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 18335
_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 COSY' . . . 18335 1
2 '2D 1H-1H TOCSY' . . . 18335 1
3 '2D 1H-1H NOESY' . . . 18335 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 HIS HB2 H 1 3.27 0.01 . 2 . . . A 1 HIS HB2 . 18335 1
2 . 1 1 1 1 HIS HB3 H 1 3.07 0.01 . 2 . . . A 1 HIS HB3 . 18335 1
3 . 1 1 1 1 HIS HD2 H 1 7.30 0.01 . 1 . . . A 1 HIS HD2 . 18335 1
4 . 1 1 1 1 HIS HE1 H 1 8.35 0.01 . 1 . . . A 1 HIS HE1 . 18335 1
5 . 1 1 2 2 GLY H H 1 8.14 0.01 . 1 . . . A 2 GLY H . 18335 1
6 . 1 1 2 2 GLY HA2 H 1 4.19 0.01 . 2 . . . A 2 GLY HA2 . 18335 1
7 . 1 1 2 2 GLY HA3 H 1 3.81 0.01 . 2 . . . A 2 GLY HA3 . 18335 1
8 . 1 1 3 3 LEU H H 1 9.04 0.01 . 1 . . . A 3 LEU H . 18335 1
9 . 1 1 3 3 LEU HA H 1 4.04 0.01 . 1 . . . A 3 LEU HA . 18335 1
10 . 1 1 3 3 LEU HB2 H 1 1.66 0.01 . 2 . . . A 3 LEU HB2 . 18335 1
11 . 1 1 3 3 LEU HG H 1 1.55 0.01 . 1 . . . A 3 LEU HG . 18335 1
12 . 1 1 3 3 LEU HD11 H 1 0.80 0.01 . 2 . . . A 3 LEU HD11 . 18335 1
13 . 1 1 3 3 LEU HD12 H 1 0.80 0.01 . 2 . . . A 3 LEU HD12 . 18335 1
14 . 1 1 3 3 LEU HD13 H 1 0.80 0.01 . 2 . . . A 3 LEU HD13 . 18335 1
15 . 1 1 4 4 ALA H H 1 8.79 0.01 . 1 . . . A 4 ALA H . 18335 1
16 . 1 1 4 4 ALA HA H 1 3.93 0.01 . 1 . . . A 4 ALA HA . 18335 1
17 . 1 1 4 4 ALA HB1 H 1 1.39 0.01 . 1 . . . A 4 ALA HB1 . 18335 1
18 . 1 1 4 4 ALA HB2 H 1 1.39 0.01 . 1 . . . A 4 ALA HB2 . 18335 1
19 . 1 1 4 4 ALA HB3 H 1 1.39 0.01 . 1 . . . A 4 ALA HB3 . 18335 1
20 . 1 1 5 5 SER H H 1 7.83 0.01 . 1 . . . A 5 SER H . 18335 1
21 . 1 1 5 5 SER HA H 1 3.90 0.01 . 1 . . . A 5 SER HA . 18335 1
22 . 1 1 5 5 SER HB2 H 1 3.86 0.01 . 2 . . . A 5 SER HB2 . 18335 1
23 . 1 1 5 5 SER HB3 H 1 3.83 0.01 . 2 . . . A 5 SER HB3 . 18335 1
24 . 1 1 6 6 THR H H 1 8.01 0.01 . 1 . . . A 6 THR H . 18335 1
25 . 1 1 6 6 THR HA H 1 3.90 0.01 . 1 . . . A 6 THR HA . 18335 1
26 . 1 1 6 6 THR HG21 H 1 1.17 0.01 . 1 . . . A 6 THR HG21 . 18335 1
27 . 1 1 6 6 THR HG22 H 1 1.17 0.01 . 1 . . . A 6 THR HG22 . 18335 1
28 . 1 1 6 6 THR HG23 H 1 1.17 0.01 . 1 . . . A 6 THR HG23 . 18335 1
29 . 1 1 7 7 LEU H H 1 7.60 0.01 . 1 . . . A 7 LEU H . 18335 1
30 . 1 1 7 7 LEU HA H 1 4.03 0.01 . 1 . . . A 7 LEU HA . 18335 1
31 . 1 1 7 7 LEU HB2 H 1 1.72 0.01 . 2 . . . A 7 LEU HB2 . 18335 1
32 . 1 1 7 7 LEU HG H 1 1.57 0.01 . 1 . . . A 7 LEU HG . 18335 1
33 . 1 1 7 7 LEU HD11 H 1 1.22 0.01 . 2 . . . A 7 LEU HD11 . 18335 1
34 . 1 1 7 7 LEU HD12 H 1 1.22 0.01 . 2 . . . A 7 LEU HD12 . 18335 1
