, "assigned_chem_shift_list_1"
save_assigned_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 27073
_Assigned_chem_shift_list.ID 1
_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 $chemical_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err 0.007
_Assigned_chem_shift_list.Chem_shift_13C_err 0.071
_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 HMQC' . . . 27073 1
2 '3D 1H-13C-1H NOESY' . . . 27073 1
3 '3D 1H-13C-13C NOESY' . . . 27073 1
4 '2D 1H-13C HMQC' . . . 27073 1
5 '2D 1H-13C HMQC' . . . 27073 1
6 '2D 1H-13C HMQC' . . . 27073 1
7 '2D 1H-13C HMQC' . . . 27073 1
8 '2D 1H-13C HMQC' . . . 27073 1
9 '2D 1H-13C HMQC' . . . 27073 1
10 '2D 1H-13C HMQC' . . . 27073 1
11 '2D 1H-13C HMQC' . . . 27073 1
12 '2D 1H-13C HMQC' . . . 27073 1
13 '2D 1H-13C HMQC' . . . 27073 1
14 '2D 1H-13C HMQC' . . . 27073 1
15 '2D 1H-13C HMQC' . . . 27073 1
16 '2D 1H-13C HMQC' . . . 27073 1
17 '2D 1H-13C HMQC' . . . 27073 1
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 11 11 ILE HD11 H 1 0.663 0.007 . 1 . . . . 11 ILE HD1 . 27073 1
2 . 1 1 11 11 ILE HD12 H 1 0.663 0.007 . 1 . . . . 11 ILE HD1 . 27073 1
3 . 1 1 11 11 ILE HD13 H 1 0.663 0.007 . 1 . . . . 11 ILE HD1 . 27073 1
4 . 1 1 11 11 ILE CD1 C 13 13.974 0.071 . 1 . . . . 11 ILE CD1 . 27073 1
5 . 1 1 23 23 ILE HD11 H 1 0.723 0.007 . 1 . . . . 23 ILE HD1 . 27073 1
6 . 1 1 23 23 ILE HD12 H 1 0.723 0.007 . 1 . . . . 23 ILE HD1 . 27073 1
7 . 1 1 23 23 ILE HD13 H 1 0.723 0.007 . 1 . . . . 23 ILE HD1 . 27073 1
8 . 1 1 23 23 ILE CD1 C 13 12.881 0.071 . 1 . . . . 23 ILE CD1 . 27073 1
9 . 1 1 71 71 ILE HD11 H 1 0.864 0.007 . 5 . . . . 71 ILE HD1 . 27073 1
10 . 1 1 71 71 ILE HD12 H 1 0.864 0.007 . 5 . . . . 71 ILE HD1 . 27073 1
11 . 1 1 71 71 ILE HD13 H 1 0.864 0.007 . 5 . . . . 71 ILE HD1 . 27073 1
12 . 1 1 71 71 ILE CD1 C 13 12.456 0.071 . 5 . . . . 71 ILE CD1 . 27073 1
13 . 1 1 119 119 ILE HD11 H 1 0.842 0.007 . 1 . . . . 119 ILE HD1 . 27073 1
14 . 1 1 119 119 ILE HD12 H 1 0.842 0.007 . 1 . . . . 119 ILE HD1 . 27073 1
15 . 1 1 119 119 ILE HD13 H 1 0.842 0.007 . 1 . . . . 119 ILE HD1 . 27073 1
16 . 1 1 119 119 ILE CD1 C 13 14.593 0.071 . 1 . . . . 119 ILE CD1 . 27073 1
17 . 1 1 134 134 ILE HD11 H 1 0.623 0.007 . 1 . . . . 134 ILE HD1 . 27073 1
18 . 1 1 134 134 ILE HD12 H 1 0.623 0.007 . 1 . . . . 134 ILE HD1 . 27073 1
19 . 1 1 134 134 ILE HD13 H 1 0.623 0.007 . 1 . . . . 134 ILE HD1 . 27073 1
