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 17426
_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 0.01
_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' . . . 17426 1
2 '2D 1H-1H NOESY' . . . 17426 1
3 '2D DQF-COSY' . . . 17426 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.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 8.210 0.001 . 1 . . . . 1 GLY H . 17426 1
2 . 1 1 1 1 GLY HA2 H 1 3.633 0.01 . 2 . . . . 1 GLY HA2 . 17426 1
3 . 1 1 1 1 GLY HA3 H 1 3.979 0.01 . 2 . . . . 1 GLY HA3 . 17426 1
4 . 1 1 2 2 ARG H H 1 7.699 0.01 . 1 . . . . 2 ARG H . 17426 1
5 . 1 1 2 2 ARG HA H 1 4.208 0.01 . 1 . . . . 2 ARG HA . 17426 1
6 . 1 1 2 2 ARG HB3 H 1 1.695 0.01 . 2 . . . . 2 ARG HB3 . 17426 1
7 . 1 1 2 2 ARG HG3 H 1 1.376 0.003 . 2 . . . . 2 ARG HG3 . 17426 1
8 . 1 1 2 2 ARG HD3 H 1 2.968 0.005 . 2 . . . . 2 ARG HD3 . 17426 1
9 . 1 1 3 3 CYS H H 1 8.481 0.001 . 1 . . . . 3 CYS H . 17426 1
10 . 1 1 3 3 CYS HA H 1 5.071 0.004 . 1 . . . . 3 CYS HA . 17426 1
11 . 1 1 3 3 CYS HB2 H 1 2.753 0.01 . 2 . . . . 3 CYS HB2 . 17426 1
12 . 1 1 3 3 CYS HB3 H 1 2.847 0.01 . 2 . . . . 3 CYS HB3 . 17426 1
13 . 1 1 4 4 SER H H 1 8.738 0.01 . 1 . . . . 4 SER H . 17426 1
14 . 1 1 4 4 SER HA H 1 4.470 0.01 . 1 . . . . 4 SER HA . 17426 1
15 . 1 1 4 4 SER HB2 H 1 3.667 0.01 . 2 . . . . 4 SER HB2 . 17426 1
16 . 1 1 4 4 SER HB3 H 1 3.796 0.01 . 2 . . . . 4 SER HB3 . 17426 1
17 . 1 1 5 5 VAL H H 1 8.309 0.001 . 1 . . . . 5 VAL H . 17426 1
18 . 1 1 5 5 VAL HA H 1 4.121 0.003 . 1 . . . . 5 VAL HA . 17426 1
19 . 1 1 5 5 VAL HB H 1 2.004 0.01 . 1 . . . . 5 VAL HB . 17426 1
20 . 1 1 5 5 VAL HG11 H 1 0.661 0.01 . 2 . . . . 5 VAL QG . 17426 1
21 . 1 1 5 5 VAL HG12 H 1 0.661 0.01 . 2 . . . . 5 VAL QG . 17426 1
22 . 1 1 5 5 VAL HG13 H 1 0.661 0.01 . 2 . . . . 5 VAL QG . 17426 1
23 . 1 1 5 5 VAL HG21 H 1 0.661 0.01 . 2 . . . . 5 VAL QG . 17426 1
24 . 1 1 5 5 VAL HG22 H 1 0.661 0.01 . 2 . . . . 5 VAL QG . 17426 1
25 . 1 1 5 5 VAL HG23 H 1 0.661 0.01 . 2 . . . . 5 VAL QG . 17426 1
26 . 1 1 6 6 VAL H H 1 7.612 0.001 . 1 . . . . 6 VAL H . 17426 1
27 . 1 1 6 6 VAL HA H 1 3.607 0.005 . 1 . . . . 6 VAL HA . 17426 1
28 . 1 1 6 6 VAL HB H 1 1.606 0.006 . 1 . . . . 6 VAL HB . 17426 1
29 . 1 1 6 6 VAL HG11 H 1 0.411 0.003 . 2 . . . . 6 VAL MG1 . 17426 1
30 . 1 1 6 6 VAL HG12 H 1 0.411 0.003 . 2 . . . . 6 VAL MG1 . 17426 1
31 . 1 1 6 6 VAL HG13 H 1 0.411 0.003 . 2 . . . . 6 VAL MG1 . 17426 1
32 . 1 1 6 6 VAL HG21 H 1 0.624 0.002 . 2 . . . . 6 VAL MG2 . 17426 1
33 . 1 1 6 6 VAL HG22 H 1 0.624 0.002 . 2 . . . . 6 VAL MG2 . 17426 1
34 . 1 1 6 6 VAL HG23 H 1 0.624 0.002 . 2 . . . . 6 VAL MG2 . 17426 1
35 . 1 1 7 7 TYR H H 1 8.081 0.01 . 1 . . . . 7 TYR H . 17426 1
36 . 1 1 7 7 TYR HA H 1 4.371 0.01 . 1 . . . . 7 TYR HA . 17426 1
37 . 1 1 7 7 TYR HB2 H 1 2.727 0.01 . 2 . . . . 7 TYR HB2 . 17426 1
38 . 1 1 7 7 TYR HB3 H 1 2.965 0.01 . 2 . . . . 7 TYR HB3 . 17426 1
39 . 1 1 7 7 TYR HD1 H 1 6.922 0.001 . 3 . . . . 7 TYR QD . 17426 1
40 . 1 1 7 7 TYR HD2 H 1 6.922 0.001 . 3 . . . . 7 TYR QD . 17426 1
