Content for NMR-STAR saveframe, "chem_shift_set_1"
save_chem_shift_set_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chem_shift_set_1
_Assigned_chem_shift_list.Entry_ID 4088
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_cond_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference
_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 $sample_1 . 4088 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 ILE HA H 1 3.89 0.01 . . . . . . . . . . 4088 1
2 . 1 1 1 1 ILE HB H 1 1.95 0.01 . . . . . . . . . . 4088 1
3 . 1 1 1 1 ILE HG12 H 1 1.46 0.01 . . . . . . . . . . 4088 1
4 . 1 1 1 1 ILE HG13 H 1 1.19 0.01 . . . . . . . . . . 4088 1
5 . 1 1 1 1 ILE HG21 H 1 0.97 0.01 . . . . . . . . . . 4088 1
6 . 1 1 1 1 ILE HG22 H 1 0.97 0.01 . . . . . . . . . . 4088 1
7 . 1 1 1 1 ILE HG23 H 1 0.97 0.01 . . . . . . . . . . 4088 1
8 . 1 1 1 1 ILE HD11 H 1 0.89 0.01 . . . . . . . . . . 4088 1
9 . 1 1 1 1 ILE HD12 H 1 0.89 0.01 . . . . . . . . . . 4088 1
10 . 1 1 1 1 ILE HD13 H 1 0.89 0.01 . . . . . . . . . . 4088 1
11 . 1 1 2 2 CYS H H 1 8.86 0.01 . . . . . . . . . . 4088 1
12 . 1 1 2 2 CYS HA H 1 4.86 0.01 . . . . . . . . . . 4088 1
13 . 1 1 2 2 CYS HB2 H 1 3.06 0.01 . . . . . . . . . . 4088 1
14 . 1 1 2 2 CYS HB3 H 1 3.06 0.01 . . . . . . . . . . 4088 1
15 . 1 1 3 3 VAL H H 1 8.79 0.01 . . . . . . . . . . 4088 1
16 . 1 1 3 3 VAL HA H 1 4.20 0.01 . . . . . . . . . . 4088 1
17 . 1 1 3 3 VAL HB H 1 2.07 0.01 . . . . . . . . . . 4088 1
18 . 1 1 3 3 VAL HG11 H 1 0.91 0.01 . . . . . . . . . . 4088 1
19 . 1 1 3 3 VAL HG12 H 1 0.91 0.01 . . . . . . . . . . 4088 1
20 . 1 1 3 3 VAL HG13 H 1 0.91 0.01 . . . . . . . . . . 4088 1
21 . 1 1 3 3 VAL HG21 H 1 0.91 0.01 . . . . . . . . . . 4088 1
22 . 1 1 3 3 VAL HG22 H 1 0.91 0.01 . . . . . . . . . . 4088 1
23 . 1 1 3 3 VAL HG23 H 1 0.91 0.01 . . . . . . . . . . 4088 1
24 . 1 1 4 4 VAL H H 1 8.41 0.01 . . . . . . . . . . 4088 1
25 . 1 1 4 4 VAL HA H 1 3.87 0.01 . . . . . . . . . . 4088 1
26 . 1 1 4 4 VAL HB H 1 1.93 0.01 . . . . . . . . . . 4088 1
27 . 1 1 4 4 VAL HG11 H 1 0.86 0.01 . . . . . . . . . . 4088 1
28 . 1 1 4 4 VAL HG12 H 1 0.86 0.01 . . . . . . . . . . 4088 1
29 . 1 1 4 4 VAL HG13 H 1 0.86 0.01 . . . . . . . . . . 4088 1
30 . 1 1 4 4 VAL HG21 H 1 0.80 0.01 . . . . . . . . . . 4088 1
31 . 1 1 4 4 VAL HG22 H 1 0.80 0.01 . . . . . . . . . . 4088 1
32 . 1 1 4 4 VAL HG23 H 1 0.80 0.01 . . . . . . . . . . 4088 1
33 . 1 1 5 5 GLN H H 1 8.47 0.01 . . . . . . . . . . 4088 1
34 . 1 1 5 5 GLN HA H 1 4.26 0.01 . . . . . . . . . . 4088 1
35 . 1 1 5 5 GLN HB2 H 1 1.70 0.01 . . . . . . . . . . 4088 1
36 . 1 1 5 5 GLN HB3 H 1 1.70 0.01 . . . . . . . . . . 4088 1
37 . 1 1 5 5 GLN HG2 H 1 2.18 0.01 . . . . . . . . . . 4088 1
38 . 1 1 5 5 GLN HG3 H 1 2.18 0.01 . . . . . . . . . . 4088 1
39 . 1 1 5 5 GLN HE21 H 1 7.41 0.01 . . . . . . . . . . 4088 1
40 . 1 1 5 5 GLN HE22 H 1 6.82 0.01 . . . . . . . . . . 4088 1
41 . 1 1 6 6 ASP H H 1 8.34 0.01 . . . . . . . . . . 4088 1
42 . 1 1 6 6 ASP HA H 1 4.56 0.01 . . . . . . . . . . 4088 1
43 . 1 1 6 6 ASP HB2 H 1 2.67 0.01 . . . . . . . . . . 4088 1
44 . 1 1 6 6 ASP HB3 H 1 2.67 0.01 . . . . . . . . . . 4088 1
45 . 1 1 7 7 TRP H H 1 7.94 0.01 . . . . . . . . . . 4088 1
