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 30270
_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 $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 DQF-COSY; 2D 1H-1H TOCSY; 2D 1H-1H NOESY' . . . 30270 1
2 '2D 1H-1H TOCSY' . . . 30270 1
3 '2D 1H-1H TOCSY' . . . 30270 1
4 '2D 1H-1H TOCSY' . . . 30270 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 ASN H H 1 8.410 0.02 . 1 . . . . A 1 ASN H1 . 30270 1
2 . 1 1 1 1 ASN HA H 1 4.600 0.02 . 1 . . . . A 1 ASN HA . 30270 1
3 . 1 1 1 1 ASN HB2 H 1 2.640 0.02 . 2 . . . . A 1 ASN HB2 . 30270 1
4 . 1 1 1 1 ASN HB3 H 1 2.550 0.02 . 2 . . . . A 1 ASN HB3 . 30270 1
5 . 1 1 1 1 ASN HD21 H 1 7.880 0.02 . 1 . . . . A 1 ASN HD21 . 30270 1
6 . 1 1 1 1 ASN HD22 H 1 7.105 0.02 . 1 . . . . A 1 ASN HD22 . 30270 1
7 . 1 1 2 2 VAL H H 1 7.880 0.02 . 1 . . . . A 2 VAL H . 30270 1
8 . 1 1 2 2 VAL HA H 1 3.790 0.02 . 1 . . . . A 2 VAL HA . 30270 1
9 . 1 1 2 2 VAL HB H 1 1.910 0.02 . 1 . . . . A 2 VAL HB . 30270 1
10 . 1 1 2 2 VAL HG11 H 1 0.750 0.02 . 1 . . . . A 2 VAL HG11 . 30270 1
11 . 1 1 2 2 VAL HG12 H 1 0.750 0.02 . 1 . . . . A 2 VAL HG12 . 30270 1
12 . 1 1 2 2 VAL HG13 H 1 0.750 0.02 . 1 . . . . A 2 VAL HG13 . 30270 1
13 . 1 1 3 3 HIS H H 1 8.330 0.02 . 1 . . . . A 3 HIS H . 30270 1
14 . 1 1 3 3 HIS HA H 1 4.520 0.02 . 1 . . . . A 3 HIS HA . 30270 1
15 . 1 1 3 3 HIS HB2 H 1 3.018 0.02 . 1 . . . . A 3 HIS HB2 . 30270 1
16 . 1 1 3 3 HIS HB3 H 1 3.114 0.02 . 1 . . . . A 3 HIS HB3 . 30270 1
17 . 1 1 3 3 HIS HD2 H 1 7.103 0.02 . 1 . . . . A 3 HIS HD2 . 30270 1
18 . 1 1 4 4 THR H H 1 7.745 0.02 . 1 . . . . A 4 THR H . 30270 1
19 . 1 1 4 4 THR HA H 1 4.140 0.02 . 1 . . . . A 4 THR HA . 30270 1
20 . 1 1 4 4 THR HB H 1 3.991 0.02 . 1 . . . . A 4 THR HB . 30270 1
21 . 1 1 4 4 THR HG21 H 1 1.303 0.02 . 1 . . . . A 4 THR HG1 . 30270 1
22 . 1 1 4 4 THR HG22 H 1 1.303 0.02 . 1 . . . . A 4 THR HG1 . 30270 1
23 . 1 1 4 4 THR HG23 H 1 1.303 0.02 . 1 . . . . A 4 THR HG1 . 30270 1
24 . 1 1 5 5 PHE H H 1 7.995 0.02 . 1 . . . . A 5 PHE H . 30270 1
25 . 1 1 5 5 PHE HA H 1 4.417 0.02 . 1 . . . . A 5 PHE HA . 30270 1
26 . 1 1 5 5 PHE HB2 H 1 2.902 0.02 . 1 . . . . A 5 PHE HB2 . 30270 1
27 . 1 1 5 5 PHE HB3 H 1 2.980 0.02 . 1 . . . . A 5 PHE HB3 . 30270 1
28 . 1 1 5 5 PHE HD1 H 1 7.402 0.02 . 3 . . . . A 5 PHE HD1 . 30270 1
29 . 1 1 5 5 PHE HD2 H 1 7.134 0.02 . 3 . . . . A 5 PHE HD2 . 30270 1
