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 34337
_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 $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' . . . 34337 1
2 '2D 1H-1H NOESY' . . . 34337 1
3 '2D DQF-COSY' . . . 34337 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 2 2 ARG H H 1 8.545 0.000 . . . . . . A 1 ARG H . 34337 1
2 . 1 1 2 2 ARG HA H 1 4.255 0.000 . . . . . . A 1 ARG HA . 34337 1
3 . 1 1 2 2 ARG HB2 H 1 1.842 0.002 . . . . . . A 1 ARG HB2 . 34337 1
4 . 1 1 2 2 ARG HB3 H 1 1.842 0.002 . . . . . . A 1 ARG HB3 . 34337 1
5 . 1 1 2 2 ARG HG2 H 1 1.700 0.001 . . . . . . A 1 ARG HG2 . 34337 1
6 . 1 1 2 2 ARG HG3 H 1 1.663 0.001 . . . . . . A 1 ARG HG3 . 34337 1
7 . 1 1 2 2 ARG HD2 H 1 3.216 0.000 . . . . . . A 1 ARG HD2 . 34337 1
8 . 1 1 2 2 ARG HD3 H 1 3.216 0.000 . . . . . . A 1 ARG HD3 . 34337 1
9 . 1 1 2 2 ARG HE H 1 7.636 0.002 . . . . . . A 1 ARG HE . 34337 1
10 . 1 1 3 3 PRO HA H 1 4.412 0.004 . . . . . . A 2 PRO HA . 34337 1
11 . 1 1 3 3 PRO HB2 H 1 2.389 0.000 . . . . . . A 2 PRO HB2 . 34337 1
12 . 1 1 3 3 PRO HB3 H 1 2.295 0.004 . . . . . . A 2 PRO HB3 . 34337 1
13 . 1 1 3 3 PRO HG2 H 1 1.989 0.001 . . . . . . A 2 PRO HG2 . 34337 1
14 . 1 1 3 3 PRO HG3 H 1 1.646 0.000 . . . . . . A 2 PRO HG3 . 34337 1
15 . 1 1 3 3 PRO HD2 H 1 3.843 0.001 . . . . . . A 2 PRO HD2 . 34337 1
16 . 1 1 3 3 PRO HD3 H 1 3.420 0.100 . . . . . . A 2 PRO HD3 . 34337 1
17 . 1 1 4 4 LEU H H 1 8.141 0.000 . . . . . . A 3 LEU H . 34337 1
18 . 1 1 4 4 LEU HA H 1 4.242 0.000 . . . . . . A 3 LEU HA . 34337 1
19 . 1 1 4 4 LEU HB2 H 1 1.778 0.001 . . . . . . A 3 LEU HB2 . 34337 1
20 . 1 1 4 4 LEU HB3 H 1 1.778 0.001 . . . . . . A 3 LEU HB3 . 34337 1
21 . 1 1 4 4 LEU HG H 1 1.661 0.001 . . . . . . A 3 LEU HG . 34337 1
22 . 1 1 4 4 LEU HD11 H 1 0.852 0.000 . . . . . . A 3 LEU HD11 . 34337 1
23 . 1 1 4 4 LEU HD12 H 1 0.852 0.000 . . . . . . A 3 LEU HD12 . 34337 1
24 . 1 1 4 4 LEU HD13 H 1 0.852 0.000 . . . . . . A 3 LEU HD13 . 34337 1
25 . 1 1 4 4 LEU HD21 H 1 0.922 0.002 . . . . . . A 3 LEU HD21 . 34337 1
26 . 1 1 4 4 LEU HD22 H 1 0.922 0.002 . . . . . . A 3 LEU HD22 . 34337 1
27 . 1 1 4 4 LEU HD23 H 1 0.922 0.002 . . . . . . A 3 LEU HD23 . 34337 1
28 . 1 1 5 5 ASP H H 1 8.162 0.002 . . . . . . A 4 ASP H . 34337 1
29 . 1 1 5 5 ASP HA H 1 4.535 0.001 . . . . . . A 4 ASP HA . 34337 1
30 . 1 1 5 5 ASP HB2 H 1 2.813 0.000 . . . . . . A 4 ASP HB2 . 34337 1
