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 30490
_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 1H-1H TOCSY' . . . 30490 1
2 '2D 1H-1H NOESY' . . . 30490 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 GLY H H 1 8.224 0.00 . . . . . . A 1 GLY H1 . 30490 1
2 . 1 1 1 1 GLY HA2 H 1 3.738 0.00 . . . . . . A 1 GLY HA2 . 30490 1
3 . 1 1 1 1 GLY HA3 H 1 3.995 0.00 . . . . . . A 1 GLY HA3 . 30490 1
4 . 1 1 2 2 SER H H 1 8.067 0.00 . . . . . . A 2 SER H . 30490 1
5 . 1 1 2 2 SER HA H 1 4.355 0.00 . . . . . . A 2 SER HA . 30490 1
6 . 1 1 2 2 SER HB2 H 1 3.841 0.00 . . . . . . A 2 SER HB2 . 30490 1
7 . 1 1 2 2 SER HB3 H 1 3.904 0.00 . . . . . . A 2 SER HB3 . 30490 1
8 . 1 1 3 3 ARG H H 1 8.061 0.00 . . . . . . A 3 ARG H . 30490 1
9 . 1 1 3 3 ARG HA H 1 4.308 0.00 . . . . . . A 3 ARG HA . 30490 1
10 . 1 1 3 3 ARG HB2 H 1 1.646 0.00 . . . . . . A 3 ARG HB2 . 30490 1
11 . 1 1 3 3 ARG HG2 H 1 1.425 0.00 . . . . . . A 3 ARG HG2 . 30490 1
12 . 1 1 3 3 ARG HG3 H 1 1.531 0.00 . . . . . . A 3 ARG HG3 . 30490 1
13 . 1 1 3 3 ARG HD2 H 1 3.103 0.00 . . . . . . A 3 ARG HD2 . 30490 1
14 . 1 1 3 3 ARG HD3 H 1 3.103 0.00 . . . . . . A 3 ARG HD3 . 30490 1
15 . 1 1 4 4 ARG H H 1 8.248 0.00 . . . . . . A 4 ARG H . 30490 1
16 . 1 1 4 4 ARG HA H 1 4.593 0.00 . . . . . . A 4 ARG HA . 30490 1
17 . 1 1 4 4 ARG HB2 H 1 1.451 0.00 . . . . . . A 4 ARG HB2 . 30490 1
18 . 1 1 4 4 ARG HG2 H 1 1.199 0.00 . . . . . . A 4 ARG HG2 . 30490 1
19 . 1 1 4 4 ARG HG3 H 1 1.315 0.00 . . . . . . A 4 ARG HG3 . 30490 1
20 . 1 1 4 4 ARG HD2 H 1 2.950 0.00 . . . . . . A 4 ARG HD2 . 30490 1
21 . 1 1 4 4 ARG HD3 H 1 2.950 0.00 . . . . . . A 4 ARG HD3 . 30490 1
22 . 1 1 5 5 PHE H H 1 8.551 0.00 . . . . . . A 5 PHE H . 30490 1
23 . 1 1 5 5 PHE HA H 1 4.710 0.00 . . . . . . A 5 PHE HA . 30490 1
24 . 1 1 5 5 PHE HB2 H 1 2.862 0.00 . . . . . . A 5 PHE HB2 . 30490 1
25 . 1 1 5 5 PHE HB3 H 1 2.934 0.00 . . . . . . A 5 PHE HB3 . 30490 1
26 . 1 1 6 6 ARG H H 1 8.217 0.00 . . . . . . A 6 ARG H . 30490 1
27 . 1 1 6 6 ARG HA H 1 4.740 0.00 . . . . . . A 6 ARG HA . 30490 1
28 . 1 1 6 6 ARG HB2 H 1 1.535 0.00 . . . . . . A 6 ARG HB2 . 30490 1
29 . 1 1 6 6 ARG HB3 H 1 1.669 0.00 . . . . . . A 6 ARG HB3 . 30490 1
30 . 1 1 6 6 ARG HG2 H 1 1.384 0.00 . . . . . . A 6 ARG HG2 . 30490 1
31 . 1 1 6 6 ARG HG3 H 1 1.451 0.00 . . . . . . A 6 ARG HG3 . 30490 1
32 . 1 1 6 6 ARG HD2 H 1 3.055 0.00 . . . . . . A 6 ARG HD2 . 30490 1
