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 26795
_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' . . . 26795 1
2 '2D 1H-1H TOCSY' . . . 26795 1
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loop_
_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 . . 26795 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 HB1 H 1 1.296 0.002 . . . . . . 1 ALA QB . 26795 1
2 . 1 1 1 1 ALA HB2 H 1 1.296 0.002 . . . . . . 1 ALA QB . 26795 1
3 . 1 1 1 1 ALA HB3 H 1 1.296 0.002 . . . . . . 1 ALA QB . 26795 1
4 . 1 1 1 1 ALA H H 1 7.905 0.002 . . . . . . 1 ALA HN . 26795 1
5 . 1 1 1 1 ALA HA H 1 3.889 0.000 . . . . . . 1 ALA HA . 26795 1
6 . 1 1 2 2 GLY H H 1 8.466 0.001 . . . . . . 2 GLY HN . 26795 1
7 . 1 1 2 2 GLY HA2 H 1 3.753 0.000 . . . . . . 2 GLY QA . 26795 1
8 . 1 1 2 2 GLY HA3 H 1 3.753 0.000 . . . . . . 2 GLY QA . 26795 1
9 . 1 1 3 3 CYS H H 1 8.279 0.001 . . . . . . 3 CYS HN . 26795 1
10 . 1 1 3 3 CYS HA H 1 4.407 0.001 . . . . . . 3 CYS HA . 26795 1
11 . 1 1 3 3 CYS HB2 H 1 2.887 0.001 . . . . . . 3 CYS HB2 . 26795 1
12 . 1 1 3 3 CYS HB3 H 1 2.726 0.000 . . . . . . 3 CYS HB3 . 26795 1
13 . 1 1 4 4 LYS H H 1 8.412 0.001 . . . . . . 4 LYS HN . 26795 1
14 . 1 1 4 4 LYS HA H 1 4.270 0.002 . . . . . . 4 LYS HA . 26795 1
15 . 1 1 4 4 LYS HB2 H 1 1.402 0.003 . . . . . . 4 LYS HB2 . 26795 1
16 . 1 1 4 4 LYS HB3 H 1 1.008 0.001 . . . . . . 4 LYS HB3 . 26795 1
17 . 1 1 4 4 LYS HG2 H 1 1.096 0.001 . . . . . . 4 LYS HG2 . 26795 1
18 . 1 1 4 4 LYS HG3 H 1 1.006 0.001 . . . . . . 4 LYS HG3 . 26795 1
19 . 1 1 4 4 LYS HD2 H 1 1.256 0.001 . . . . . . 4 LYS HD2 . 26795 1
20 . 1 1 4 4 LYS HD3 H 1 1.198 0.000 . . . . . . 4 LYS HD3 . 26795 1
21 . 1 1 4 4 LYS HE2 H 1 2.562 0.002 . . . . . . 4 LYS HE2 . 26795 1
22 . 1 1 4 4 LYS HZ1 H 1 7.226 0.002 . . . . . . 4 LYS HZ2 . 26795 1
23 . 1 1 4 4 LYS HZ2 H 1 7.226 0.002 . . . . . . 4 LYS HZ2 . 26795 1
24 . 1 1 4 4 LYS HZ3 H 1 7.226 0.002 . . . . . . 4 LYS HZ2 . 26795 1
25 . 1 1 5 5 ASN H H 1 8.245 0.001 . . . . . . 5 ASN HN . 26795 1
26 . 1 1 5 5 ASN HA H 1 4.192 0.791 . . . . . . 5 ASN HA . 26795 1
27 . 1 1 5 5 ASN HB2 H 1 2.422 0.003 . . . . . . 5 ASN HB2 . 26795 1
28 . 1 1 5 5 ASN HD21 H 1 7.316 0.001 . . . . . . 5 ASN HD21 . 26795 1