31 . 1 1 5 5 ASP HB3 H 1 2.813 0.000 . . . . . . A 4 ASP HB3 . 34337 1
32 . 1 1 6 6 THR H H 1 7.767 0.000 . . . . . . A 5 THR H . 34337 1
33 . 1 1 6 6 THR HA H 1 4.328 0.000 . . . . . . A 5 THR HA . 34337 1
34 . 1 1 6 6 THR HG21 H 1 1.172 0.004 . . . . . . A 5 THR HG21 . 34337 1
35 . 1 1 6 6 THR HG22 H 1 1.172 0.004 . . . . . . A 5 THR HG22 . 34337 1
36 . 1 1 6 6 THR HG23 H 1 1.172 0.004 . . . . . . A 5 THR HG23 . 34337 1
37 . 1 1 7 7 VAL H H 1 7.543 0.000 . . . . . . A 6 VAL H . 34337 1
38 . 1 1 7 7 VAL HA H 1 4.032 0.000 . . . . . . A 6 VAL HA . 34337 1
39 . 1 1 7 7 VAL HB H 1 2.124 0.000 . . . . . . A 6 VAL HB . 34337 1
40 . 1 1 7 7 VAL HG11 H 1 0.924 0.000 . . . . . . A 6 VAL HG11 . 34337 1
41 . 1 1 7 7 VAL HG12 H 1 0.924 0.000 . . . . . . A 6 VAL HG12 . 34337 1
42 . 1 1 7 7 VAL HG13 H 1 0.924 0.000 . . . . . . A 6 VAL HG13 . 34337 1
43 . 1 1 7 7 VAL HG21 H 1 0.968 0.000 . . . . . . A 6 VAL HG21 . 34337 1
44 . 1 1 7 7 VAL HG22 H 1 0.968 0.000 . . . . . . A 6 VAL HG22 . 34337 1
45 . 1 1 7 7 VAL HG23 H 1 0.968 0.000 . . . . . . A 6 VAL HG23 . 34337 1
46 . 1 1 8 8 GLN H H 1 8.257 0.000 . . . . . . A 7 GLN H . 34337 1
47 . 1 1 8 8 GLN HA H 1 4.390 0.000 . . . . . . A 7 GLN HA . 34337 1
48 . 1 1 8 8 GLN HB2 H 1 1.916 0.002 . . . . . . A 7 GLN HB2 . 34337 1
49 . 1 1 8 8 GLN HB3 H 1 2.031 0.001 . . . . . . A 7 GLN HB3 . 34337 1
50 . 1 1 8 8 GLN HG2 H 1 2.319 0.000 . . . . . . A 7 GLN HG2 . 34337 1
51 . 1 1 8 8 GLN HG3 H 1 2.319 0.000 . . . . . . A 7 GLN HG3 . 34337 1
52 . 1 1 8 8 GLN HE21 H 1 7.571 0.000 . . . . . . A 7 GLN HE21 . 34337 1
53 . 1 1 8 8 GLN HE22 H 1 6.825 0.000 . . . . . . A 7 GLN HE22 . 34337 1
54 . 1 1 9 9 ARG H H 1 8.543 0.003 . . . . . . A 8 ARG H . 34337 1
55 . 1 1 9 9 ARG HA H 1 4.388 0.001 . . . . . . A 8 ARG HA . 34337 1
56 . 1 1 9 9 ARG HB2 H 1 1.765 0.004 . . . . . . A 8 ARG HB2 . 34337 1
57 . 1 1 9 9 ARG HB3 H 1 1.765 0.004 . . . . . . A 8 ARG HB3 . 34337 1
58 . 1 1 9 9 ARG HG2 H 1 1.657 0.000 . . . . . . A 8 ARG HG2 . 34337 1
59 . 1 1 9 9 ARG HG3 H 1 1.657 0.000 . . . . . . A 8 ARG HG3 . 34337 1
60 . 1 1 9 9 ARG HD2 H 1 3.165 0.002 . . . . . . A 8 ARG HD2 . 34337 1
61 . 1 1 9 9 ARG HD3 H 1 3.165 0.002 . . . . . . A 8 ARG HD3 . 34337 1
62 . 1 1 9 9 ARG HE H 1 7.493 0.000 . . . . . . A 8 ARG HE . 34337 1
63 . 1 1 10 10 PRO HA H 1 4.484 0.000 . . . . . . A 9 PRO HA . 34337 1
