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 36450
_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 $chemical_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' 1 $1H isotropic 36450 1
2 '2D trNOESY' 1 $1H isotropic 36450 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 2 2 ALA H H 1 8.681 0.004 . 1 . . . . A 2 ALA H . 36450 1
2 . 1 . 1 2 2 ALA HA H 1 4.382 0.001 . 1 . . . . A 2 ALA HA . 36450 1
3 . 1 . 1 2 2 ALA HB1 H 1 1.374 0.000 . 1 . . . . A 2 ALA HB1 . 36450 1
4 . 1 . 1 2 2 ALA HB2 H 1 1.374 0.000 . 1 . . . . A 2 ALA HB2 . 36450 1
5 . 1 . 1 2 2 ALA HB3 H 1 1.374 0.000 . 1 . . . . A 2 ALA HB3 . 36450 1
6 . 1 . 1 3 3 ARG H H 1 8.524 0.002 . 1 . . . . A 3 ARG H . 36450 1
7 . 1 . 1 3 3 ARG HA H 1 4.250 0.001 . 1 . . . . A 3 ARG HA . 36450 1
8 . 1 . 1 3 3 ARG HB2 H 1 1.732 0.000 . 2 . . . . A 3 ARG HB2 . 36450 1
9 . 1 . 1 3 3 ARG HB3 H 1 1.732 0.000 . 2 . . . . A 3 ARG HB3 . 36450 1
10 . 1 . 1 3 3 ARG HG2 H 1 1.585 0.002 . 2 . . . . A 3 ARG HG2 . 36450 1
11 . 1 . 1 3 3 ARG HG3 H 1 1.585 0.002 . 2 . . . . A 3 ARG HG3 . 36450 1
12 . 1 . 1 4 4 GLY H H 1 8.460 0.002 . 1 . . . . A 4 GLY H . 36450 1
13 . 1 . 1 4 4 GLY HA2 H 1 3.899 0.003 . 2 . . . . A 4 GLY HA2 . 36450 1
14 . 1 . 1 4 4 GLY HA3 H 1 3.899 0.003 . 2 . . . . A 4 GLY HA3 . 36450 1
15 . 1 . 1 5 5 TRP H H 1 8.094 0.002 . 1 . . . . A 5 TRP H . 36450 1
16 . 1 . 1 5 5 TRP HA H 1 4.648 0.003 . 1 . . . . A 5 TRP HA . 36450 1
17 . 1 . 1 5 5 TRP HB2 H 1 3.337 0.002 . 1 . . . . A 5 TRP HB2 . 36450 1
18 . 1 . 1 5 5 TRP HB3 H 1 3.248 0.002 . 1 . . . . A 5 TRP HB3 . 36450 1
19 . 1 . 1 5 5 TRP HD1 H 1 7.259 0.008 . 1 . . . . A 5 TRP HD1 . 36450 1
20 . 1 . 1 5 5 TRP HE3 H 1 7.626 0.003 . 1 . . . . A 5 TRP HE3 . 36450 1
21 . 1 . 1 5 5 TRP HZ2 H 1 7.504 0.001 . 1 . . . . A 5 TRP HZ2 . 36450 1
22 . 1 . 1 5 5 TRP HZ3 H 1 7.195 0.001 . 1 . . . . A 5 TRP HZ3 . 36450 1
23 . 1 . 1 5 5 TRP HH2 H 1 7.165 0.000 . 1 . . . . A 5 TRP HH2 . 36450 1
24 . 1 . 1 6 6 GLY H H 1 8.339 0.002 . 1 . . . . A 6 GLY H . 36450 1
25 . 1 . 1 6 6 GLY HA2 H 1 3.816 0.005 . 2 . . . . A 6 GLY HA2 . 36450 1
26 . 1 . 1 6 6 GLY HA3 H 1 3.816 0.005 . 2 . . . . A 6 GLY HA3 . 36450 1
27 . 1 . 1 7 7 ARG H H 1 8.091 0.001 . 1 . . . . A 7 ARG H . 36450 1
28 . 1 . 1 7 7 ARG HA H 1 4.257 0.004 . 1 . . . . A 7 ARG HA . 36450 1
29 . 1 . 1 7 7 ARG HB2 H 1 1.815 0.000 . 1 . . . . A 7 ARG HB2 . 36450 1
30 . 1 . 1 7 7 ARG HB3 H 1 1.709 0.000 . 1 . . . . A 7 ARG HB3 . 36450 1
31 . 1 . 1 7 7 ARG HG2 H 1 1.586 0.000 . 2 . . . . A 7 ARG HG2 . 36450 1
32 . 1 . 1 7 7 ARG HG3 H 1 1.586 0.000 . 2 . . . . A 7 ARG HG3 . 36450 1
