Content for NMR-STAR saveframe, "assigned_chem_shift_list_1"
save_assigned_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 26798
_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 $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 NOESY' . . . 26798 1
2 '2D 1H-1H TOCSY' . . . 26798 1
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_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
4 $CARA . . 26798 1
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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.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 ALA HA H 1 3.901 0.000 . . . . . . 1 ALA HA . 26798 1
2 . 1 1 1 1 ALA HB1 H 1 1.293 0.000 . . . . . . 1 ALA HB2 . 26798 1
3 . 1 1 1 1 ALA HB2 H 1 1.293 0.000 . . . . . . 1 ALA HB2 . 26798 1
4 . 1 1 1 1 ALA HB3 H 1 1.293 0.000 . . . . . . 1 ALA HB2 . 26798 1
5 . 1 1 2 2 GLY H H 1 8.501 0.002 . . . . . . 2 GLY HN . 26798 1
6 . 1 1 2 2 GLY HA2 H 1 3.761 0.001 . . . . . . 2 GLY HA1 . 26798 1
7 . 1 1 3 3 CYS H H 1 8.274 0.000 . . . . . . 3 CYS HN . 26798 1
8 . 1 1 3 3 CYS HA H 1 4.389 0.000 . . . . . . 3 CYS HA . 26798 1
9 . 1 1 3 3 CYS HB2 H 1 2.921 0.001 . . . . . . 3 CYS HB2 . 26798 1
10 . 1 1 3 3 CYS HB3 H 1 2.708 0.003 . . . . . . 3 CYS HB3 . 26798 1
11 . 1 1 4 4 LYS H H 1 8.388 0.000 . . . . . . 4 LYS HN . 26798 1
12 . 1 1 4 4 LYS HA H 1 4.411 0.005 . . . . . . 4 LYS HA . 26798 1
13 . 1 1 4 4 LYS HB2 H 1 1.386 0.003 . . . . . . 4 LYS HB2 . 26798 1
14 . 1 1 4 4 LYS HB3 H 1 1.281 0.004 . . . . . . 4 LYS HB3 . 26798 1
15 . 1 1 4 4 LYS HG2 H 1 1.105 0.005 . . . . . . 4 LYS HG2 . 26798 1
16 . 1 1 4 4 LYS HG3 H 1 0.970 0.001 . . . . . . 4 LYS HG3 . 26798 1
17 . 1 1 4 4 LYS HD2 H 1 1.237 0.009 . . . . . . 4 LYS HD2 . 26798 1
18 . 1 1 4 4 LYS HE2 H 1 2.556 0.002 . . . . . . 4 LYS HE2 . 26798 1
19 . 1 1 5 5 ASN H H 1 8.275 0.001 . . . . . . 5 ASN HN . 26798 1
20 . 1 1 5 5 ASN HA H 1 4.575 0.005 . . . . . . 5 ASN HA . 26798 1
21 . 1 1 5 5 ASN HB2 H 1 2.435 0.002 . . . . . . 5 ASN HB2 . 26798 1
22 . 1 1 5 5 ASN HB3 H 1 2.305 0.004 . . . . . . 5 ASN HB3 . 26798 1
23 . 1 1 5 5 ASN HD21 H 1 7.352 0.003 . . . . . . 5 ASN HD21 . 26798 1
24 . 1 1 5 5 ASN HD22 H 1 6.751 0.004 . . . . . . 5 ASN HD22 . 26798 1
25 . 1 1 6 6 PHE H H 1 8.146 0.002 . . . . . . 6 PHE HN . 26798 1
26 . 1 1 6 6 PHE HA H 1 4.569 0.002 . . . . . . 6 PHE HA . 26798 1
27 . 1 1 6 6 PHE HB2 H 1 2.696 0.002 . . . . . . 6 PHE HB2 . 26798 1
28 . 1 1 6 6 PHE HB3 H 1 2.569 0.001 . . . . . . 6 PHE HB3 . 26798 1
29 . 1 1 6 6 PHE HD1 H 1 6.767 0.004 . . . . . . 6 PHE QD . 26798 1
30 . 1 1 6 6 PHE HD2 H 1 6.767 0.004 . . . . . . 6 PHE QD . 26798 1
31 . 1 1 6 6 PHE HE1 H 1 6.945 0.000 . . . . . . 6 PHE QE . 26798 1
32 . 1 1 6 6 PHE HE2 H 1 6.945 0.000 . . . . . . 6 PHE QE . 26798 1
33 . 1 1 6 6 PHE HZ H 1 6.884 0.004 . . . . . . 6 PHE HZ . 26798 1
34 . 1 1 7 7 X HA H 1 4.383 0.004 . . . . . . 7 MSA HA . 26798 1
35 . 1 1 7 7 X HB2 H 1 2.795 0.002 . . . . . . 7 MSA HB2 . 26798 1
36 . 1 1 7 7 X HN H 1 8.188 0.003 . . . . . . 7 MSA HN . 26798 1
37 . 1 1 7 7 X QE H 1 6.659 0.001 . . . . . . 7 MSA QE . 26798 1
38 . 1 1 7 7 X QH H 1 1.929 0.002 . . . . . . 7 MSA QH . 26798 1