35 . 1 1 7 7 LEU HD13 H 1 1.22 0.01 . 2 . . . A 7 LEU HD13 . 18335 1
36 . 1 1 8 8 THR H H 1 7.42 0.01 . 1 . . . A 8 THR H . 18335 1
37 . 1 1 8 8 THR HA H 1 4.05 0.01 . 1 . . . A 8 THR HA . 18335 1
38 . 1 1 8 8 THR HB H 1 3.87 0.01 . 1 . . . A 8 THR HB . 18335 1
39 . 1 1 9 9 ARG H H 1 7.65 0.01 . 1 . . . A 9 ARG H . 18335 1
40 . 1 1 9 9 ARG HA H 1 4.04 0.01 . 1 . . . A 9 ARG HA . 18335 1
41 . 1 1 9 9 ARG HB3 H 1 1.79 0.01 . 2 . . . A 9 ARG HB3 . 18335 1
42 . 1 1 9 9 ARG HG2 H 1 1.62 0.01 . 2 . . . A 9 ARG HG2 . 18335 1
43 . 1 1 10 10 TRP H H 1 7.94 0.01 . 1 . . . A 10 TRP H . 18335 1
44 . 1 1 10 10 TRP HA H 1 4.49 0.01 . 1 . . . A 10 TRP HA . 18335 1
45 . 1 1 10 10 TRP HB2 H 1 3.21 0.01 . 2 . . . A 10 TRP HB2 . 18335 1
46 . 1 1 10 10 TRP HB3 H 1 3.40 0.01 . 2 . . . A 10 TRP HB3 . 18335 1
47 . 1 1 10 10 TRP HD1 H 1 7.27 0.01 . 1 . . . A 10 TRP HD1 . 18335 1
48 . 1 1 10 10 TRP HE1 H 1 10.55 0.01 . 1 . . . A 10 TRP HE1 . 18335 1
49 . 1 1 10 10 TRP HZ2 H 1 7.35 0.01 . 1 . . . A 10 TRP HZ2 . 18335 1
50 . 1 1 10 10 TRP HH2 H 1 7.33 0.01 . 1 . . . A 10 TRP HH2 . 18335 1
51 . 1 1 11 11 ALA H H 1 8.20 0.01 . 1 . . . A 11 ALA H . 18335 1
52 . 1 1 11 11 ALA HA H 1 3.95 0.01 . 1 . . . A 11 ALA HA . 18335 1
53 . 1 1 11 11 ALA HB1 H 1 1.30 0.01 . 1 . . . A 11 ALA HB1 . 18335 1
54 . 1 1 11 11 ALA HB2 H 1 1.30 0.01 . 1 . . . A 11 ALA HB2 . 18335 1
55 . 1 1 11 11 ALA HB3 H 1 1.30 0.01 . 1 . . . A 11 ALA HB3 . 18335 1
56 . 1 1 12 12 HIS H H 1 7.53 0.01 . 1 . . . A 12 HIS H . 18335 1
57 . 1 1 12 12 HIS HA H 1 4.37 0.01 . 1 . . . A 12 HIS HA . 18335 1
58 . 1 1 12 12 HIS HB2 H 1 2.78 0.01 . 2 . . . A 12 HIS HB2 . 18335 1
59 . 1 1 12 12 HIS HB3 H 1 3.09 0.01 . 2 . . . A 12 HIS HB3 . 18335 1
60 . 1 1 12 12 HIS HD2 H 1 6.90 0.01 . 1 . . . A 12 HIS HD2 . 18335 1
61 . 1 1 12 12 HIS HE1 H 1 8.45 0.01 . 1 . . . A 12 HIS HE1 . 18335 1
62 . 1 1 13 13 TYR H H 1 8.02 0.01 . 1 . . . A 13 TYR H . 18335 1
63 . 1 1 13 13 TYR HA H 1 4.02 0.01 . 1 . . . A 13 TYR HA . 18335 1
64 . 1 1 13 13 TYR HB3 H 1 3.04 0.01 . 2 . . . A 13 TYR HB3 . 18335 1
65 . 1 1 13 13 TYR HD2 H 1 6.99 0.01 . 3 . . . A 13 TYR HD2 . 18335 1
66 . 1 1 13 13 TYR HE2 H 1 6.71 0.01 . 3 . . . A 13 TYR HE2 . 18335 1
67 . 1 1 14 14 ASN H H 1 8.18 0.01 . 1 . . . A 14 ASN H . 18335 1
68 . 1 1 14 14 ASN HA H 1 4.25 0.01 . 1 . . . A 14 ASN HA . 18335 1
69 . 1 1 14 14 ASN HB3 H 1 2.52 0.01 . 2 . . . A 14 ASN HB3 . 18335 1
70 . 1 1 14 14 ASN HD21 H 1 6.66 0.01 . 2 . . . A 14 ASN HD21 . 18335 1