33 . 1 . 1 8 8 LYS H H 1 8.456 0.002 . 1 . . . . A 8 LYS H . 36450 1
34 . 1 . 1 8 8 LYS HA H 1 4.318 0.002 . 1 . . . . A 8 LYS HA . 36450 1
35 . 1 . 1 8 8 LYS HB2 H 1 1.818 0.002 . 1 . . . . A 8 LYS HB2 . 36450 1
36 . 1 . 1 8 8 LYS HB3 H 1 1.745 0.000 . 1 . . . . A 8 LYS HB3 . 36450 1
37 . 1 . 1 8 8 LYS HG2 H 1 1.433 0.000 . 2 . . . . A 8 LYS HG2 . 36450 1
38 . 1 . 1 8 8 LYS HG3 H 1 1.433 0.000 . 2 . . . . A 8 LYS HG3 . 36450 1
39 . 1 . 1 8 8 LYS HD2 H 1 1.648 0.000 . 2 . . . . A 8 LYS HD2 . 36450 1
40 . 1 . 1 8 8 LYS HD3 H 1 1.648 0.000 . 2 . . . . A 8 LYS HD3 . 36450 1
41 . 1 . 1 9 9 CYS H H 1 8.387 0.004 . 1 . . . . A 9 CYS H . 36450 1
42 . 1 . 1 9 9 CYS HA H 1 4.731 0.000 . 1 . . . . A 9 CYS HA . 36450 1
43 . 1 . 1 9 9 CYS HB2 H 1 2.876 0.000 . 2 . . . . A 9 CYS HB2 . 36450 1
44 . 1 . 1 9 9 CYS HB3 H 1 2.876 0.000 . 2 . . . . A 9 CYS HB3 . 36450 1
45 . 1 . 1 10 10 PRO HA H 1 4.347 0.000 . 1 . . . . A 10 PRO HA . 36450 1
46 . 1 . 1 10 10 PRO HB2 H 1 2.193 0.000 . 1 . . . . A 10 PRO HB2 . 36450 1
47 . 1 . 1 10 10 PRO HG2 H 1 1.761 0.000 . 2 . . . . A 10 PRO HG2 . 36450 1
48 . 1 . 1 10 10 PRO HG3 H 1 1.761 0.000 . 2 . . . . A 10 PRO HG3 . 36450 1
49 . 1 . 1 10 10 PRO HD2 H 1 3.699 0.000 . 2 . . . . A 10 PRO HD2 . 36450 1
50 . 1 . 1 10 10 PRO HD3 H 1 3.699 0.000 . 2 . . . . A 10 PRO HD3 . 36450 1
51 . 1 . 1 11 11 LEU H H 1 8.174 0.001 . 1 . . . . A 11 LEU H . 36450 1
52 . 1 . 1 11 11 LEU HA H 1 4.250 0.004 . 1 . . . . A 11 LEU HA . 36450 1
53 . 1 . 1 11 11 LEU HB2 H 1 1.530 0.000 . 2 . . . . A 11 LEU HB2 . 36450 1
54 . 1 . 1 11 11 LEU HB3 H 1 1.530 0.000 . 2 . . . . A 11 LEU HB3 . 36450 1
55 . 1 . 1 11 11 LEU HG H 1 1.425 0.000 . 1 . . . . A 11 LEU HG . 36450 1
56 . 1 . 1 11 11 LEU HD11 H 1 0.877 0.000 . 2 . . . . A 11 LEU HD11 . 36450 1
57 . 1 . 1 11 11 LEU HD12 H 1 0.877 0.000 . 2 . . . . A 11 LEU HD12 . 36450 1
58 . 1 . 1 11 11 LEU HD13 H 1 0.877 0.000 . 2 . . . . A 11 LEU HD13 . 36450 1
59 . 1 . 1 11 11 LEU HD21 H 1 0.877 0.000 . 2 . . . . A 11 LEU HD21 . 36450 1
60 . 1 . 1 11 11 LEU HD22 H 1 0.877 0.000 . 2 . . . . A 11 LEU HD22 . 36450 1
61 . 1 . 1 11 11 LEU HD23 H 1 0.877 0.000 . 2 . . . . A 11 LEU HD23 . 36450 1
62 . 1 . 1 12 12 PHE H H 1 8.169 0.010 . 1 . . . . A 12 PHE H . 36450 1
63 . 1 . 1 12 12 PHE HA H 1 4.635 0.000 . 1 . . . . A 12 PHE HA . 36450 1
64 . 1 . 1 12 12 PHE HB2 H 1 3.162 0.002 . 1 . . . . A 12 PHE HB2 . 36450 1
65 . 1 . 1 12 12 PHE HB3 H 1 3.037 0.005 . 1 . . . . A 12 PHE HB3 . 36450 1
66 . 1 . 1 12 12 PHE HD1 H 1 7.262 0.007 . 1 . . . . A 12 PHE HD1 . 36450 1
67 . 1 . 1 12 12 PHE HD2 H 1 7.262 0.007 . 1 . . . . A 12 PHE HD2 . 36450 1
