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 31255
_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' . . . 31255 1
2 '2D 1H-1H NOESY' . . . 31255 1
3 '2D 1H-13C HSQC' . . . 31255 1
4 '2D 1H-15N HSQC' . . . 31255 1
stop_
loop_
_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 1 1 ARG HA H 1 4.134 0.001 . 1 . . . . A 1 ARG HA . 31255 1
2 . 1 . 1 1 1 ARG HB2 H 1 1.919 0.000 . . . . . . A 1 ARG HB2 . 31255 1
3 . 1 . 1 1 1 ARG HB3 H 1 1.890 0.000 . . . . . . A 1 ARG HB3 . 31255 1
4 . 1 . 1 1 1 ARG HG2 H 1 1.637 0.000 . . . . . . A 1 ARG HG2 . 31255 1
5 . 1 . 1 1 1 ARG HG3 H 1 1.670 0.000 . . . . . . A 1 ARG HG3 . 31255 1
6 . 1 . 1 1 1 ARG HD2 H 1 3.146 0.000 . 2 . . . . A 1 ARG HD2 . 31255 1
7 . 1 . 1 1 1 ARG HD3 H 1 3.146 0.000 . 2 . . . . A 1 ARG HD3 . 31255 1
8 . 1 . 1 1 1 ARG HE H 1 7.200 0.000 . 1 . . . . A 1 ARG HE . 31255 1
9 . 1 . 1 1 1 ARG CA C 13 53.236 0.000 . 1 . . . . A 1 ARG CA . 31255 1
10 . 1 . 1 1 1 ARG CB C 13 28.426 0.026 . 1 . . . . A 1 ARG CB . 31255 1
11 . 1 . 1 1 1 ARG CG C 13 23.551 0.027 . 1 . . . . A 1 ARG CG . 31255 1
12 . 1 . 1 1 1 ARG CD C 13 40.875 0.000 . 1 . . . . A 1 ARG CD . 31255 1
13 . 1 . 1 2 2 CYS H H 1 8.945 0.000 . 1 . . . . A 2 CYS H . 31255 1
14 . 1 . 1 2 2 CYS HA H 1 4.880 0.000 . 1 . . . . A 2 CYS HA . 31255 1
15 . 1 . 1 2 2 CYS HB2 H 1 2.767 0.000 . . . . . . A 2 CYS HB2 . 31255 1
16 . 1 . 1 2 2 CYS HB3 H 1 3.068 0.000 . . . . . . A 2 CYS HB3 . 31255 1
17 . 1 . 1 2 2 CYS CB C 13 38.783 0.010 . 1 . . . . A 2 CYS CB . 31255 1
18 . 1 . 1 2 2 CYS N N 15 121.706 0.000 . 1 . . . . A 2 CYS N . 31255 1
19 . 1 . 1 3 3 CYS H H 1 8.707 0.000 . 1 . . . . A 3 CYS H . 31255 1
20 . 1 . 1 3 3 CYS HA H 1 5.070 0.002 . 1 . . . . A 3 CYS HA . 31255 1
21 . 1 . 1 3 3 CYS HB2 H 1 3.168 0.000 . . . . . . A 3 CYS HB2 . 31255 1
22 . 1 . 1 3 3 CYS HB3 H 1 3.071 0.002 . . . . . . A 3 CYS HB3 . 31255 1
23 . 1 . 1 3 3 CYS CA C 13 53.410 0.000 . 1 . . . . A 3 CYS CA . 31255 1
24 . 1 . 1 3 3 CYS CB C 13 43.482 0.022 . 1 . . . . A 3 CYS CB . 31255 1
25 . 1 . 1 3 3 CYS N N 15 120.485 0.000 . 1 . . . . A 3 CYS N . 31255 1
26 . 1 . 1 4 4 GLY H H 1 8.513 0.000 . 1 . . . . A 4 GLY H . 31255 1
27 . 1 . 1 4 4 GLY HA2 H 1 4.301 0.000 . . . . . . A 4 GLY HA2 . 31255 1
28 . 1 . 1 4 4 GLY HA3 H 1 3.726 0.000 . . . . . . A 4 GLY HA3 . 31255 1
29 . 1 . 1 4 4 GLY CA C 13 42.286 0.001 . 1 . . . . A 4 GLY CA . 31255 1
30 . 1 . 1 4 4 GLY N N 15 110.232 0.000 . 1 . . . . A 4 GLY N . 31255 1
31 . 1 . 1 5 5 TYR HA H 1 4.529 0.000 . 1 . . . . A 5 TYR HA . 31255 1
32 . 1 . 1 5 5 TYR HB2 H 1 3.145 0.000 . . . . . . A 5 TYR HB2 . 31255 1
