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 30385
_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 $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_NOESY . . . 30385 1
2 2D_TOCSY . . . 30385 1
3 DQF-COSY . . . 30385 1
4 '2D 1H-1H NOESY' . . . 30385 1
5 '2D 1H-1H TOCSY' . . . 30385 1
6 '2D 1H-1H TOCSY' . . . 30385 1
7 '2D 1H-1H NOESY' . . . 30385 1
8 '1D 1H exchange' . . . 30385 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 1 1 CYS HA H 1 4.265 0.002 . 1 . . . . A 1 CYS HA . 30385 1
2 . 1 1 1 1 CYS HB2 H 1 3.310 0.005 . 2 . . . . A 1 CYS HB2 . 30385 1
3 . 1 1 1 1 CYS HB3 H 1 3.014 0.003 . 2 . . . . A 1 CYS HB3 . 30385 1
4 . 1 1 2 2 CYS H H 1 9.069 0.001 . 1 . . . . A 2 CYS H . 30385 1
5 . 1 1 2 2 CYS HA H 1 4.828 0.003 . 1 . . . . A 2 CYS HA . 30385 1
6 . 1 1 2 2 CYS HB2 H 1 3.284 0.004 . 2 . . . . A 2 CYS HB2 . 30385 1
7 . 1 1 2 2 CYS HB3 H 1 3.235 0.004 . 2 . . . . A 2 CYS HB3 . 30385 1
8 . 1 1 3 3 THR H H 1 8.670 0.014 . 1 . . . . A 3 THR H . 30385 1
9 . 1 1 3 3 THR HA H 1 4.360 0.042 . 1 . . . . A 3 THR HA . 30385 1
10 . 1 1 3 3 THR HB H 1 4.299 0.012 . 1 . . . . A 3 THR HB . 30385 1
11 . 1 1 3 3 THR HG21 H 1 1.254 0.001 . 1 . . . . A 3 THR HG21 . 30385 1
12 . 1 1 3 3 THR HG22 H 1 1.254 0.001 . 1 . . . . A 3 THR HG22 . 30385 1
13 . 1 1 3 3 THR HG23 H 1 1.254 0.001 . 1 . . . . A 3 THR HG23 . 30385 1
14 . 1 1 4 4 ALA H H 1 8.126 0.006 . 1 . . . . A 4 ALA H . 30385 1
15 . 1 1 4 4 ALA HA H 1 4.376 0.006 . 1 . . . . A 4 ALA HA . 30385 1
16 . 1 1 4 4 ALA HB1 H 1 1.426 0.001 . 1 . . . . A 4 ALA HB1 . 30385 1
17 . 1 1 4 4 ALA HB2 H 1 1.426 0.001 . 1 . . . . A 4 ALA HB2 . 30385 1
18 . 1 1 4 4 ALA HB3 H 1 1.426 0.001 . 1 . . . . A 4 ALA HB3 . 30385 1
19 . 1 1 5 5 LEU H H 1 8.418 0.002 . 1 . . . . A 5 LEU H . 30385 1
20 . 1 1 5 5 LEU HA H 1 4.323 0.004 . 1 . . . . A 5 LEU HA . 30385 1
21 . 1 1 5 5 LEU HB2 H 1 1.797 0.003 . 2 . . . . A 5 LEU HB2 . 30385 1
22 . 1 1 5 5 LEU HB3 H 1 1.796 0.003 . 2 . . . . A 5 LEU HB3 . 30385 1
23 . 1 1 5 5 LEU HG H 1 1.575 0.004 . 1 . . . . A 5 LEU HG . 30385 1
24 . 1 1 5 5 LEU HD11 H 1 0.928 0.005 . 2 . . . . A 5 LEU HD11 . 30385 1
25 . 1 1 5 5 LEU HD12 H 1 0.928 0.005 . 2 . . . . A 5 LEU HD12 . 30385 1