20 . 1 1 134 134 ILE CD1 C 13 13.420 0.071 . 1 . . . . 134 ILE CD1 . 27073 1
21 . 1 1 138 138 ILE HD11 H 1 1.025 0.007 . 1 . . . . 138 ILE HD1 . 27073 1
22 . 1 1 138 138 ILE HD12 H 1 1.025 0.007 . 1 . . . . 138 ILE HD1 . 27073 1
23 . 1 1 138 138 ILE HD13 H 1 1.025 0.007 . 1 . . . . 138 ILE HD1 . 27073 1
24 . 1 1 138 138 ILE CD1 C 13 14.241 0.071 . 1 . . . . 138 ILE CD1 . 27073 1
25 . 1 1 160 160 ILE HD11 H 1 0.807 0.007 . 1 . . . . 160 ILE HD1 . 27073 1
26 . 1 1 160 160 ILE HD12 H 1 0.807 0.007 . 1 . . . . 160 ILE HD1 . 27073 1
27 . 1 1 160 160 ILE HD13 H 1 0.807 0.007 . 1 . . . . 160 ILE HD1 . 27073 1
28 . 1 1 160 160 ILE CD1 C 13 12.342 0.071 . 1 . . . . 160 ILE CD1 . 27073 1
29 . 1 1 178 178 ILE HD11 H 1 0.785 0.007 . 5 . . . . 178 ILE HD1 . 27073 1
30 . 1 1 178 178 ILE HD12 H 1 0.785 0.007 . 5 . . . . 178 ILE HD1 . 27073 1
31 . 1 1 178 178 ILE HD13 H 1 0.785 0.007 . 5 . . . . 178 ILE HD1 . 27073 1
32 . 1 1 178 178 ILE CD1 C 13 14.435 0.071 . 5 . . . . 178 ILE CD1 . 27073 1
33 . 1 1 233 233 ILE HD11 H 1 0.650 0.007 . 1 . . . . 233 ILE HD1 . 27073 1
34 . 1 1 233 233 ILE HD12 H 1 0.650 0.007 . 1 . . . . 233 ILE HD1 . 27073 1
35 . 1 1 233 233 ILE HD13 H 1 0.650 0.007 . 1 . . . . 233 ILE HD1 . 27073 1
36 . 1 1 233 233 ILE CD1 C 13 12.516 0.071 . 1 . . . . 233 ILE CD1 . 27073 1
37 . 1 1 239 239 ILE HD11 H 1 0.607 0.007 . 1 . . . . 239 ILE HD1 . 27073 1
38 . 1 1 239 239 ILE HD12 H 1 0.607 0.007 . 1 . . . . 239 ILE HD1 . 27073 1
39 . 1 1 239 239 ILE HD13 H 1 0.607 0.007 . 1 . . . . 239 ILE HD1 . 27073 1
40 . 1 1 239 239 ILE CD1 C 13 13.406 0.071 . 1 . . . . 239 ILE CD1 . 27073 1
41 . 1 1 253 253 ILE HD11 H 1 0.880 0.007 . 5 . . . . 253 ILE HD1 . 27073 1
42 . 1 1 253 253 ILE HD12 H 1 0.880 0.007 . 5 . . . . 253 ILE HD1 . 27073 1
43 . 1 1 253 253 ILE HD13 H 1 0.880 0.007 . 5 . . . . 253 ILE HD1 . 27073 1
44 . 1 1 253 253 ILE CD1 C 13 14.310 0.071 . 5 . . . . 253 ILE CD1 . 27073 1
45 . 1 1 293 293 ILE HD11 H 1 0.768 0.007 . 5 . . . . 293 ILE HD1 . 27073 1
46 . 1 1 293 293 ILE HD12 H 1 0.768 0.007 . 5 . . . . 293 ILE HD1 . 27073 1
47 . 1 1 293 293 ILE HD13 H 1 0.768 0.007 . 5 . . . . 293 ILE HD1 . 27073 1
48 . 1 1 293 293 ILE CD1 C 13 13.550 0.071 . 5 . . . . 293 ILE CD1 . 27073 1
49 . 1 1 308 308 ILE HD11 H 1 0.691 0.007 . 1 . . . . 308 ILE HD1 . 27073 1
