Content for NMR-STAR saveframe, "assigned_chemical_shifts_1"
save_assigned_chemical_shifts_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1
_Assigned_chem_shift_list.Entry_ID 34357
_Assigned_chem_shift_list.ID 1
_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
1 '2D 1H-1H TOCSY' . . . 34357 1
2 '2D 1H-1H COSY' . . . 34357 1
3 '2D 1H-1H NOESY' . . . 34357 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.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 2 2 GLY H H 1 8.741 0.0 . 1 . . . . A 2 GLY H . 34357 1
2 . 1 1 2 2 GLY HA2 H 1 3.980 0.002 . 1 . . . . A 2 GLY HA2 . 34357 1
3 . 1 1 3 3 GLY H H 1 8.319 0.001 . 1 . . . . A 3 GLY H . 34357 1
4 . 1 1 3 3 GLY HA2 H 1 3.957 0.003 . 1 . . . . A 3 GLY HA2 . 34357 1
5 . 1 1 4 4 ARG H H 1 8.182 0.002 . 1 . . . . A 4 ARG H . 34357 1
6 . 1 1 4 4 ARG HA H 1 4.295 0.001 . 1 . . . . A 4 ARG HA . 34357 1
7 . 1 1 4 4 ARG HB2 H 1 1.721 . . 2 . . . . A 4 ARG HB2 . 34357 1
8 . 1 1 4 4 ARG HB3 H 1 1.808 . . 2 . . . . A 4 ARG HB3 . 34357 1
9 . 1 1 4 4 ARG HG2 H 1 1.501 . . 2 . . . . A 4 ARG HG2 . 34357 1
10 . 1 1 4 4 ARG HG3 H 1 1.616 . . 2 . . . . A 4 ARG HG3 . 34357 1
11 . 1 1 5 5 LEU H H 1 8.023 0.0 . 1 . . . . A 5 LEU H . 34357 1
12 . 1 1 5 5 LEU HA H 1 5.449 0.001 . 1 . . . . A 5 LEU HA . 34357 1
13 . 1 1 5 5 LEU HB2 H 1 1.646 . . 1 . . . . A 5 LEU HB2 . 34357 1
14 . 1 1 5 5 LEU HG H 1 1.523 0.001 . 1 . . . . A 5 LEU HG . 34357 1
15 . 1 1 5 5 LEU HD11 H 1 0.811 0.001 . 1 . . . . A 5 LEU HD11 . 34357 1
16 . 1 1 5 5 LEU HD12 H 1 0.811 0.001 . 1 . . . . A 5 LEU HD12 . 34357 1
17 . 1 1 5 5 LEU HD13 H 1 0.811 0.001 . 1 . . . . A 5 LEU HD13 . 34357 1
18 . 1 1 6 6 CYS H H 1 9.347 0.001 . 1 . . . . A 6 CYS H . 34357 1
19 . 1 1 6 6 CYS HA H 1 4.821 0.003 . 1 . . . . A 6 CYS HA . 34357 1
20 . 1 1 6 6 CYS HB2 H 1 2.691 0.008 . 2 . . . . A 6 CYS HB2 . 34357 1
21 . 1 1 6 6 CYS HB3 H 1 2.722 0.006 . 2 . . . . A 6 CYS HB3 . 34357 1
22 . 1 1 7 7 TYR H H 1 8.809 0.002 . 1 . . . . A 7 TYR H . 34357 1
23 . 1 1 7 7 TYR HA H 1 5.568 0.001 . 1 . . . . A 7 TYR HA . 34357 1
24 . 1 1 7 7 TYR HB2 H 1 2.721 . . 2 . . . . A 7 TYR HB2 . 34357 1
25 . 1 1 7 7 TYR HB3 H 1 2.720 0.002 . 2 . . . . A 7 TYR HB3 . 34357 1
26 . 1 1 7 7 TYR HD1 H 1 6.920 0.0 . 1 . . . . A 7 TYR HD1 . 34357 1
27 . 1 1 7 7 TYR HD2 H 1 6.920 0.0 . 1 . . . . A 7 TYR HD2 . 34357 1
28 . 1 1 7 7 TYR HE1 H 1 6.580 0.005 . 1 . . . . A 7 TYR HE1 . 34357 1
29 . 1 1 7 7 TYR HE2 H 1 6.580 0.005 . 1 . . . . A 7 TYR HE2 . 34357 1
30 . 1 1 8 8 CYS H H 1 8.828 0.002 . 1 . . . . A 8 CYS H . 34357 1
31 . 1 1 8 8 CYS HA H 1 4.255 0.0 . 1 . . . . A 8 CYS HA . 34357 1
32 . 1 1 8 8 CYS HB2 H 1 2.592 0.0 . 2 . . . . A 8 CYS HB2 . 34357 1
33 . 1 1 8 8 CYS HB3 H 1 2.376 0.0 . 2 . . . . A 8 CYS HB3 . 34357 1
34 . 1 1 9 9 ARG H H 1 9.128 0.001 . 1 . . . . A 9 ARG H . 34357 1
35 . 1 1 9 9 ARG HA H 1 3.782 0.001 . 1 . . . . A 9 ARG HA . 34357 1
36 . 1 1 9 9 ARG HB2 H 1 1.983 . . 2 . . . . A 9 ARG HB2 . 34357 1
37 . 1 1 9 9 ARG HB3 H 1 1.715 . . 2 . . . . A 9 ARG HB3 . 34357 1
38 . 1 1 9 9 ARG HG2 H 1 1.550 . . 1 . . . . A 9 ARG HG2 . 34357 1
39 . 1 1 10 10 GLY H H 1 6.960 0.004 . 1 . . . . A 10 GLY H . 34357 1