26 . 1 1 5 5 LEU HD13 H 1 0.928 0.005 . 2 . . . . A 5 LEU HD13 . 30385 1
27 . 1 1 5 5 LEU HD21 H 1 0.829 0.003 . 2 . . . . A 5 LEU HD21 . 30385 1
28 . 1 1 5 5 LEU HD22 H 1 0.829 0.003 . 2 . . . . A 5 LEU HD22 . 30385 1
29 . 1 1 5 5 LEU HD23 H 1 0.829 0.003 . 2 . . . . A 5 LEU HD23 . 30385 1
30 . 1 1 6 6 CYS H H 1 8.265 0.001 . 1 . . . . A 6 CYS H . 30385 1
31 . 1 1 6 6 CYS HA H 1 4.584 0.011 . 1 . . . . A 6 CYS HA . 30385 1
32 . 1 1 6 6 CYS HB2 H 1 3.397 0.010 . 2 . . . . A 6 CYS HB2 . 30385 1
33 . 1 1 6 6 CYS HB3 H 1 3.259 0.003 . 2 . . . . A 6 CYS HB3 . 30385 1
34 . 1 1 7 7 SER H H 1 8.590 0.001 . 1 . . . . A 7 SER H . 30385 1
35 . 1 1 7 7 SER HA H 1 4.390 0.007 . 1 . . . . A 7 SER HA . 30385 1
36 . 1 1 7 7 SER HB2 H 1 4.031 0.002 . 2 . . . . A 7 SER HB2 . 30385 1
37 . 1 1 7 7 SER HB3 H 1 3.902 0.007 . 2 . . . . A 7 SER HB3 . 30385 1
38 . 1 1 8 8 ARG HA H 1 4.006 0.004 . 1 . . . . A 8 ARG HA . 30385 1
39 . 1 1 8 8 ARG HB2 H 1 1.646 0.004 . 2 . . . . A 8 ARG HB2 . 30385 1
40 . 1 1 8 8 ARG HB3 H 1 1.446 0.006 . 2 . . . . A 8 ARG HB3 . 30385 1
41 . 1 1 8 8 ARG HG2 H 1 1.142 0.004 . 2 . . . . A 8 ARG HG2 . 30385 1
42 . 1 1 8 8 ARG HG3 H 1 0.985 0.007 . 2 . . . . A 8 ARG HG3 . 30385 1
43 . 1 1 8 8 ARG HD2 H 1 2.953 0.006 . 2 . . . . A 8 ARG HD2 . 30385 1
44 . 1 1 8 8 ARG HD3 H 1 2.954 0.005 . 2 . . . . A 8 ARG HD3 . 30385 1
45 . 1 1 8 8 ARG HE H 1 7.044 0.001 . 1 . . . . A 8 ARG HE . 30385 1
46 . 1 1 9 9 TYR H H 1 7.945 0.033 . 1 . . . . A 9 TYR H . 30385 1
47 . 1 1 9 9 TYR HA H 1 4.529 0.002 . 1 . . . . A 9 TYR HA . 30385 1
48 . 1 1 9 9 TYR HB2 H 1 3.168 0.007 . 2 . . . . A 9 TYR HB2 . 30385 1
49 . 1 1 9 9 TYR HB3 H 1 2.690 0.004 . 2 . . . . A 9 TYR HB3 . 30385 1
50 . 1 1 9 9 TYR HD1 H 1 7.154 0.001 . 1 . . . . A 9 TYR HD1 . 30385 1
51 . 1 1 9 9 TYR HD2 H 1 7.154 0.001 . 1 . . . . A 9 TYR HD2 . 30385 1
52 . 1 1 9 9 TYR HE1 H 1 6.813 0.000 . 1 . . . . A 9 TYR HE1 . 30385 1
53 . 1 1 9 9 TYR HE2 H 1 6.813 0.000 . 1 . . . . A 9 TYR HE2 . 30385 1
54 . 1 1 10 10 HIS H H 1 8.044 0.003 . 1 . . . . A 10 HIS H . 30385 1
55 . 1 1 10 10 HIS HA H 1 4.646 0.003 . 1 . . . . A 10 HIS HA . 30385 1
56 . 1 1 10 10 HIS HB2 H 1 3.357 0.005 . 2 . . . . A 10 HIS HB2 . 30385 1
57 . 1 1 10 10 HIS HB3 H 1 3.252 0.005 . 2 . . . . A 10 HIS HB3 . 30385 1