50 . 1 1 308 308 ILE HD12 H 1 0.691 0.007 . 1 . . . . 308 ILE HD1 . 27073 1
51 . 1 1 308 308 ILE HD13 H 1 0.691 0.007 . 1 . . . . 308 ILE HD1 . 27073 1
52 . 1 1 308 308 ILE CD1 C 13 9.913 0.071 . 1 . . . . 308 ILE CD1 . 27073 1
53 . 1 1 323 323 ILE HD11 H 1 0.893 0.007 . 1 . . . . 323 ILE HD1 . 27073 1
54 . 1 1 323 323 ILE HD12 H 1 0.893 0.007 . 1 . . . . 323 ILE HD1 . 27073 1
55 . 1 1 323 323 ILE HD13 H 1 0.893 0.007 . 1 . . . . 323 ILE HD1 . 27073 1
56 . 1 1 323 323 ILE CD1 C 13 13.510 0.071 . 1 . . . . 323 ILE CD1 . 27073 1
57 . 1 1 363 363 ILE HD11 H 1 0.599 0.007 . 1 . . . . 363 ILE HD1 . 27073 1
58 . 1 1 363 363 ILE HD12 H 1 0.599 0.007 . 1 . . . . 363 ILE HD1 . 27073 1
59 . 1 1 363 363 ILE HD13 H 1 0.599 0.007 . 1 . . . . 363 ILE HD1 . 27073 1
60 . 1 1 363 363 ILE CD1 C 13 12.816 0.071 . 1 . . . . 363 ILE CD1 . 27073 1
61 . 1 1 419 419 ILE HD11 H 1 0.600 0.007 . 1 . . . . 419 ILE HD1 . 27073 1
62 . 1 1 419 419 ILE HD12 H 1 0.600 0.007 . 1 . . . . 419 ILE HD1 . 27073 1
63 . 1 1 419 419 ILE HD13 H 1 0.600 0.007 . 1 . . . . 419 ILE HD1 . 27073 1
64 . 1 1 419 419 ILE CD1 C 13 13.858 0.071 . 1 . . . . 419 ILE CD1 . 27073 1
65 . 1 1 432 432 ILE HD11 H 1 0.458 0.007 . 1 . . . . 432 ILE HD1 . 27073 1
66 . 1 1 432 432 ILE HD12 H 1 0.458 0.007 . 1 . . . . 432 ILE HD1 . 27073 1
67 . 1 1 432 432 ILE HD13 H 1 0.458 0.007 . 1 . . . . 432 ILE HD1 . 27073 1
68 . 1 1 432 432 ILE CD1 C 13 11.788 0.071 . 1 . . . . 432 ILE CD1 . 27073 1
69 . 1 1 462 462 ILE HD11 H 1 0.844 0.007 . 1 . . . . 462 ILE HD1 . 27073 1
70 . 1 1 462 462 ILE HD12 H 1 0.844 0.007 . 1 . . . . 462 ILE HD1 . 27073 1
71 . 1 1 462 462 ILE HD13 H 1 0.844 0.007 . 1 . . . . 462 ILE HD1 . 27073 1
72 . 1 1 462 462 ILE CD1 C 13 14.451 0.071 . 1 . . . . 462 ILE CD1 . 27073 1
73 . 1 1 463 463 ILE HD11 H 1 0.802 0.007 . 1 . . . . 463 ILE HD1 . 27073 1
74 . 1 1 463 463 ILE HD12 H 1 0.802 0.007 . 1 . . . . 463 ILE HD1 . 27073 1
75 . 1 1 463 463 ILE HD13 H 1 0.802 0.007 . 1 . . . . 463 ILE HD1 . 27073 1
76 . 1 1 463 463 ILE CD1 C 13 14.642 0.071 . 1 . . . . 463 ILE CD1 . 27073 1
77 . 1 1 512 512 ILE HD11 H 1 0.697 0.007 . 1 . . . . 512 ILE HD1 . 27073 1
78 . 1 1 512 512 ILE HD12 H 1 0.697 0.007 . 1 . . . . 512 ILE HD1 . 27073 1
79 . 1 1 512 512 ILE HD13 H 1 0.697 0.007 . 1 . . . . 512 ILE HD1 . 27073 1
80 . 1 1 512 512 ILE CD1 C 13 13.523 0.071 . 1 . . . . 512 ILE CD1 . 27073 1
stop_
save_