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 21011
_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' 1 $sample_1 isotropic 21011 1
2 '2D 1H-1H TOCSY' 1 $sample_1 isotropic 21011 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 LYS HA H 1 3.941 0.002 . 1 . . . . . 1 LYS HA . 21011 1
2 . 1 1 1 1 LYS HB2 H 1 1.804 0.004 . 2 . . . . . 1 LYS HB2 . 21011 1
3 . 1 1 1 1 LYS HB3 H 1 1.643 0.004 . 2 . . . . . 1 LYS HB3 . 21011 1
4 . 1 1 1 1 LYS HG2 H 1 1.313 0.004 . 2 . . . . . 1 LYS HG23 . 21011 1
5 . 1 1 1 1 LYS HG3 H 1 1.313 0.004 . 2 . . . . . 1 LYS HG23 . 21011 1
6 . 1 1 2 2 TRP H H 1 8.611 0.002 . 1 . . . . . 2 TRP H . 21011 1
7 . 1 1 2 2 TRP HA H 1 4.666 0.004 . 1 . . . . . 2 TRP HA . 21011 1
8 . 1 1 2 2 TRP HB2 H 1 3.199 0.003 . 2 . . . . . 2 TRP HB2 . 21011 1
9 . 1 1 2 2 TRP HB3 H 1 2.938 0.002 . 2 . . . . . 2 TRP HB3 . 21011 1
10 . 1 1 2 2 TRP HD1 H 1 7.233 0.001 . 1 . . . . . 2 TRP HD1 . 21011 1
11 . 1 1 2 2 TRP HE1 H 1 10.10 0.002 . 1 . . . . . 2 TRP HE1 . 21011 1
12 . 1 1 2 2 TRP HE3 H 1 7.553 0.002 . 1 . . . . . 2 TRP HE3 . 21011 1
13 . 1 1 2 2 TRP HZ2 H 1 7.463 0.002 . 1 . . . . . 2 TRP HZ2 . 21011 1
14 . 1 1 3 3 PHE H H 1 7.906 0.004 . 1 . . . . . 3 PHE H . 21011 1
15 . 1 1 3 3 PHE HA H 1 4.438 0.003 . 1 . . . . . 3 PHE HA . 21011 1
16 . 1 1 3 3 PHE HB2 H 1 2.945 0.005 . 2 . . . . . 3 PHE HB2 . 21011 1
17 . 1 1 3 3 PHE HB3 H 1 2.826 0.002 . 2 . . . . . 3 PHE HB3 . 21011 1
18 . 1 1 3 3 PHE HD1 H 1 7.292 0.002 . 3 . . . . . 3 PHE HD1 . 21011 1
19 . 1 1 3 3 PHE HE1 H 1 7.148 0.001 . 3 . . . . . 3 PHE HE1 . 21011 1
20 . 1 1 4 4 ARG H H 1 8.009 0.007 . 1 . . . . . 4 ARG H . 21011 1
21 . 1 1 4 4 ARG HA H 1 4.019 0.006 . 1 . . . . . 4 ARG HA . 21011 1
22 . 1 1 4 4 ARG HB2 H 1 1.598 0.000 . 2 . . . . . 4 ARG HB2 . 21011 1
23 . 1 1 4 4 ARG HB3 H 1 1.451 0.003 . 2 . . . . . 4 ARG HB3 . 21011 1
24 . 1 1 4 4 ARG HD2 H 1 3.126 0.009 . 2 . . . . . 4 ARG HD . 21011 1
25 . 1 1 4 4 ARG HD3 H 1 3.126 0.009 . 2 . . . . . 4 ARG HD . 21011 1
26 . 1 1 4 4 ARG HG2 H 1 1.348 0.000 . 2 . . . . . 4 ARG HG . 21011 1
27 . 1 1 4 4 ARG HG3 H 1 1.348 0.000 . 2 . . . . . 4 ARG HG . 21011 1
28 . 1 1 5 5 VAL H H 1 8.075 0.003 . 1 . . . . . 5 VAL H . 21011 1
29 . 1 1 5 5 VAL HA H 1 4.034 0.007 . 1 . . . . . 5 VAL HA . 21011 1