33 . 1 1 6 6 ARG HD3 H 1 3.055 0.00 . . . . . . A 6 ARG HD3 . 30490 1
34 . 1 1 7 7 PHE H H 1 8.764 0.00 . . . . . . A 7 PHE H . 30490 1
35 . 1 1 7 7 PHE HA H 1 5.026 0.00 . . . . . . A 7 PHE HA . 30490 1
36 . 1 1 7 7 PHE HB2 H 1 2.785 0.00 . . . . . . A 7 PHE HB2 . 30490 1
37 . 1 1 7 7 PHE HB3 H 1 2.989 0.00 . . . . . . A 7 PHE HB3 . 30490 1
38 . 1 1 8 8 DPR HA H 1 4.590 0.00 . . . . . . A 8 DPR HA . 30490 1
39 . 1 1 8 8 DPR HB2 H 1 2.168 0.00 . . . . . . A 8 DPR HB2 . 30490 1
40 . 1 1 8 8 DPR HD2 H 1 3.402 0.00 . . . . . . A 8 DPR HD2 . 30490 1
41 . 1 1 8 8 DPR HD3 H 1 3.542 0.00 . . . . . . A 8 DPR HD3 . 30490 1
42 . 1 1 8 8 DPR HG2 H 1 1.809 0.00 . . . . . . A 8 DPR HG2 . 30490 1
43 . 1 1 9 9 PRO HA H 1 4.437 0.00 . . . . . . A 9 PRO HA . 30490 1
44 . 1 1 9 9 PRO HB2 H 1 2.183 0.00 . . . . . . A 9 PRO HB2 . 30490 1
45 . 1 1 9 9 PRO HG2 H 1 1.877 0.00 . . . . . . A 9 PRO HG2 . 30490 1
46 . 1 1 9 9 PRO HD2 H 1 3.634 0.00 . . . . . . A 9 PRO HD2 . 30490 1
47 . 1 1 9 9 PRO HD3 H 1 3.911 0.00 . . . . . . A 9 PRO HD3 . 30490 1
48 . 1 1 10 10 LYS H H 1 7.744 0.00 . . . . . . A 10 LYS H . 30490 1
49 . 1 1 10 10 LYS HA H 1 4.389 0.00 . . . . . . A 10 LYS HA . 30490 1
50 . 1 1 10 10 LYS HB2 H 1 1.846 0.00 . . . . . . A 10 LYS HB2 . 30490 1
51 . 1 1 10 10 LYS HB3 H 1 1.846 0.00 . . . . . . A 10 LYS HB3 . 30490 1
52 . 1 1 10 10 LYS HG2 H 1 1.333 0.00 . . . . . . A 10 LYS HG2 . 30490 1
53 . 1 1 10 10 LYS HG3 H 1 1.410 0.00 . . . . . . A 10 LYS HG3 . 30490 1
54 . 1 1 10 10 LYS HD2 H 1 1.645 0.00 . . . . . . A 10 LYS HD2 . 30490 1
55 . 1 1 10 10 LYS HD3 H 1 1.645 0.00 . . . . . . A 10 LYS HD3 . 30490 1
56 . 1 1 10 10 LYS HE2 H 1 2.924 0.00 . . . . . . A 10 LYS HE2 . 30490 1
57 . 1 1 10 10 LYS HE3 H 1 2.924 0.00 . . . . . . A 10 LYS HE3 . 30490 1
58 . 1 1 11 11 ILE H H 1 8.215 0.00 . . . . . . A 11 ILE H . 30490 1
59 . 1 1 11 11 ILE HA H 1 4.421 0.00 . . . . . . A 11 ILE HA . 30490 1
60 . 1 1 11 11 ILE HB H 1 1.643 0.00 . . . . . . A 11 ILE HB . 30490 1
61 . 1 1 11 11 ILE HG12 H 1 0.942 0.00 . . . . . . A 11 ILE HG12 . 30490 1
62 . 1 1 11 11 ILE HG13 H 1 1.403 0.00 . . . . . . A 11 ILE HG13 . 30490 1
63 . 1 1 11 11 ILE HG21 H 1 0.722 0.00 . . . . . . A 11 ILE HG21 . 30490 1
64 . 1 1 11 11 ILE HG22 H 1 0.722 0.00 . . . . . . A 11 ILE HG22 . 30490 1
65 . 1 1 11 11 ILE HG23 H 1 0.722 0.00 . . . . . . A 11 ILE HG23 . 30490 1
66 . 1 1 11 11 ILE HD11 H 1 0.513 0.00 . . . . . . A 11 ILE HD11 . 30490 1
67 . 1 1 11 11 ILE HD12 H 1 0.513 0.00 . . . . . . A 11 ILE HD12 . 30490 1
