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 27357
_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 $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 TOCSY' . . . 27357 1
2 '2D 1H-1H ROESY' . . . 27357 1
stop_
loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
2 $NMRFAM-Sparky . . 27357 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_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 ALA H H 1 7.999 0.02 . 1 . . . . . 1 ALA H . 27357 1
2 . 1 . 1 1 1 ALA HA H 1 4.029 0.02 . 1 . . . . . 1 ALA HA . 27357 1
3 . 1 . 1 1 1 ALA HB1 H 1 0.800 0.02 . 1 . . . . . 1 ALA HB1 . 27357 1
4 . 1 . 1 1 1 ALA HB2 H 1 0.800 0.02 . 1 . . . . . 1 ALA HB2 . 27357 1
5 . 1 . 1 1 1 ALA HB3 H 1 0.800 0.02 . 1 . . . . . 1 ALA HB3 . 27357 1
6 . 1 . 1 2 2 CYS H H 1 8.572 0.02 . 1 . . . . . 2 CYS H . 27357 1
7 . 1 . 1 2 2 CYS HA H 1 5.338 0.02 . 1 . . . . . 2 CYS HA . 27357 1
8 . 1 . 1 2 2 CYS HB2 H 1 2.946 0.02 . . . . . . . 2 CYS HB2 . 27357 1
9 . 1 . 1 2 2 CYS HB3 H 1 2.405 0.02 . . . . . . . 2 CYS HB3 . 27357 1
10 . 1 . 1 3 3 PHE H H 1 8.717 0.02 . 1 . . . . . 3 PHE H . 27357 1
11 . 1 . 1 3 3 PHE HA H 1 4.826 0.02 . 1 . . . . . 3 PHE HA . 27357 1
12 . 1 . 1 3 3 PHE HB2 H 1 3.035 0.02 . . . . . . . 3 PHE HB2 . 27357 1
13 . 1 . 1 3 3 PHE HB3 H 1 2.919 0.02 . . . . . . . 3 PHE HB3 . 27357 1
14 . 1 . 1 3 3 PHE HD1 H 1 7.047 0.02 . . . . . . . 3 PHE HD1 . 27357 1
15 . 1 . 1 3 3 PHE HD2 H 1 7.047 0.02 . . . . . . . 3 PHE HD2 . 27357 1
16 . 1 . 1 3 3 PHE HE1 H 1 7.189 0.02 . . . . . . . 3 PHE HE1 . 27357 1
17 . 1 . 1 3 3 PHE HE2 H 1 7.189 0.02 . . . . . . . 3 PHE HE2 . 27357 1
18 . 1 . 1 3 3 PHE HZ H 1 7.467 0.02 . 1 . . . . . 3 PHE HZ . 27357 1
19 . 1 . 1 4 4 LEU H H 1 8.352 0.02 . 1 . . . . . 4 LEU H . 27357 1
20 . 1 . 1 4 4 LEU HA H 1 4.425 0.02 . 1 . . . . . 4 LEU HA . 27357 1
21 . 1 . 1 4 4 LEU HB2 H 1 1.260 0.02 . . . . . . . 4 LEU HB2 . 27357 1
22 . 1 . 1 4 4 LEU HB3 H 1 1.518 0.02 . . . . . . . 4 LEU HB3 . 27357 1
23 . 1 . 1 4 4 LEU HG H 1 1.402 0.02 . 1 . . . . . 4 LEU HG . 27357 1
24 . 1 . 1 4 4 LEU HD11 H 1 0.419 0.02 . . . . . . . 4 LEU HD11 . 27357 1
25 . 1 . 1 4 4 LEU HD12 H 1 0.419 0.02 . . . . . . . 4 LEU HD12 . 27357 1