29 . 1 1 5 5 ASN HD22 H 1 6.713 0.001 . . . . . . 5 ASN HD22 . 26795 1
30 . 1 1 6 6 PHE H H 1 8.163 0.001 . . . . . . 6 PHE HN . 26795 1
31 . 1 1 6 6 PHE HA H 1 4.451 0.002 . . . . . . 6 PHE HA . 26795 1
32 . 1 1 6 6 PHE HB2 H 1 2.717 0.005 . . . . . . 6 PHE HB2 . 26795 1
33 . 1 1 6 6 PHE HB3 H 1 2.582 0.002 . . . . . . 6 PHE HB3 . 26795 1
34 . 1 1 6 6 PHE HD1 H 1 6.707 0.002 . . . . . . 6 PHE QD . 26795 1
35 . 1 1 6 6 PHE HD2 H 1 6.707 0.002 . . . . . . 6 PHE QD . 26795 1
36 . 1 1 6 6 PHE HE1 H 1 6.959 0.001 . . . . . . 6 PHE QE . 26795 1
37 . 1 1 6 6 PHE HE2 H 1 6.959 0.001 . . . . . . 6 PHE QE . 26795 1
38 . 1 1 6 6 PHE HZ H 1 6.924 0.002 . . . . . . 6 PHE HZ . 26795 1
39 . 1 1 7 7 WFP HA H 1 4.328 0.003 . . . . . . 7 WFP HA . 26795 1
40 . 1 1 7 7 WFP HB2 H 1 2.713 0.002 . . . . . . 7 WFP HB2 . 26795 1
41 . 1 1 7 7 WFP HN H 1 8.089 0.000 . . . . . . 7 WFP HN . 26795 1
42 . 1 1 7 7 WFP HD1 H 1 6.590 0.002 . . . . . . 7 WFP QD . 26795 1
43 . 1 1 8 8 DTR HA H 1 4.241 0.002 . . . . . . 8 DTR HA . 26795 1
44 . 1 1 8 8 DTR HB2 H 1 2.884 0.002 . . . . . . 8 DTR HB2 . 26795 1
45 . 1 1 8 8 DTR HB3 H 1 2.783 0.002 . . . . . . 8 DTR HB3 . 26795 1
46 . 1 1 8 8 DTR HD1 H 1 6.918 0.001 . . . . . . 8 DTR HD1 . 26795 1
47 . 1 1 8 8 DTR HE1 H 1 10.004 0.001 . . . . . . 8 DTR HE1 . 26795 1
48 . 1 1 8 8 DTR HE3 H 1 7.246 0.001 . . . . . . 8 DTR HE3 . 26795 1
49 . 1 1 8 8 DTR HZ2 H 1 7.361 0.001 . . . . . . 8 DTR HZ2 . 26795 1
50 . 1 1 8 8 DTR HZ3 H 1 7.001 0.001 . . . . . . 8 DTR HZ3 . 26795 1
51 . 1 1 8 8 DTR HH2 H 1 6.920 0.000 . . . . . . 8 DTR HH2 . 26795 1
52 . 1 1 8 8 DTR HN H 1 8.369 0.001 . . . . . . 8 DTR HN . 26795 1
53 . 1 1 9 9 LYS H H 1 8.103 0.002 . . . . . . 9 LYS HN . 26795 1
54 . 1 1 9 9 LYS HA H 1 3.872 0.001 . . . . . . 9 LYS HA . 26795 1
55 . 1 1 9 9 LYS HB2 H 1 1.273 0.125 . . . . . . 9 LYS HB2 . 26795 1
56 . 1 1 9 9 LYS HB3 H 1 0.981 0.001 . . . . . . 9 LYS HB3 . 26795 1
57 . 1 1 9 9 LYS HG2 H 1 0.292 0.003 . . . . . . 9 LYS HG2 . 26795 1
58 . 1 1 9 9 LYS HG3 H 1 0.128 0.003 . . . . . . 9 LYS HG3 . 26795 1
59 . 1 1 9 9 LYS HD2 H 1 1.084 0.005 . . . . . . 9 LYS HD2 . 26795 1
60 . 1 1 9 9 LYS HE2 H 1 2.437 0.002 . . . . . . 9 LYS HE2 . 26795 1
61 . 1 1 9 9 LYS HE3 H 1 2.366 0.002 . . . . . . 9 LYS HE3 . 26795 1