68 . 1 . 1 12 12 PHE HE1 H 1 7.351 0.002 . 1 . . . . A 12 PHE HE1 . 36450 1
69 . 1 . 1 12 12 PHE HE2 H 1 7.351 0.002 . 1 . . . . A 12 PHE HE2 . 36450 1
70 . 1 . 1 12 12 PHE HZ H 1 7.306 0.001 . 1 . . . . A 12 PHE HZ . 36450 1
71 . 1 . 1 13 13 GLY H H 1 8.358 0.002 . 1 . . . . A 13 GLY H . 36450 1
72 . 1 . 1 13 13 GLY HA2 H 1 3.890 0.001 . 2 . . . . A 13 GLY HA2 . 36450 1
73 . 1 . 1 13 13 GLY HA3 H 1 3.890 0.001 . 2 . . . . A 13 GLY HA3 . 36450 1
74 . 1 . 1 14 14 LYS H H 1 8.225 0.004 . 1 . . . . A 14 LYS H . 36450 1
75 . 1 . 1 14 14 LYS HA H 1 4.300 0.000 . 1 . . . . A 14 LYS HA . 36450 1
76 . 1 . 1 14 14 LYS HB2 H 1 1.839 0.002 . 1 . . . . A 14 LYS HB2 . 36450 1
77 . 1 . 1 14 14 LYS HB3 H 1 1.746 0.000 . 1 . . . . A 14 LYS HB3 . 36450 1
78 . 1 . 1 14 14 LYS HG2 H 1 1.421 0.000 . 2 . . . . A 14 LYS HG2 . 36450 1
79 . 1 . 1 14 14 LYS HG3 H 1 1.421 0.000 . 2 . . . . A 14 LYS HG3 . 36450 1
80 . 1 . 1 15 15 ASN H H 1 8.512 0.003 . 1 . . . . A 15 ASN H . 36450 1
81 . 1 . 1 15 15 ASN HA H 1 4.674 0.003 . 1 . . . . A 15 ASN HA . 36450 1
82 . 1 . 1 15 15 ASN HB2 H 1 2.838 0.000 . 1 . . . . A 15 ASN HB2 . 36450 1
83 . 1 . 1 15 15 ASN HB3 H 1 2.771 0.000 . 1 . . . . A 15 ASN HB3 . 36450 1
84 . 1 . 1 16 16 LYS H H 1 8.323 0.007 . 1 . . . . A 16 LYS H . 36450 1
85 . 1 . 1 16 16 LYS HA H 1 4.341 0.002 . 1 . . . . A 16 LYS HA . 36450 1
86 . 1 . 1 16 16 LYS HB2 H 1 1.869 0.002 . 1 . . . . A 16 LYS HB2 . 36450 1
87 . 1 . 1 16 16 LYS HB3 H 1 1.755 0.002 . 1 . . . . A 16 LYS HB3 . 36450 1
88 . 1 . 1 16 16 LYS HG2 H 1 1.421 0.000 . 2 . . . . A 16 LYS HG2 . 36450 1
89 . 1 . 1 16 16 LYS HG3 H 1 1.421 0.000 . 2 . . . . A 16 LYS HG3 . 36450 1
90 . 1 . 1 16 16 LYS HD2 H 1 1.674 0.000 . 2 . . . . A 16 LYS HD2 . 36450 1
91 . 1 . 1 16 16 LYS HD3 H 1 1.674 0.000 . 2 . . . . A 16 LYS HD3 . 36450 1
92 . 1 . 1 17 17 SER H H 1 8.406 0.000 . 1 . . . . A 17 SER H . 36450 1
93 . 1 . 1 17 17 SER HA H 1 4.431 0.003 . 1 . . . . A 17 SER HA . 36450 1
94 . 1 . 1 17 17 SER HB2 H 1 3.879 0.000 . 2 . . . . A 17 SER HB2 . 36450 1
95 . 1 . 1 17 17 SER HB3 H 1 3.879 0.000 . 2 . . . . A 17 SER HB3 . 36450 1
96 . 1 . 1 18 18 ARG H H 1 8.001 0.002 . 1 . . . . A 18 ARG H . 36450 1
97 . 1 . 1 18 18 ARG HA H 1 4.163 0.000 . 1 . . . . A 18 ARG HA . 36450 1
98 . 1 . 1 18 18 ARG HB2 H 1 1.853 0.000 . 1 . . . . A 18 ARG HB2 . 36450 1
99 . 1 . 1 18 18 ARG HB3 H 1 1.722 0.000 . 1 . . . . A 18 ARG HB3 . 36450 1
100 . 1 . 1 18 18 ARG HG2 H 1 1.588 0.000 . 2 . . . . A 18 ARG HG2 . 36450 1
101 . 1 . 1 18 18 ARG HG3 H 1 1.588 0.000 . 2 . . . . A 18 ARG HG3 . 36450 1
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save_