58 . 1 1 11 11 CYS HA H 1 4.655 0.005 . 1 . . . . A 11 CYS HA . 30385 1
59 . 1 1 11 11 CYS HB2 H 1 3.352 0.003 . 2 . . . . A 11 CYS HB2 . 30385 1
60 . 1 1 11 11 CYS HB3 H 1 2.975 0.002 . 2 . . . . A 11 CYS HB3 . 30385 1
61 . 1 1 12 12 LEU H H 1 8.233 0.002 . 1 . . . . A 12 LEU H . 30385 1
62 . 1 1 12 12 LEU HA H 1 4.570 0.013 . 1 . . . . A 12 LEU HA . 30385 1
63 . 1 1 12 12 LEU HB2 H 1 1.559 0.028 . 1 . . . . A 12 LEU HB2 . 30385 1
64 . 1 1 12 12 LEU HB3 H 1 1.559 0.028 . 1 . . . . A 12 LEU HB3 . 30385 1
65 . 1 1 12 12 LEU HG H 1 1.420 0.004 . 1 . . . . A 12 LEU HG . 30385 1
66 . 1 1 12 12 LEU HD11 H 1 0.962 0.009 . 2 . . . . A 12 LEU HD11 . 30385 1
67 . 1 1 12 12 LEU HD12 H 1 0.962 0.009 . 2 . . . . A 12 LEU HD12 . 30385 1
68 . 1 1 12 12 LEU HD13 H 1 0.962 0.009 . 2 . . . . A 12 LEU HD13 . 30385 1
69 . 1 1 12 12 LEU HD21 H 1 0.866 0.001 . 2 . . . . A 12 LEU HD21 . 30385 1
70 . 1 1 12 12 LEU HD22 H 1 0.866 0.001 . 2 . . . . A 12 LEU HD22 . 30385 1
71 . 1 1 12 12 LEU HD23 H 1 0.866 0.001 . 2 . . . . A 12 LEU HD23 . 30385 1
72 . 1 1 13 13 PRO HA H 1 4.610 0.002 . 1 . . . . A 13 PRO HA . 30385 1
73 . 1 1 13 13 PRO HB2 H 1 2.404 0.004 . 2 . . . . A 13 PRO HB2 . 30385 1
74 . 1 1 13 13 PRO HB3 H 1 1.770 0.005 . 2 . . . . A 13 PRO HB3 . 30385 1
75 . 1 1 13 13 PRO HG2 H 1 2.100 0.003 . 2 . . . . A 13 PRO HG2 . 30385 1
76 . 1 1 13 13 PRO HG3 H 1 1.979 0.082 . 2 . . . . A 13 PRO HG3 . 30385 1
77 . 1 1 13 13 PRO HD2 H 1 3.599 0.002 . 2 . . . . A 13 PRO HD2 . 30385 1
78 . 1 1 13 13 PRO HD3 H 1 3.516 0.006 . 2 . . . . A 13 PRO HD3 . 30385 1
79 . 1 1 14 14 CYS H H 1 9.294 0.002 . 1 . . . . A 14 CYS H . 30385 1
80 . 1 1 14 14 CYS HA H 1 4.940 0.003 . 1 . . . . A 14 CYS HA . 30385 1
81 . 1 1 14 14 CYS HB2 H 1 3.275 0.002 . 2 . . . . A 14 CYS HB2 . 30385 1
82 . 1 1 14 14 CYS HB3 H 1 3.123 0.003 . 2 . . . . A 14 CYS HB3 . 30385 1
83 . 1 1 15 15 CYS H H 1 8.627 0.005 . 1 . . . . A 15 CYS H . 30385 1
84 . 1 1 15 15 CYS HA H 1 4.417 0.004 . 1 . . . . A 15 CYS HA . 30385 1
85 . 1 1 15 15 CYS HB2 H 1 3.352 0.005 . 2 . . . . A 15 CYS HB2 . 30385 1
86 . 1 1 15 15 CYS HB3 H 1 2.902 0.003 . 2 . . . . A 15 CYS HB3 . 30385 1
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