30 . 1 1 5 5 PHE HE1 H 1 7.074 0.02 . 3 . . . . A 5 PHE HE1 . 30270 1
31 . 1 1 5 5 PHE HE2 H 1 7.074 0.02 . 3 . . . . A 5 PHE HE2 . 30270 1
32 . 1 1 6 6 ARG H H 1 8.059 0.02 . 1 . . . . A 6 ARG H . 30270 1
33 . 1 1 6 6 ARG HA H 1 4.095 0.02 . 1 . . . . A 6 ARG HA . 30270 1
34 . 1 1 6 6 ARG HB2 H 1 1.677 0.02 . 2 . . . . A 6 ARG HB2 . 30270 1
35 . 1 1 6 6 ARG HB3 H 1 1.677 0.02 . 2 . . . . A 6 ARG HB3 . 30270 1
36 . 1 1 6 6 ARG HG2 H 1 1.535 0.02 . 2 . . . . A 6 ARG HG2 . 30270 1
37 . 1 1 6 6 ARG HG3 H 1 1.535 0.02 . 2 . . . . A 6 ARG HG3 . 30270 1
38 . 1 1 6 6 ARG HD2 H 1 2.990 0.02 . 2 . . . . A 6 ARG HD2 . 30270 1
39 . 1 1 6 6 ARG HD3 H 1 2.990 0.02 . 2 . . . . A 6 ARG HD3 . 30270 1
40 . 1 1 6 6 ARG HH11 H 1 7.086 0.02 . 2 . . . . A 6 ARG HH11 . 30270 1
41 . 1 1 6 6 ARG HH12 H 1 7.086 0.02 . 2 . . . . A 6 ARG HH12 . 30270 1
42 . 1 1 7 7 GLY H H 1 7.404 0.02 . 1 . . . . A 7 GLY H . 30270 1
43 . 1 1 7 7 GLY HA2 H 1 3.701 0.02 . 2 . . . . A 7 GLY HA2 . 30270 1
44 . 1 1 7 7 GLY HA3 H 1 3.701 0.02 . 2 . . . . A 7 GLY HA3 . 30270 1
45 . 1 1 8 8 ILE H H 1 7.746 0.02 . 1 . . . . A 8 ILE H . 30270 1
46 . 1 1 8 8 ILE HA H 1 3.980 0.02 . 1 . . . . A 8 ILE HA . 30270 1
47 . 1 1 8 8 ILE HB H 1 1.701 0.02 . 1 . . . . A 8 ILE HB . 30270 1
48 . 1 1 8 8 ILE HG12 H 1 0.988 0.02 . 1 . . . . A 8 ILE HG12 . 30270 1
49 . 1 1 8 8 ILE HG13 H 1 1.316 0.02 . 1 . . . . A 8 ILE HG13 . 30270 1
50 . 1 1 8 8 ILE HD11 H 1 0.732 0.02 . 1 . . . . A 8 ILE HD11 . 30270 1
51 . 1 1 8 8 ILE HD12 H 1 0.732 0.02 . 1 . . . . A 8 ILE HD12 . 30270 1
52 . 1 1 8 8 ILE HD13 H 1 0.732 0.02 . 1 . . . . A 8 ILE HD13 . 30270 1
53 . 1 1 9 9 ASN H H 1 8.241 0.02 . 1 . . . . A 9 ASN H . 30270 1
54 . 1 1 9 9 ASN HA H 1 4.532 0.02 . 1 . . . . A 9 ASN HA . 30270 1
55 . 1 1 9 9 ASN HB2 H 1 2.670 0.02 . 2 . . . . A 9 ASN HB2 . 30270 1
56 . 1 1 9 9 ASN HB3 H 1 2.593 0.02 . 2 . . . . A 9 ASN HB3 . 30270 1
57 . 1 1 9 9 ASN HD21 H 1 7.756 0.02 . 1 . . . . A 9 ASN HD21 . 30270 1
58 . 1 1 9 9 ASN HD22 H 1 7.102 0.02 . 1 . . . . A 9 ASN HD22 . 30270 1
59 . 1 1 10 10 GLY H H 1 8.103 0.02 . 1 . . . . A 10 GLY H . 30270 1
60 . 1 1 10 10 GLY HA2 H 1 3.723 0.02 . 1 . . . . A 10 GLY HA2 . 30270 1
61 . 1 1 10 10 GLY HA3 H 1 3.723 0.02 . 1 . . . . A 10 GLY HA3 . 30270 1
62 . 1 1 11 11 HIS H H 1 7.997 0.02 . 1 . . . . A 11 HIS H . 30270 1
63 . 1 1 11 11 HIS HA H 1 4.416 0.02 . 1 . . . . A 11 HIS HA . 30270 1
64 . 1 1 11 11 HIS HB2 H 1 2.880 0.02 . 1 . . . . A 11 HIS HB2 . 30270 1