33 . 1 . 1 5 5 TYR HB3 H 1 3.071 0.000 . . . . . . A 5 TYR HB3 . 31255 1
34 . 1 . 1 5 5 TYR HD1 H 1 7.167 0.000 . 3 . . . . A 5 TYR HD1 . 31255 1
35 . 1 . 1 5 5 TYR HD2 H 1 7.167 0.000 . 3 . . . . A 5 TYR HD2 . 31255 1
36 . 1 . 1 5 5 TYR HE1 H 1 6.852 0.011 . 3 . . . . A 5 TYR HE1 . 31255 1
37 . 1 . 1 5 5 TYR HE2 H 1 6.852 0.011 . 3 . . . . A 5 TYR HE2 . 31255 1
38 . 1 . 1 5 5 TYR CA C 13 55.829 0.000 . 1 . . . . A 5 TYR CA . 31255 1
39 . 1 . 1 5 5 TYR CB C 13 35.269 0.016 . 1 . . . . A 5 TYR CB . 31255 1
40 . 1 . 1 6 6 LYS H H 1 8.505 0.003 . 1 . . . . A 6 LYS H . 31255 1
41 . 1 . 1 6 6 LYS HA H 1 4.067 0.000 . 1 . . . . A 6 LYS HA . 31255 1
42 . 1 . 1 6 6 LYS HB2 H 1 1.842 0.004 . . . . . . A 6 LYS HB2 . 31255 1
43 . 1 . 1 6 6 LYS HB3 H 1 1.806 0.003 . . . . . . A 6 LYS HB3 . 31255 1
44 . 1 . 1 6 6 LYS HG2 H 1 1.231 0.001 . 2 . . . . A 6 LYS HG2 . 31255 1
45 . 1 . 1 6 6 LYS HG3 H 1 1.231 0.001 . 2 . . . . A 6 LYS HG3 . 31255 1
46 . 1 . 1 6 6 LYS HD2 H 1 1.627 0.003 . 2 . . . . A 6 LYS HD2 . 31255 1
47 . 1 . 1 6 6 LYS HD3 H 1 1.627 0.003 . 2 . . . . A 6 LYS HD3 . 31255 1
48 . 1 . 1 6 6 LYS HE2 H 1 2.950 0.000 . 2 . . . . A 6 LYS HE2 . 31255 1
49 . 1 . 1 6 6 LYS HE3 H 1 2.950 0.000 . 2 . . . . A 6 LYS HE3 . 31255 1
50 . 1 . 1 6 6 LYS HZ1 H 1 7.588 0.000 . 1 . . . . A 6 LYS HZ1 . 31255 1
51 . 1 . 1 6 6 LYS HZ2 H 1 7.588 0.000 . 1 . . . . A 6 LYS HZ2 . 31255 1
52 . 1 . 1 6 6 LYS HZ3 H 1 7.588 0.000 . 1 . . . . A 6 LYS HZ3 . 31255 1
53 . 1 . 1 6 6 LYS CA C 13 55.176 0.000 . 1 . . . . A 6 LYS CA . 31255 1
54 . 1 . 1 6 6 LYS CB C 13 30.021 0.012 . 1 . . . . A 6 LYS CB . 31255 1
55 . 1 . 1 6 6 LYS CG C 13 22.390 0.000 . 1 . . . . A 6 LYS CG . 31255 1
56 . 1 . 1 6 6 LYS CD C 13 26.484 0.000 . 1 . . . . A 6 LYS CD . 31255 1
57 . 1 . 1 6 6 LYS CE C 13 39.428 0.000 . 1 . . . . A 6 LYS CE . 31255 1
58 . 1 . 1 6 6 LYS N N 15 117.480 0.000 . 1 . . . . A 6 LYS N . 31255 1
59 . 1 . 1 7 7 MET H H 1 7.972 0.000 . 1 . . . . A 7 MET H . 31255 1
60 . 1 . 1 7 7 MET HA H 1 4.636 0.000 . 1 . . . . A 7 MET HA . 31255 1
61 . 1 . 1 7 7 MET HB2 H 1 2.128 0.001 . 2 . . . . A 7 MET HB2 . 31255 1
62 . 1 . 1 7 7 MET HB3 H 1 2.128 0.001 . 2 . . . . A 7 MET HB3 . 31255 1
63 . 1 . 1 7 7 MET HG2 H 1 2.533 0.000 . 2 . . . . A 7 MET HG2 . 31255 1
64 . 1 . 1 7 7 MET HG3 H 1 2.533 0.000 . 2 . . . . A 7 MET HG3 . 31255 1
65 . 1 . 1 7 7 MET HE1 H 1 2.120 0.001 . 1 . . . . A 7 MET HE1 . 31255 1
66 . 1 . 1 7 7 MET HE2 H 1 2.120 0.001 . 1 . . . . A 7 MET HE2 . 31255 1
67 . 1 . 1 7 7 MET HE3 H 1 2.120 0.001 . 1 . . . . A 7 MET HE3 . 31255 1
68 . 1 . 1 7 7 MET CA C 13 52.651 0.000 . 1 . . . . A 7 MET CA . 31255 1