40 . 1 1 10 10 GLY HA2 H 1 3.622 . . 2 . . . . A 10 GLY HA2 . 34357 1
41 . 1 1 10 10 GLY HA3 H 1 4.185 0.001 . 2 . . . . A 10 GLY HA3 . 34357 1
42 . 1 1 11 11 TRP H H 1 7.950 0.003 . 1 . . . . A 11 TRP H . 34357 1
43 . 1 1 11 11 TRP HA H 1 5.047 0.0 . 1 . . . . A 11 TRP HA . 34357 1
44 . 1 1 11 11 TRP HD1 H 1 7.219 0.001 . 1 . . . . A 11 TRP HD1 . 34357 1
45 . 1 1 11 11 TRP HE1 H 1 10.21 0.0 . 1 . . . . A 11 TRP HE1 . 34357 1
46 . 1 1 11 11 TRP HE3 H 1 6.976 0.001 . 1 . . . . A 11 TRP HE3 . 34357 1
47 . 1 1 11 11 TRP HZ2 H 1 7.318 0.001 . 1 . . . . A 11 TRP HZ2 . 34357 1
48 . 1 1 11 11 TRP HZ3 H 1 6.701 0.002 . 1 . . . . A 11 TRP HZ3 . 34357 1
49 . 1 1 11 11 TRP HH2 H 1 6.893 0.003 . 1 . . . . A 11 TRP HH2 . 34357 1
50 . 1 1 12 12 ILE H H 1 9.382 0.003 . 1 . . . . A 12 ILE H . 34357 1
51 . 1 1 12 12 ILE HA H 1 4.825 0.002 . 1 . . . . A 12 ILE HA . 34357 1
52 . 1 1 12 12 ILE HB H 1 2.675 0.003 . 1 . . . . A 12 ILE HB . 34357 1
53 . 1 1 12 12 ILE HG12 H 1 0.921 0.006 . 1 . . . . A 12 ILE HG12 . 34357 1
54 . 1 1 13 13 CYS H H 1 8.907 0.003 . 1 . . . . A 13 CYS H . 34357 1
55 . 1 1 13 13 CYS HA H 1 5.730 0.001 . 1 . . . . A 13 CYS HA . 34357 1
56 . 1 1 14 14 PHE H H 1 9.804 0.004 . 1 . . . . A 14 PHE H . 34357 1
57 . 1 1 14 14 PHE HA H 1 5.502 0.002 . 1 . . . . A 14 PHE HA . 34357 1
58 . 1 1 14 14 PHE HD1 H 1 7.106 0.004 . 1 . . . . A 14 PHE HD1 . 34357 1
59 . 1 1 14 14 PHE HD2 H 1 7.106 0.004 . 1 . . . . A 14 PHE HD2 . 34357 1
60 . 1 1 14 14 PHE HE1 H 1 6.993 0.015 . 1 . . . . A 14 PHE HE1 . 34357 1
61 . 1 1 14 14 PHE HE2 H 1 6.993 0.015 . 1 . . . . A 14 PHE HE2 . 34357 1
62 . 1 1 15 15 CYS H H 1 8.221 0.002 . 1 . . . . A 15 CYS H . 34357 1
63 . 1 1 15 15 CYS HA H 1 3.519 0.0 . 1 . . . . A 15 CYS HA . 34357 1
64 . 1 1 15 15 CYS HG H 1 1.722 . . 1 . . . . A 15 CYS HG . 34357 1
65 . 1 1 16 16 VAL H H 1 8.355 0.001 . 1 . . . . A 16 VAL H . 34357 1
66 . 1 1 16 16 VAL HA H 1 4.129 0.001 . 1 . . . . A 16 VAL HA . 34357 1
67 . 1 1 16 16 VAL HB H 1 2.200 0.002 . 1 . . . . A 16 VAL HB . 34357 1
68 . 1 1 16 16 VAL HG11 H 1 0.900 0.0 . 2 . . . . A 16 VAL HG11 . 34357 1
69 . 1 1 16 16 VAL HG12 H 1 0.900 0.0 . 2 . . . . A 16 VAL HG12 . 34357 1
70 . 1 1 16 16 VAL HG13 H 1 0.900 0.0 . 2 . . . . A 16 VAL HG13 . 34357 1
71 . 1 1 16 16 VAL HG21 H 1 0.400 0.002 . 2 . . . . A 16 VAL HG21 . 34357 1
72 . 1 1 16 16 VAL HG22 H 1 0.400 0.002 . 2 . . . . A 16 VAL HG22 . 34357 1
73 . 1 1 16 16 VAL HG23 H 1 0.400 0.002 . 2 . . . . A 16 VAL HG23 . 34357 1
74 . 1 1 17 17 GLY H H 1 8.183 0.001 . 1 . . . . A 17 GLY H . 34357 1
75 . 1 1 17 17 GLY HA2 H 1 3.899 0.0 . 2 . . . . A 17 GLY HA2 . 34357 1
76 . 1 1 17 17 GLY HA3 H 1 3.785 0.001 . 2 . . . . A 17 GLY HA3 . 34357 1
77 . 1 1 18 18 ARG H H 1 7.728 0.0 . 1 . . . . A 18 ARG H . 34357 1
78 . 1 1 18 18 ARG HA H 1 4.082 . . 1 . . . . A 18 ARG HA . 34357 1
79 . 1 1 18 18 ARG HB2 H 1 1.738 . . 2 . . . . A 18 ARG HB2 . 34357 1
80 . 1 1 18 18 ARG HB3 H 1 1.584 . . 2 . . . . A 18 ARG HB3 . 34357 1
81 . 1 1 18 18 ARG HG2 H 1 1.480 . . 1 . . . . A 18 ARG HG2 . 34357 1
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