39 . 1 1 7 7 X QQF H 1 2.028 0.001 . . . . . . 7 MSA QQF . 26798 1
40 . 1 1 8 8 DTR HA H 1 4.284 0.002 . . . . . . 8 DTR HA . 26798 1
41 . 1 1 8 8 DTR HB2 H 1 2.841 0.001 . . . . . . 8 DTR HB2 . 26798 1
42 . 1 1 8 8 DTR HD1 H 1 6.872 0.000 . . . . . . 8 DTR HD1 . 26798 1
43 . 1 1 8 8 DTR HE1 H 1 10.016 0.001 . . . . . . 8 DTR HE1 . 26798 1
44 . 1 1 8 8 DTR HE3 H 1 6.702 1.685 . . . . . . 8 DTR HE3 . 26798 1
45 . 1 1 8 8 DTR HZ2 H 1 7.260 0.002 . . . . . . 8 DTR HZ2 . 26798 1
46 . 1 1 8 8 DTR HZ3 H 1 6.919 0.001 . . . . . . 8 DTR HZ3 . 26798 1
47 . 1 1 8 8 DTR HH2 H 1 7.004 0.002 . . . . . . 8 DTR HH2 . 26798 1
48 . 1 1 8 8 DTR HN H 1 8.240 0.001 . . . . . . 8 DTR HN . 26798 1
49 . 1 1 9 9 LYS H H 1 8.108 0.001 . . . . . . 9 LYS HN . 26798 1
50 . 1 1 9 9 LYS HA H 1 3.911 0.002 . . . . . . 9 LYS HA . 26798 1
51 . 1 1 9 9 LYS HB2 H 1 1.391 0.003 . . . . . . 9 LYS HB2 . 26798 1
52 . 1 1 9 9 LYS HB3 H 1 1.000 0.001 . . . . . . 9 LYS HB3 . 26798 1
53 . 1 1 9 9 LYS HG2 H 1 0.295 0.001 . . . . . . 9 LYS HG2 . 26798 1
54 . 1 1 9 9 LYS HG3 H 1 0.093 0.001 . . . . . . 9 LYS HG3 . 26798 1
55 . 1 1 9 9 LYS HD2 H 1 1.089 0.002 . . . . . . 9 LYS HD2 . 26798 1
56 . 1 1 9 9 LYS HE2 H 1 2.455 0.004 . . . . . . 9 LYS HE2 . 26798 1
57 . 1 1 9 9 LYS HE3 H 1 2.375 0.001 . . . . . . 9 LYS HE3 . 26798 1
58 . 1 1 10 10 THR H H 1 7.872 0.002 . . . . . . 10 THR HN . 26798 1
59 . 1 1 10 10 THR HA H 1 4.188 0.000 . . . . . . 10 THR HA . 26798 1
60 . 1 1 10 10 THR HB H 1 3.977 0.006 . . . . . . 10 THR HB . 26798 1
61 . 1 1 10 10 THR HG21 H 1 0.916 0.001 . . . . . . 10 THR QG2 . 26798 1
62 . 1 1 10 10 THR HG22 H 1 0.916 0.001 . . . . . . 10 THR QG2 . 26798 1
63 . 1 1 10 10 THR HG23 H 1 0.916 0.001 . . . . . . 10 THR QG2 . 26798 1
64 . 1 1 11 11 WFP HA H 1 4.895 0.002 . . . . . . 11 WFP HA . 26798 1
65 . 1 1 11 11 WFP HB2 H 1 2.474 0.001 . . . . . . 11 WFP HB2 . 26798 1
66 . 1 1 11 11 WFP HB3 H 1 2.425 0.000 . . . . . . 11 WFP HB3 . 26798 1
67 . 1 1 11 11 WFP HZ H 1 6.542 0.004 . . . . . . 11 WFP HZ . 26798 1
68 . 1 1 11 11 WFP HN H 1 8.277 0.004 . . . . . . 11 WFP HN . 26798 1
69 . 1 1 11 11 WFP HD1 H 1 6.360 0.000 . . . . . . 11 WFP QD . 26798 1
70 . 1 1 12 12 THR H H 1 8.291 0.000 . . . . . . 12 THR HN . 26798 1
71 . 1 1 12 12 THR HA H 1 4.239 0.001 . . . . . . 12 THR HA . 26798 1
72 . 1 1 12 12 THR HB H 1 3.988 0.001 . . . . . . 12 THR HB . 26798 1
73 . 1 1 12 12 THR HG21 H 1 0.934 0.001 . . . . . . 12 THR QG2 . 26798 1
74 . 1 1 12 12 THR HG22 H 1 0.934 0.001 . . . . . . 12 THR QG2 . 26798 1
75 . 1 1 12 12 THR HG23 H 1 0.934 0.001 . . . . . . 12 THR QG2 . 26798 1
76 . 1 1 13 13 SER H H 1 8.259 0.000 . . . . . . 13 SER HN . 26798 1
77 . 1 1 13 13 SER HA H 1 4.382 0.002 . . . . . . 13 SER HA . 26798 1
78 . 1 1 13 13 SER HB2 H 1 3.695 0.004 . . . . . . 13 SER HB2 . 26798 1
79 . 1 1 14 14 CYS H H 1 7.954 0.001 . . . . . . 14 CYS HN . 26798 1
80 . 1 1 14 14 CYS HA H 1 4.218 0.001 . . . . . . 14 CYS HA . 26798 1
81 . 1 1 14 14 CYS HB2 H 1 2.976 0.001 . . . . . . 14 CYS HB2 . 26798 1
82 . 1 1 14 14 CYS HB3 H 1 2.906 0.003 . . . . . . 14 CYS HB3 . 26798 1
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