65 . 1 1 11 11 HIS HB3 H 1 2.946 0.02 . 1 . . . . A 11 HIS HB3 . 30270 1
66 . 1 1 11 11 HIS HD2 H 1 7.135 0.02 . 1 . . . . A 11 HIS HD2 . 30270 1
67 . 1 1 11 11 HIS HE1 H 1 7.401 0.02 . 1 . . . . A 11 HIS HE1 . 30270 1
68 . 1 1 12 12 ASN H H 1 8.279 0.02 . 1 . . . . A 12 ASN H . 30270 1
69 . 1 1 12 12 ASN HA H 1 4.609 0.02 . 1 . . . . A 12 ASN HA . 30270 1
70 . 1 1 12 12 ASN HB2 H 1 2.600 0.02 . 2 . . . . A 12 ASN HB2 . 30270 1
71 . 1 1 12 12 ASN HB3 H 1 2.700 0.02 . 2 . . . . A 12 ASN HB3 . 30270 1
72 . 1 1 12 12 ASN HD21 H 1 7.099 0.02 . 1 . . . . A 12 ASN HD21 . 30270 1
73 . 1 1 13 13 SER H H 1 8.239 0.02 . 1 . . . . A 13 SER H . 30270 1
74 . 1 1 13 13 SER HA H 1 4.320 0.02 . 1 . . . . A 13 SER HA . 30270 1
75 . 1 1 13 13 SER HB2 H 1 3.723 0.02 . 1 . . . . A 13 SER HB2 . 30270 1
76 . 1 1 13 13 SER HB3 H 1 3.806 0.02 . 1 . . . . A 13 SER HB3 . 30270 1
77 . 1 1 14 14 SER H H 1 8.186 0.02 . 1 . . . . A 14 SER H . 30270 1
78 . 1 1 14 14 SER HA H 1 4.330 0.02 . 1 . . . . A 14 SER HA . 30270 1
79 . 1 1 14 14 SER HB2 H 1 3.716 0.02 . 1 . . . . A 14 SER HB2 . 30270 1
80 . 1 1 14 14 SER HB3 H 1 3.781 0.02 . 1 . . . . A 14 SER HB3 . 30270 1
81 . 1 1 15 15 SER H H 1 8.083 0.02 . 1 . . . . A 15 SER H . 30270 1
82 . 1 1 15 15 SER HA H 1 4.301 0.02 . 1 . . . . A 15 SER HA . 30270 1
83 . 1 1 15 15 SER HB2 H 1 3.697 0.02 . 1 . . . . A 15 SER HB2 . 30270 1
84 . 1 1 15 15 SER HB3 H 1 3.787 0.02 . 1 . . . . A 15 SER HB3 . 30270 1
85 . 1 1 16 16 SER H H 1 8.068 0.02 . 1 . . . . A 16 SER H . 30270 1
86 . 1 1 16 16 SER HA H 1 4.294 0.02 . 1 . . . . A 16 SER HA . 30270 1
87 . 1 1 16 16 SER HB2 H 1 3.716 0.02 . 1 . . . . A 16 SER HB2 . 30270 1
88 . 1 1 16 16 SER HB3 H 1 3.806 0.02 . 1 . . . . A 16 SER HB3 . 30270 1
89 . 1 1 17 17 LEU H H 1 7.841 0.02 . 1 . . . . A 17 LEU H . 30270 1
90 . 1 1 17 17 LEU HA H 1 4.147 0.02 . 1 . . . . A 17 LEU HA . 30270 1
91 . 1 1 17 17 LEU HB2 H 1 1.508 0.02 . 2 . . . . A 17 LEU HB2 . 30270 1
92 . 1 1 17 17 LEU HB3 H 1 1.508 0.02 . 2 . . . . A 17 LEU HB3 . 30270 1
93 . 1 1 17 17 LEU HG H 1 1.508 0.02 . 1 . . . . A 17 LEU HG . 30270 1
94 . 1 1 17 17 LEU HD21 H 1 0.710 0.02 . 2 . . . . A 17 LEU HD21 . 30270 1
95 . 1 1 17 17 LEU HD22 H 1 0.710 0.02 . 2 . . . . A 17 LEU HD22 . 30270 1
96 . 1 1 17 17 LEU HD23 H 1 0.710 0.02 . 2 . . . . A 17 LEU HD23 . 30270 1
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save_