69 . 1 . 1 7 7 MET CB C 13 30.840 0.000 . 1 . . . . A 7 MET CB . 31255 1
70 . 1 . 1 7 7 MET CG C 13 29.082 0.000 . 1 . . . . A 7 MET CG . 31255 1
71 . 1 . 1 7 7 MET CE C 13 14.281 0.000 . 1 . . . . A 7 MET CE . 31255 1
72 . 1 . 1 7 7 MET N N 15 116.885 0.000 . 1 . . . . A 7 MET N . 31255 1
73 . 1 . 1 8 8 CYS H H 1 8.579 0.000 . 1 . . . . A 8 CYS H . 31255 1
74 . 1 . 1 8 8 CYS HA H 1 5.111 0.000 . 1 . . . . A 8 CYS HA . 31255 1
75 . 1 . 1 8 8 CYS HB2 H 1 2.998 0.000 . . . . . . A 8 CYS HB2 . 31255 1
76 . 1 . 1 8 8 CYS HB3 H 1 2.823 0.000 . . . . . . A 8 CYS HB3 . 31255 1
77 . 1 . 1 8 8 CYS CA C 13 53.394 0.000 . 1 . . . . A 8 CYS CA . 31255 1
78 . 1 . 1 8 8 CYS CB C 13 44.336 0.009 . 1 . . . . A 8 CYS CB . 31255 1
79 . 1 . 1 8 8 CYS N N 15 119.987 0.000 . 1 . . . . A 8 CYS N . 31255 1
80 . 1 . 1 9 9 HIS H H 1 8.733 0.000 . 1 . . . . A 9 HIS H . 31255 1
81 . 1 . 1 9 9 HIS HA H 1 5.126 0.000 . 1 . . . . A 9 HIS HA . 31255 1
82 . 1 . 1 9 9 HIS HB2 H 1 3.265 0.002 . 2 . . . . A 9 HIS HB2 . 31255 1
83 . 1 . 1 9 9 HIS HB3 H 1 3.265 0.002 . 2 . . . . A 9 HIS HB3 . 31255 1
84 . 1 . 1 9 9 HIS HD2 H 1 7.342 0.000 . 1 . . . . A 9 HIS HD2 . 31255 1
85 . 1 . 1 9 9 HIS CA C 13 50.894 0.000 . 1 . . . . A 9 HIS CA . 31255 1
86 . 1 . 1 9 9 HIS CB C 13 26.146 0.000 . 1 . . . . A 9 HIS CB . 31255 1
87 . 1 . 1 9 9 HIS N N 15 118.428 0.000 . 1 . . . . A 9 HIS N . 31255 1
88 . 1 . 1 10 10 HYP CA C 13 59.631 0.000 . 1 . . . . A 10 HYP CA . 31255 1
89 . 1 . 1 10 10 HYP CB C 13 37.021 0.013 . 1 . . . . A 10 HYP CB . 31255 1
90 . 1 . 1 10 10 HYP CD C 13 55.724 0.000 . 1 . . . . A 10 HYP CD . 31255 1
91 . 1 . 1 10 10 HYP CG C 13 70.333 0.000 . 1 . . . . A 10 HYP CG . 31255 1
92 . 1 . 1 10 10 HYP HA H 1 4.704 0.000 . 1 . . . . A 10 HYP HA . 31255 1
93 . 1 . 1 10 10 HYP HB3 H 1 2.433 0.002 . . . . . . A 10 HYP HB3 . 31255 1
94 . 1 . 1 10 10 HYP HD22 H 1 3.856 0.000 . . . . . . A 10 HYP HD22 . 31255 1
95 . 1 . 1 10 10 HYP HD23 H 1 3.914 0.000 . . . . . . A 10 HYP HD23 . 31255 1
96 . 1 . 1 10 10 HYP HG H 1 4.691 0.000 . 1 . . . . A 10 HYP HG . 31255 1
97 . 1 . 1 11 11 CYS H H 1 8.695 0.000 . 1 . . . . A 11 CYS H . 31255 1
98 . 1 . 1 11 11 CYS HA H 1 4.523 0.000 . 1 . . . . A 11 CYS HA . 31255 1
99 . 1 . 1 11 11 CYS HB2 H 1 3.265 0.000 . . . . . . A 11 CYS HB2 . 31255 1
100 . 1 . 1 11 11 CYS HB3 H 1 3.086 0.000 . . . . . . A 11 CYS HB3 . 31255 1
101 . 1 . 1 11 11 CYS CA C 13 54.437 0.000 . 1 . . . . A 11 CYS CA . 31255 1
102 . 1 . 1 11 11 CYS CB C 13 40.126 0.000 . 1 . . . . A 11 CYS CB . 31255 1
103 . 1 . 1 11 11 CYS N N 15 127.331 0.000 . 1 . . . . A 11 CYS N . 31255 1
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save_