30 . 1 1 5 5 VAL HB H 1 1.946 0.002 . 1 . . . . . 5 VAL HB . 21011 1
31 . 1 1 5 5 VAL HG11 H 1 0.883 0.007 . 2 . . . . . 5 VAL HG12 . 21011 1
32 . 1 1 5 5 VAL HG12 H 1 0.883 0.007 . 2 . . . . . 5 VAL HG12 . 21011 1
33 . 1 1 5 5 VAL HG13 H 1 0.883 0.007 . 2 . . . . . 5 VAL HG12 . 21011 1
34 . 1 1 5 5 VAL HG21 H 1 0.825 0.001 . 2 . . . . . 5 VAL HG . 21011 1
35 . 1 1 5 5 VAL HG22 H 1 0.825 0.001 . 2 . . . . . 5 VAL HG . 21011 1
36 . 1 1 5 5 VAL HG23 H 1 0.825 0.001 . 2 . . . . . 5 VAL HG . 21011 1
37 . 1 1 6 6 TYR H H 1 8.507 0.002 . 1 . . . . . 6 TYR H . 21011 1
38 . 1 1 6 6 TYR HA H 1 4.564 0.004 . 1 . . . . . 6 TYR HA . 21011 1
39 . 1 1 6 6 TYR HB2 H 1 3.134 0.003 . 2 . . . . . 6 TYR HB2 . 21011 1
40 . 1 1 6 6 TYR HB3 H 1 2.935 0.001 . 2 . . . . . 6 TYR HB3 . 21011 1
41 . 1 1 6 6 TYR HD1 H 1 7.094 0.000 . 3 . . . . . 6 TYR HD1 . 21011 1
42 . 1 1 7 7 ARG H H 1 8.328 0.003 . 1 . . . . . 7 ARG H . 21011 1
43 . 1 1 7 7 ARG HA H 1 4.289 0.006 . 1 . . . . . 7 ARG HA . 21011 1
44 . 1 1 7 7 ARG HB2 H 1 1.812 0.004 . 2 . . . . . 7 ARG HB2 . 21011 1
45 . 1 1 7 7 ARG HB3 H 1 1.643 0.005 . 2 . . . . . 7 ARG HB3 . 21011 1
46 . 1 1 7 7 ARG HD2 H 1 3.193 0.003 . 2 . . . . . 7 ARG HD . 21011 1
47 . 1 1 7 7 ARG HD3 H 1 3.193 0.003 . 2 . . . . . 7 ARG HD . 21011 1
48 . 1 1 7 7 ARG HG2 H 1 1.551 0.009 . 2 . . . . . 7 ARG HG . 21011 1
49 . 1 1 7 7 ARG HG3 H 1 1.551 0.009 . 2 . . . . . 7 ARG HG . 21011 1
50 . 1 1 8 8 GLY H H 1 7.784 0.001 . 1 . . . . . 8 GLY H . 21011 1
51 . 1 1 8 8 GLY HA2 H 1 3.866 0.006 . 2 . . . . . 8 GLY HA . 21011 1
52 . 1 1 8 8 GLY HA3 H 1 3.866 0.006 . 2 . . . . . 8 GLY HA . 21011 1
53 . 1 1 9 9 ILE H H 1 7.990 0.003 . 1 . . . . . 9 ILE H . 21011 1
54 . 1 1 9 9 ILE HA H 1 4.140 0.001 . 1 . . . . . 9 ILE HA . 21011 1
55 . 1 1 9 9 ILE HB H 1 1.770 0.004 . 1 . . . . . 9 ILE HB . 21011 1
56 . 1 1 9 9 ILE HD11 H 1 0.823 0.004 . 1 . . . . . 9 ILE HD . 21011 1
57 . 1 1 9 9 ILE HD12 H 1 0.823 0.004 . 1 . . . . . 9 ILE HD . 21011 1
58 . 1 1 9 9 ILE HD13 H 1 0.823 0.004 . 1 . . . . . 9 ILE HD . 21011 1
59 . 1 1 9 9 ILE HG12 H 1 0.871 0.008 . 2 . . . . . 9 ILE HG12 . 21011 1
60 . 1 1 9 9 ILE HG21 H 1 1.322 0.004 . 1 . . . . . 9 ILE HG21 . 21011 1