71 . 1 1 14 14 ASN HD22 H 1 7.32 0.01 . 2 . . . A 14 ASN HD22 . 18335 1
72 . 1 1 15 15 ALA H H 1 7.77 0.01 . 1 . . . A 15 ALA H . 18335 1
73 . 1 1 15 15 ALA HA H 1 4.00 0.01 . 1 . . . A 15 ALA HA . 18335 1
74 . 1 1 15 15 ALA HB1 H 1 1.35 0.01 . 1 . . . A 15 ALA HB1 . 18335 1
75 . 1 1 15 15 ALA HB2 H 1 1.35 0.01 . 1 . . . A 15 ALA HB2 . 18335 1
76 . 1 1 15 15 ALA HB3 H 1 1.35 0.01 . 1 . . . A 15 ALA HB3 . 18335 1
77 . 1 1 16 16 LEU H H 1 7.83 0.01 . 1 . . . A 16 LEU H . 18335 1
78 . 1 1 16 16 LEU HA H 1 4.11 0.01 . 1 . . . A 16 LEU HA . 18335 1
79 . 1 1 16 16 LEU HB2 H 1 1.72 0.01 . 2 . . . A 16 LEU HB2 . 18335 1
80 . 1 1 16 16 LEU HD11 H 1 0.96 0.01 . 2 . . . A 16 LEU HD11 . 18335 1
81 . 1 1 16 16 LEU HD12 H 1 0.96 0.01 . 2 . . . A 16 LEU HD12 . 18335 1
82 . 1 1 16 16 LEU HD13 H 1 0.96 0.01 . 2 . . . A 16 LEU HD13 . 18335 1
83 . 1 1 17 17 ILE H H 1 7.52 0.01 . 1 . . . A 17 ILE H . 18335 1
84 . 1 1 17 17 ILE HA H 1 3.86 0.01 . 1 . . . A 17 ILE HA . 18335 1
85 . 1 1 17 17 ILE HB H 1 1.81 0.01 . 1 . . . A 17 ILE HB . 18335 1
86 . 1 1 17 17 ILE HG12 H 1 1.57 0.01 . 2 . . . A 17 ILE HG12 . 18335 1
87 . 1 1 17 17 ILE HG13 H 1 1.12 0.01 . 2 . . . A 17 ILE HG13 . 18335 1
88 . 1 1 17 17 ILE HD11 H 1 0.78 0.01 . 1 . . . A 17 ILE HD11 . 18335 1
89 . 1 1 17 17 ILE HD12 H 1 0.78 0.01 . 1 . . . A 17 ILE HD12 . 18335 1
90 . 1 1 17 17 ILE HD13 H 1 0.78 0.01 . 1 . . . A 17 ILE HD13 . 18335 1
91 . 1 1 18 18 ARG H H 1 7.64 0.01 . 1 . . . A 18 ARG H . 18335 1
92 . 1 1 18 18 ARG HA H 1 4.06 0.01 . 1 . . . A 18 ARG HA . 18335 1
93 . 1 1 18 18 ARG HB2 H 1 1.70 0.01 . 2 . . . A 18 ARG HB2 . 18335 1
94 . 1 1 18 18 ARG HG2 H 1 1.35 0.01 . 2 . . . A 18 ARG HG2 . 18335 1
95 . 1 1 19 19 ALA H H 1 7.59 0.01 . 1 . . . A 19 ALA H . 18335 1
96 . 1 1 19 19 ALA HA H 1 4.13 0.01 . 1 . . . A 19 ALA HA . 18335 1
97 . 1 1 19 19 ALA HB1 H 1 1.22 0.01 . 1 . . . A 19 ALA HB1 . 18335 1
98 . 1 1 19 19 ALA HB2 H 1 1.22 0.01 . 1 . . . A 19 ALA HB2 . 18335 1
99 . 1 1 19 19 ALA HB3 H 1 1.22 0.01 . 1 . . . A 19 ALA HB3 . 18335 1
100 . 1 1 20 20 PHE H H 1 7.41 0.01 . 1 . . . A 20 PHE H . 18335 1
101 . 1 1 20 20 PHE HA H 1 4.35 0.01 . 1 . . . A 20 PHE HA . 18335 1
102 . 1 1 20 20 PHE HB2 H 1 2.94 0.01 . 2 . . . A 20 PHE HB2 . 18335 1
103 . 1 1 20 20 PHE HB3 H 1 3.13 0.01 . 2 . . . A 20 PHE HB3 . 18335 1
104 . 1 1 20 20 PHE HD2 H 1 6.83 0.01 . 3 . . . A 20 PHE HD2 . 18335 1
105 . 1 1 20 20 PHE HE2 H 1 6.96 0.01 . 3 . . . A 20 PHE HE2 . 18335 1
stop_
save_