26 . 1 . 1 4 4 LEU HD13 H 1 0.419 0.02 . . . . . . . 4 LEU HD13 . 27357 1
27 . 1 . 1 4 4 LEU HD21 H 1 0.609 0.02 . . . . . . . 4 LEU HD21 . 27357 1
28 . 1 . 1 4 4 LEU HD22 H 1 0.609 0.02 . . . . . . . 4 LEU HD22 . 27357 1
29 . 1 . 1 4 4 LEU HD23 H 1 0.609 0.02 . . . . . . . 4 LEU HD23 . 27357 1
30 . 1 . 1 5 5 THR H H 1 8.816 0.02 . 1 . . . . . 5 THR H . 27357 1
31 . 1 . 1 5 5 THR HA H 1 4.521 0.02 . 1 . . . . . 5 THR HA . 27357 1
32 . 1 . 1 5 5 THR HB H 1 4.522 0.02 . 1 . . . . . 5 THR HB . 27357 1
33 . 1 . 1 5 5 THR HG21 H 1 1.218 0.02 . 1 . . . . . 5 THR HG21 . 27357 1
34 . 1 . 1 5 5 THR HG22 H 1 1.218 0.02 . 1 . . . . . 5 THR HG22 . 27357 1
35 . 1 . 1 5 5 THR HG23 H 1 1.218 0.02 . 1 . . . . . 5 THR HG23 . 27357 1
36 . 1 . 1 6 6 ARG H H 1 8.899 0.02 . 1 . . . . . 6 ARG H . 27357 1
37 . 1 . 1 6 6 ARG HA H 1 4.123 0.02 . 1 . . . . . 6 ARG HA . 27357 1
38 . 1 . 1 6 6 ARG HB2 H 1 1.844 0.02 . . . . . . . 6 ARG HB2 . 27357 1
39 . 1 . 1 6 6 ARG HB3 H 1 1.844 0.02 . . . . . . . 6 ARG HB3 . 27357 1
40 . 1 . 1 6 6 ARG HG2 H 1 1.621 0.02 . . . . . . . 6 ARG HG2 . 27357 1
41 . 1 . 1 6 6 ARG HG3 H 1 1.621 0.02 . . . . . . . 6 ARG HG3 . 27357 1
42 . 1 . 1 6 6 ARG HD2 H 1 3.161 0.02 . . . . . . . 6 ARG HD2 . 27357 1
43 . 1 . 1 6 6 ARG HD3 H 1 3.161 0.02 . . . . . . . 6 ARG HD3 . 27357 1
44 . 1 . 1 6 6 ARG HE H 1 7.168 0.02 . 1 . . . . . 6 ARG HE . 27357 1
45 . 1 . 1 7 7 LEU H H 1 7.457 0.02 . 1 . . . . . 7 LEU H . 27357 1
46 . 1 . 1 7 7 LEU HA H 1 4.300 0.02 . 1 . . . . . 7 LEU HA . 27357 1
47 . 1 . 1 7 7 LEU HB2 H 1 1.550 0.02 . . . . . . . 7 LEU HB2 . 27357 1
48 . 1 . 1 7 7 LEU HB3 H 1 1.550 0.02 . . . . . . . 7 LEU HB3 . 27357 1
49 . 1 . 1 7 7 LEU HG H 1 1.634 0.02 . 1 . . . . . 7 LEU HG . 27357 1
50 . 1 . 1 7 7 LEU HD11 H 1 0.784 0.02 . . . . . . . 7 LEU HD11 . 27357 1
51 . 1 . 1 7 7 LEU HD12 H 1 0.784 0.02 . . . . . . . 7 LEU HD12 . 27357 1
52 . 1 . 1 7 7 LEU HD13 H 1 0.784 0.02 . . . . . . . 7 LEU HD13 . 27357 1
53 . 1 . 1 7 7 LEU HD21 H 1 0.840 0.02 . . . . . . . 7 LEU HD21 . 27357 1
54 . 1 . 1 7 7 LEU HD22 H 1 0.840 0.02 . . . . . . . 7 LEU HD22 . 27357 1
55 . 1 . 1 7 7 LEU HD23 H 1 0.840 0.02 . . . . . . . 7 LEU HD23 . 27357 1
56 . 1 . 1 8 8 GLY H H 1 7.935 0.02 . 1 . . . . . 8 GLY H . 27357 1