41 . 1 1 7 7 TYR HE1 H 1 6.612 0.002 . 3 . . . . 7 TYR QE . 17426 1
42 . 1 1 7 7 TYR HE2 H 1 6.612 0.002 . 3 . . . . 7 TYR QE . 17426 1
43 . 1 1 8 8 GLY H H 1 7.614 0.01 . 1 . . . . 8 GLY H . 17426 1
44 . 1 1 8 8 GLY HA2 H 1 3.437 0.01 . 2 . . . . 8 GLY HA2 . 17426 1
45 . 1 1 8 8 GLY HA3 H 1 3.886 0.01 . 2 . . . . 8 GLY HA3 . 17426 1
46 . 1 1 9 9 LEU H H 1 7.879 0.01 . 1 . . . . 9 LEU H . 17426 1
47 . 1 1 9 9 LEU HA H 1 4.254 0.01 . 1 . . . . 9 LEU HA . 17426 1
48 . 1 1 9 9 LEU HB2 H 1 1.311 0.01 . 2 . . . . 9 LEU HB2 . 17426 1
49 . 1 1 9 9 LEU HB3 H 1 1.431 0.01 . 2 . . . . 9 LEU HB3 . 17426 1
50 . 1 1 9 9 LEU HD11 H 1 0.647 0.01 . 2 . . . . 9 LEU QD . 17426 1
51 . 1 1 9 9 LEU HD12 H 1 0.647 0.01 . 2 . . . . 9 LEU QD . 17426 1
52 . 1 1 9 9 LEU HD13 H 1 0.647 0.01 . 2 . . . . 9 LEU QD . 17426 1
53 . 1 1 9 9 LEU HD21 H 1 0.647 0.01 . 2 . . . . 9 LEU QD . 17426 1
54 . 1 1 9 9 LEU HD22 H 1 0.647 0.01 . 2 . . . . 9 LEU QD . 17426 1
55 . 1 1 9 9 LEU HD23 H 1 0.647 0.01 . 2 . . . . 9 LEU QD . 17426 1
56 . 1 1 10 10 ARG H H 1 8.309 0.01 . 1 . . . . 10 ARG H . 17426 1
57 . 1 1 10 10 ARG HA H 1 4.114 0.01 . 1 . . . . 10 ARG HA . 17426 1
58 . 1 1 10 10 ARG HB2 H 1 1.505 0.01 . 2 . . . . 10 ARG HB2 . 17426 1
59 . 1 1 10 10 ARG HG2 H 1 1.201 0.003 . 2 . . . . 10 ARG HG2 . 17426 1
60 . 1 1 10 10 ARG HG3 H 1 1.277 0.01 . 2 . . . . 10 ARG HG3 . 17426 1
61 . 1 1 10 10 ARG HD2 H 1 2.917 0.002 . 2 . . . . 10 ARG QD . 17426 1
62 . 1 1 10 10 ARG HD3 H 1 2.917 0.002 . 2 . . . . 10 ARG QD . 17426 1
63 . 1 1 11 11 CYS H H 1 8.351 0.01 . 1 . . . . 11 CYS H . 17426 1
64 . 1 1 11 11 CYS HA H 1 4.809 0.003 . 1 . . . . 11 CYS HA . 17426 1
65 . 1 1 11 11 CYS HB2 H 1 2.584 0.01 . 2 . . . . 11 CYS HB2 . 17426 1
66 . 1 1 11 11 CYS HB3 H 1 2.718 0.01 . 2 . . . . 11 CYS HB3 . 17426 1
67 . 1 1 12 12 PHE H H 1 8.543 0.01 . 1 . . . . 12 PHE H . 17426 1
68 . 1 1 12 12 PHE HA H 1 4.654 0.002 . 1 . . . . 12 PHE HA . 17426 1
69 . 1 1 12 12 PHE HB2 H 1 2.813 0.01 . 2 . . . . 12 PHE HB2 . 17426 1
70 . 1 1 12 12 PHE HB3 H 1 3.136 0.003 . 2 . . . . 12 PHE HB3 . 17426 1
71 . 1 1 12 12 PHE HD1 H 1 7.095 0.001 . 3 . . . . 12 PHE QD . 17426 1
72 . 1 1 12 12 PHE HD2 H 1 7.095 0.001 . 3 . . . . 12 PHE QD . 17426 1
73 . 1 1 13 13 PRO HA H 1 4.185 0.003 . 1 . . . . 13 PRO HA . 17426 1
74 . 1 1 13 13 PRO HB2 H 1 2.201 0.01 . 2 . . . . 13 PRO HB2 . 17426 1
75 . 1 1 13 13 PRO HB3 H 1 1.780 0.01 . 2 . . . . 13 PRO HB3 . 17426 1
76 . 1 1 13 13 PRO HG2 H 1 1.951 0.01 . 2 . . . . 13 PRO HG2 . 17426 1
77 . 1 1 13 13 PRO HG3 H 1 1.862 0.01 . 2 . . . . 13 PRO HG3 . 17426 1
78 . 1 1 13 13 PRO HD2 H 1 3.706 0.004 . 2 . . . . 13 PRO HD2 . 17426 1
79 . 1 1 13 13 PRO HD3 H 1 3.788 0.01 . 2 . . . . 13 PRO HD3 . 17426 1
80 . 1 1 14 14 ASP H H 1 7.898 0.01 . 1 . . . . 14 ASP H . 17426 1
81 . 1 1 14 14 ASP HA H 1 4.342 0.002 . 1 . . . . 14 ASP HA . 17426 1
82 . 1 1 14 14 ASP HB2 H 1 2.659 0.01 . 2 . . . . 14 ASP HB2 . 17426 1
83 . 1 1 14 14 ASP HB3 H 1 2.919 0.01 . 2 . . . . 14 ASP HB3 . 17426 1
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save_