64 . 1 1 10 10 PRO HB2 H 1 2.351 0.000 . . . . . . A 9 PRO HB2 . 34337 1
65 . 1 1 10 10 PRO HB3 H 1 2.351 0.000 . . . . . . A 9 PRO HB3 . 34337 1
66 . 1 1 10 10 PRO HG2 H 1 1.920 0.000 . . . . . . A 9 PRO HG2 . 34337 1
67 . 1 1 10 10 PRO HG3 H 1 1.920 0.000 . . . . . . A 9 PRO HG3 . 34337 1
68 . 1 1 10 10 PRO HD2 H 1 3.836 0.000 . . . . . . A 9 PRO HD2 . 34337 1
69 . 1 1 10 10 PRO HD3 H 1 3.447 0.000 . . . . . . A 9 PRO HD3 . 34337 1
70 . 1 1 11 11 LYS H H 1 8.632 0.000 . . . . . . A 10 LYS H . 34337 1
71 . 1 1 11 11 LYS HA H 1 4.162 0.000 . . . . . . A 10 LYS HA . 34337 1
72 . 1 1 11 11 LYS HB2 H 1 1.774 0.001 . . . . . . A 10 LYS HB2 . 34337 1
73 . 1 1 11 11 LYS HB3 H 1 1.774 0.001 . . . . . . A 10 LYS HB3 . 34337 1
74 . 1 1 11 11 LYS HG2 H 1 1.414 0.001 . . . . . . A 10 LYS HG2 . 34337 1
75 . 1 1 11 11 LYS HG3 H 1 1.471 0.004 . . . . . . A 10 LYS HG3 . 34337 1
76 . 1 1 11 11 LYS HD2 H 1 1.657 0.000 . . . . . . A 10 LYS HD2 . 34337 1
77 . 1 1 11 11 LYS HD3 H 1 1.657 0.000 . . . . . . A 10 LYS HD3 . 34337 1
78 . 1 1 11 11 LYS HE2 H 1 2.973 0.000 . . . . . . A 10 LYS HE2 . 34337 1
79 . 1 1 11 11 LYS HE3 H 1 2.973 0.000 . . . . . . A 10 LYS HE3 . 34337 1
80 . 1 1 11 11 LYS HZ1 H 1 7.538 0.000 . . . . . . A 10 LYS HZ1 . 34337 1
81 . 1 1 11 11 LYS HZ2 H 1 7.538 0.000 . . . . . . A 10 LYS HZ2 . 34337 1
82 . 1 1 11 11 LYS HZ3 H 1 7.538 0.000 . . . . . . A 10 LYS HZ3 . 34337 1
83 . 1 1 12 12 GLY H H 1 8.508 0.004 . . . . . . A 11 GLY H . 34337 1
84 . 1 1 12 12 GLY HA2 H 1 3.727 0.003 . . . . . . A 11 GLY HA2 . 34337 1
85 . 1 1 12 12 GLY HA3 H 1 3.938 0.000 . . . . . . A 11 GLY HA2 . 34337 1
86 . 1 1 13 13 TYR H H 1 7.945 0.000 . . . . . . A 12 TYR H . 34337 1
87 . 1 1 13 13 TYR HA H 1 4.449 0.001 . . . . . . A 12 TYR HA . 34337 1
88 . 1 1 13 13 TYR HB2 H 1 2.823 0.000 . . . . . . A 12 TYR HB2 . 34337 1
89 . 1 1 13 13 TYR HB3 H 1 3.019 0.000 . . . . . . A 12 TYR HB3 . 34337 1
90 . 1 1 13 13 TYR HD1 H 1 7.011 0.001 . . . . . . A 12 TYR HD1 . 34337 1
91 . 1 1 13 13 TYR HD2 H 1 7.011 0.001 . . . . . . A 12 TYR HD2 . 34337 1
92 . 1 1 13 13 TYR HE1 H 1 6.764 0.000 . . . . . . A 12 TYR HE1 . 34337 1
93 . 1 1 13 13 TYR HE2 H 1 6.764 0.000 . . . . . . A 12 TYR HE2 . 34337 1
94 . 1 1 14 14 NH2 HN1 H 1 7.606 0.002 . . . . . . A 13 NH2 HN1 . 34337 1
95 . 1 1 14 14 NH2 HN2 H 1 7.080 0.000 . . . . . . A 13 NH2 HN2 . 34337 1
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save_