62 . 1 1 9 9 LYS HZ1 H 1 7.234 0.001 . . . . . . 9 LYS HZ2 . 26795 1
63 . 1 1 9 9 LYS HZ2 H 1 7.234 0.001 . . . . . . 9 LYS HZ2 . 26795 1
64 . 1 1 9 9 LYS HZ3 H 1 7.234 0.001 . . . . . . 9 LYS HZ2 . 26795 1
65 . 1 1 10 10 THR H H 1 7.681 0.001 . . . . . . 10 THR HN . 26795 1
66 . 1 1 10 10 THR HA H 1 4.131 0.002 . . . . . . 10 THR HA . 26795 1
67 . 1 1 10 10 THR HB H 1 3.886 0.002 . . . . . . 10 THR HB . 26795 1
68 . 1 1 10 10 THR HG21 H 1 0.873 0.001 . . . . . . 10 THR QG2 . 26795 1
69 . 1 1 10 10 THR HG22 H 1 0.873 0.001 . . . . . . 10 THR QG2 . 26795 1
70 . 1 1 10 10 THR HG23 H 1 0.873 0.001 . . . . . . 10 THR QG2 . 26795 1
71 . 1 1 11 11 PHE H H 1 8.185 0.001 . . . . . . 11 PHE HN . 26795 1
72 . 1 1 11 11 PHE HA H 1 4.656 0.000 . . . . . . 11 PHE HA . 26795 1
73 . 1 1 11 11 PHE HB2 H 1 2.676 0.002 . . . . . . 11 PHE HB2 . 26795 1
74 . 1 1 11 11 PHE HB3 H 1 2.581 0.002 . . . . . . 11 PHE HB3 . 26795 1
75 . 1 1 11 11 PHE HD1 H 1 6.843 0.001 . . . . . . 11 PHE QD . 26795 1
76 . 1 1 11 11 PHE HD2 H 1 6.843 0.001 . . . . . . 11 PHE QD . 26795 1
77 . 1 1 11 11 PHE HE1 H 1 7.025 0.018 . . . . . . 11 PHE QE . 26795 1
78 . 1 1 11 11 PHE HE2 H 1 7.025 0.018 . . . . . . 11 PHE QE . 26795 1
79 . 1 1 11 11 PHE HZ H 1 6.979 0.001 . . . . . . 11 PHE HZ . 26795 1
80 . 1 1 12 12 THR H H 1 8.109 0.004 . . . . . . 12 THR HN . 26795 1
81 . 1 1 12 12 THR HA H 1 4.189 0.001 . . . . . . 12 THR HA . 26795 1
82 . 1 1 12 12 THR HB H 1 3.929 0.002 . . . . . . 12 THR HB . 26795 1
83 . 1 1 12 12 THR HG21 H 1 0.914 0.004 . . . . . . 12 THR QG2 . 26795 1
84 . 1 1 12 12 THR HG22 H 1 0.914 0.004 . . . . . . 12 THR QG2 . 26795 1
85 . 1 1 12 12 THR HG23 H 1 0.914 0.004 . . . . . . 12 THR QG2 . 26795 1
86 . 1 1 13 13 SER H H 1 8.150 0.002 . . . . . . 13 SER HN . 26795 1
87 . 1 1 13 13 SER HA H 1 4.306 0.001 . . . . . . 13 SER HA . 26795 1
88 . 1 1 13 13 SER HB2 H 1 3.673 0.003 . . . . . . 13 SER HB2 . 26795 1
89 . 1 1 14 14 CYS H H 1 8.133 0.000 . . . . . . 14 CYS HN . 26795 1
90 . 1 1 14 14 CYS HA H 1 4.360 0.001 . . . . . . 14 CYS HA . 26795 1
91 . 1 1 14 14 CYS HB2 H 1 3.003 0.000 . . . . . . 14 CYS HB2 . 26795 1
92 . 1 1 14 14 CYS HB3 H 1 2.881 0.001 . . . . . . 14 CYS HB3 . 26795 1
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save_