61 . 1 1 9 9 ILE HG22 H 1 1.104 0.002 . 1 . . . . . 9 ILE HG23 . 21011 1
62 . 1 1 9 9 ILE HG23 H 1 1.104 0.002 . 1 . . . . . 9 ILE HG23 . 21011 1
63 . 1 1 10 10 TYR H H 1 8.361 0.002 . 1 . . . . . 10 TYR H . 21011 1
64 . 1 1 10 10 TYR HA H 1 4.572 0.004 . 1 . . . . . 10 TYR HA . 21011 1
65 . 1 1 10 10 TYR HB2 H 1 3.136 0.009 . 2 . . . . . 10 TYR HB2 . 21011 1
66 . 1 1 10 10 TYR HB3 H 1 2.946 0.002 . 2 . . . . . 10 TYR HB3 . 21011 1
67 . 1 1 10 10 TYR HD1 H 1 7.095 0.006 . 3 . . . . . 10 TYR HD1 . 21011 1
68 . 1 1 11 11 ARG H H 1 8.137 0.003 . 1 . . . . . 11 ARG H . 21011 1
69 . 1 1 11 11 ARG HA H 1 4.274 0.008 . 1 . . . . . 11 ARG HA . 21011 1
70 . 1 1 11 11 ARG HB2 H 1 1.741 0.000 . 2 . . . . . 11 ARG HB2 . 21011 1
71 . 1 1 11 11 ARG HB3 H 1 1.650 0.003 . 2 . . . . . 11 ARG HB3 . 21011 1
72 . 1 1 11 11 ARG HD2 H 1 3.139 0.001 . 2 . . . . . 11 ARG HD . 21011 1
73 . 1 1 11 11 ARG HD3 H 1 3.139 0.001 . 2 . . . . . 11 ARG HD . 21011 1
74 . 1 1 11 11 ARG HG2 H 1 1.534 0.000 . 2 . . . . . 11 ARG HG . 21011 1
75 . 1 1 11 11 ARG HG3 H 1 1.534 0.000 . 2 . . . . . 11 ARG HG . 21011 1
76 . 1 1 11 11 ARG HH11 H 1 7.145 0.000 . 2 . . . . . 11 ARG HH11 . 21011 1
77 . 1 1 12 12 ARG H H 1 8.329 0.005 . 1 . . . . . 12 ARG H . 21011 1
78 . 1 1 12 12 ARG HA H 1 4.222 0.004 . 1 . . . . . 12 ARG HA . 21011 1
79 . 1 1 12 12 ARG HB2 H 1 1.745 0.000 . 2 . . . . . 12 ARG HB2 . 21011 1
80 . 1 1 12 12 ARG HB3 H 1 1.640 0.002 . 2 . . . . . 12 ARG HB3 . 21011 1
81 . 1 1 12 12 ARG HG2 H 1 1.539 0.002 . 2 . . . . . 12 ARG HG . 21011 1
82 . 1 1 12 12 ARG HG3 H 1 1.539 0.002 . 2 . . . . . 12 ARG HG . 21011 1
83 . 1 1 13 13 ARG H H 1 8.439 0.001 . 1 . . . . . 13 ARG H . 21011 1
84 . 1 1 13 13 ARG HA H 1 4.283 0.002 . 1 . . . . . 13 ARG HA . 21011 1
85 . 1 1 13 13 ARG HB2 H 1 1.824 0.007 . 2 . . . . . 13 ARG HB2 . 21011 1
86 . 1 1 13 13 ARG HB3 H 1 1.755 0.001 . 2 . . . . . 13 ARG HB3 . 21011 1
87 . 1 1 13 13 ARG HD2 H 1 3.193 0.001 . 2 . . . . . 13 ARG HD . 21011 1
88 . 1 1 13 13 ARG HD3 H 1 3.193 0.001 . 2 . . . . . 13 ARG HD . 21011 1
89 . 1 1 13 13 ARG HG2 H 1 1.637 0.003 . 2 . . . . . 13 ARG HG . 21011 1
90 . 1 1 13 13 ARG HG3 H 1 1.637 0.003 . 2 . . . . . 13 ARG HG . 21011 1
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save_