46 . 1 1 7 7 TRP HA H 1 4.57 0.01 . . . . . . . . . . 4088 1
47 . 1 1 7 7 TRP HB2 H 1 3.30 0.01 . . . . . . . . . . 4088 1
48 . 1 1 7 7 TRP HB3 H 1 3.30 0.01 . . . . . . . . . . 4088 1
49 . 1 1 7 7 TRP HD1 H 1 7.25 0.01 . . . . . . . . . . 4088 1
50 . 1 1 7 7 TRP HE1 H 1 10.19 0.01 . . . . . . . . . . 4088 1
51 . 1 1 7 7 TRP HE3 H 1 7.55 0.01 . . . . . . . . . . 4088 1
52 . 1 1 7 7 TRP HZ2 H 1 7.46 0.01 . . . . . . . . . . 4088 1
53 . 1 1 7 7 TRP HZ3 H 1 7.15 0.01 . . . . . . . . . . 4088 1
54 . 1 1 7 7 TRP HH2 H 1 7.22 0.01 . . . . . . . . . . 4088 1
55 . 1 1 8 8 GLY H H 1 8.47 0.01 . . . . . . . . . . 4088 1
56 . 1 1 8 8 GLY HA2 H 1 3.72 0.01 . . . . . . . . . . 4088 1
57 . 1 1 8 8 GLY HA3 H 1 3.72 0.01 . . . . . . . . . . 4088 1
58 . 1 1 9 9 HIS H H 1 8.28 0.01 . . . . . . . . . . 4088 1
59 . 1 1 9 9 HIS HA H 1 4.61 0.01 . . . . . . . . . . 4088 1
60 . 1 1 9 9 HIS HB2 H 1 3.27 0.01 . . . . . . . . . . 4088 1
61 . 1 1 9 9 HIS HB3 H 1 3.03 0.01 . . . . . . . . . . 4088 1
62 . 1 1 9 9 HIS HD2 H 1 7.22 0.01 . . . . . . . . . . 4088 1
63 . 1 1 9 9 HIS HE1 H 1 8.47 0.01 . . . . . . . . . . 4088 1
64 . 1 1 10 10 HIS H H 1 8.59 0.01 . . . . . . . . . . 4088 1
65 . 1 1 10 10 HIS HA H 1 4.62 0.01 . . . . . . . . . . 4088 1
66 . 1 1 10 10 HIS HB2 H 1 3.19 0.01 . . . . . . . . . . 4088 1
67 . 1 1 10 10 HIS HB3 H 1 3.19 0.01 . . . . . . . . . . 4088 1
68 . 1 1 10 10 HIS HD2 H 1 7.18 0.01 . . . . . . . . . . 4088 1
69 . 1 1 10 10 HIS HE1 H 1 8.43 0.01 . . . . . . . . . . 4088 1
70 . 1 1 11 11 ARG H H 1 8.47 0.01 . . . . . . . . . . 4088 1
71 . 1 1 11 11 ARG HA H 1 4.40 0.01 . . . . . . . . . . 4088 1
72 . 1 1 11 11 ARG HB2 H 1 1.82 0.01 . . . . . . . . . . 4088 1
73 . 1 1 11 11 ARG HB3 H 1 1.71 0.01 . . . . . . . . . . 4088 1
74 . 1 1 11 11 ARG HG2 H 1 1.55 0.01 . . . . . . . . . . 4088 1
75 . 1 1 11 11 ARG HG3 H 1 1.55 0.01 . . . . . . . . . . 4088 1
76 . 1 1 11 11 ARG HD2 H 1 3.13 0.01 . . . . . . . . . . 4088 1
77 . 1 1 11 11 ARG HD3 H 1 3.13 0.01 . . . . . . . . . . 4088 1
78 . 1 1 11 11 ARG HE H 1 7.24 0.01 . . . . . . . . . . 4088 1
79 . 1 1 11 11 ARG HH11 H 1 6.89 0.01 . . . . . . . . . . 4088 1
80 . 1 1 11 11 ARG HH12 H 1 6.89 0.01 . . . . . . . . . . 4088 1
81 . 1 1 11 11 ARG HH21 H 1 6.48 0.01 . . . . . . . . . . 4088 1
82 . 1 1 11 11 ARG HH22 H 1 6.48 0.01 . . . . . . . . . . 4088 1
83 . 1 1 12 12 CYS H H 1 8.71 0.01 . . . . . . . . . . 4088 1
84 . 1 1 12 12 CYS HA H 1 4.80 0.01 . . . . . . . . . . 4088 1
85 . 1 1 12 12 CYS HB2 H 1 3.22 0.01 . . . . . . . . . . 4088 1
86 . 1 1 12 12 CYS HB3 H 1 2.98 0.01 . . . . . . . . . . 4088 1
87 . 1 1 13 13 THR H H 1 8.43 0.01 . . . . . . . . . . 4088 1
88 . 1 1 13 13 THR HA H 1 4.33 0.01 . . . . . . . . . . 4088 1
89 . 1 1 13 13 THR HB H 1 4.23 0.01 . . . . . . . . . . 4088 1
90 . 1 1 13 13 THR HG21 H 1 1.17 0.01 . . . . . . . . . . 4088 1
91 . 1 1 13 13 THR HG22 H 1 1.17 0.01 . . . . . . . . . . 4088 1
92 . 1 1 13 13 THR HG23 H 1 1.17 0.01 . . . . . . . . . . 4088 1
93 . 1 1 14 14 NH2 HN1 H 1 7.75 0.01 . . . . . . . . . . 4088 1
94 . 1 1 14 14 NH2 HN2 H 1 7.28 0.01 . . . . . . . . . . 4088 1
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save_