68 . 1 1 11 11 ILE HD13 H 1 0.513 0.00 . . . . . . A 11 ILE HD13 . 30490 1
69 . 1 1 12 12 ILE H H 1 8.628 0.00 . . . . . . A 12 ILE H . 30490 1
70 . 1 1 12 12 ILE HA H 1 4.294 0.00 . . . . . . A 12 ILE HA . 30490 1
71 . 1 1 12 12 ILE HB H 1 1.611 0.00 . . . . . . A 12 ILE HB . 30490 1
72 . 1 1 12 12 ILE HG12 H 1 1.048 0.00 . . . . . . A 12 ILE HG12 . 30490 1
73 . 1 1 12 12 ILE HG13 H 1 1.235 0.00 . . . . . . A 12 ILE HG13 . 30490 1
74 . 1 1 12 12 ILE HG21 H 1 0.794 0.00 . . . . . . A 12 ILE HG21 . 30490 1
75 . 1 1 12 12 ILE HG22 H 1 0.794 0.00 . . . . . . A 12 ILE HG22 . 30490 1
76 . 1 1 12 12 ILE HG23 H 1 0.794 0.00 . . . . . . A 12 ILE HG23 . 30490 1
77 . 1 1 12 12 ILE HD11 H 1 0.685 0.00 . . . . . . A 12 ILE HD11 . 30490 1
78 . 1 1 12 12 ILE HD12 H 1 0.685 0.00 . . . . . . A 12 ILE HD12 . 30490 1
79 . 1 1 12 12 ILE HD13 H 1 0.685 0.00 . . . . . . A 12 ILE HD13 . 30490 1
80 . 1 1 13 13 PHE H H 1 8.474 0.00 . . . . . . A 13 PHE H . 30490 1
81 . 1 1 13 13 PHE HA H 1 4.936 0.00 . . . . . . A 13 PHE HA . 30490 1
82 . 1 1 13 13 PHE HB2 H 1 2.906 0.00 . . . . . . A 13 PHE HB2 . 30490 1
83 . 1 1 13 13 PHE HB3 H 1 3.039 0.01 . . . . . . A 13 PHE HB3 . 30490 1
84 . 1 1 14 14 ASN H H 1 8.469 0.00 . . . . . . A 14 ASN H . 30490 1
85 . 1 1 14 14 ASN HA H 1 4.705 0.00 . . . . . . A 14 ASN HA . 30490 1
86 . 1 1 14 14 ASN HB2 H 1 2.801 0.00 . . . . . . A 14 ASN HB2 . 30490 1
87 . 1 1 14 14 ASN HB3 H 1 2.875 0.00 . . . . . . A 14 ASN HB3 . 30490 1
88 . 1 1 14 14 ASN HD21 H 1 7.590 0.00 . . . . . . A 14 ASN HD21 . 30490 1
89 . 1 1 14 14 ASN HD22 H 1 6.829 0.00 . . . . . . A 14 ASN HD22 . 30490 1
90 . 1 1 15 15 GLN H H 1 8.015 0.00 . . . . . . A 15 GLN H . 30490 1
91 . 1 1 15 15 GLN HA H 1 4.318 0.00 . . . . . . A 15 GLN HA . 30490 1
92 . 1 1 15 15 GLN HE21 H 1 6.807 0.00 . . . . . . A 15 GLN HE21 . 30490 1
93 . 1 1 15 15 GLN HE22 H 1 7.465 0.00 . . . . . . A 15 GLN HE22 . 30490 1
94 . 1 1 16 16 ARG H H 1 8.257 0.00 . . . . . . A 16 ARG H . 30490 1
95 . 1 1 16 16 ARG HA H 1 4.174 0.00 . . . . . . A 16 ARG HA . 30490 1
96 . 1 1 16 16 ARG HB2 H 1 1.740 0.00 . . . . . . A 16 ARG HB2 . 30490 1
97 . 1 1 16 16 ARG HB3 H 1 1.835 0.00 . . . . . . A 16 ARG HB3 . 30490 1
98 . 1 1 16 16 ARG HG2 H 1 1.575 0.00 . . . . . . A 16 ARG HG2 . 30490 1
99 . 1 1 16 16 ARG HD2 H 1 3.136 0.00 . . . . . . A 16 ARG HD2 . 30490 1
100 . 1 1 16 16 ARG HD3 H 1 3.136 0.00 . . . . . . A 16 ARG HD3 . 30490 1
stop_
save_