57 . 1 . 1 8 8 GLY HA2 H 1 3.498 0.02 . . . . . . . 8 GLY HA2 . 27357 1
58 . 1 . 1 8 8 GLY HA3 H 1 4.108 0.02 . . . . . . . 8 GLY HA3 . 27357 1
59 . 1 . 1 9 9 THR H H 1 7.007 0.02 . 1 . . . . . 9 THR H . 27357 1
60 . 1 . 1 9 9 THR HA H 1 4.364 0.02 . 1 . . . . . 9 THR HA . 27357 1
61 . 1 . 1 9 9 THR HB H 1 4.105 0.02 . 1 . . . . . 9 THR HB . 27357 1
62 . 1 . 1 9 9 THR HG21 H 1 1.004 0.02 . 1 . . . . . 9 THR HG21 . 27357 1
63 . 1 . 1 9 9 THR HG22 H 1 1.004 0.02 . 1 . . . . . 9 THR HG22 . 27357 1
64 . 1 . 1 9 9 THR HG23 H 1 1.004 0.02 . 1 . . . . . 9 THR HG23 . 27357 1
65 . 1 . 1 10 10 TYR H H 1 8.694 0.02 . 1 . . . . . 10 TYR H . 27357 1
66 . 1 . 1 10 10 TYR HA H 1 5.070 0.02 . 1 . . . . . 10 TYR HA . 27357 1
67 . 1 . 1 10 10 TYR HB2 H 1 2.694 0.02 . . . . . . . 10 TYR HB2 . 27357 1
68 . 1 . 1 10 10 TYR HB3 H 1 2.694 0.02 . . . . . . . 10 TYR HB3 . 27357 1
69 . 1 . 1 10 10 TYR HD1 H 1 6.813 0.02 . . . . . . . 10 TYR HD1 . 27357 1
70 . 1 . 1 10 10 TYR HD2 H 1 6.813 0.02 . . . . . . . 10 TYR HD2 . 27357 1
71 . 1 . 1 10 10 TYR HE1 H 1 6.646 0.02 . . . . . . . 10 TYR HE1 . 27357 1
72 . 1 . 1 10 10 TYR HE2 H 1 6.646 0.02 . . . . . . . 10 TYR HE2 . 27357 1
73 . 1 . 1 11 11 VAL H H 1 8.777 0.02 . 1 . . . . . 11 VAL H . 27357 1
74 . 1 . 1 11 11 VAL HA H 1 4.201 0.02 . 1 . . . . . 11 VAL HA . 27357 1
75 . 1 . 1 11 11 VAL HB H 1 1.564 0.02 . 1 . . . . . 11 VAL HB . 27357 1
76 . 1 . 1 11 11 VAL HG11 H 1 0.708 0.02 . . . . . . . 11 VAL HG11 . 27357 1
77 . 1 . 1 11 11 VAL HG12 H 1 0.708 0.02 . . . . . . . 11 VAL HG12 . 27357 1
78 . 1 . 1 11 11 VAL HG13 H 1 0.708 0.02 . . . . . . . 11 VAL HG13 . 27357 1
79 . 1 . 1 11 11 VAL HG21 H 1 0.782 0.02 . . . . . . . 11 VAL HG21 . 27357 1
80 . 1 . 1 11 11 VAL HG22 H 1 0.782 0.02 . . . . . . . 11 VAL HG22 . 27357 1
81 . 1 . 1 11 11 VAL HG23 H 1 0.782 0.02 . . . . . . . 11 VAL HG23 . 27357 1
82 . 1 . 1 12 12 CYS H H 1 8.648 0.02 . 1 . . . . . 12 CYS H . 27357 1
83 . 1 . 1 12 12 CYS HA H 1 5.123 0.02 . 1 . . . . . 12 CYS HA . 27357 1
84 . 1 . 1 12 12 CYS HB2 H 1 2.853 0.02 . . . . . . . 12 CYS HB2 . 27357 1
85 . 1 . 1 12 12 CYS HB3 H 1 2.981 0.02 . . . . . . . 12 CYS HB3 . 27357 1
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save_