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 11552
_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 0.01
_Assigned_chem_shift_list.Chem_shift_13C_err 0.1
_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 'spectral resolution'
_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' 1 $sample_1 isotropic 11552 1
3 '2D 1H-1H NOESY' 1 $sample_1 isotropic 11552 1
4 '2D 1H-13C HSQC aliphatic' 1 $sample_1 isotropic 11552 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 GLY HA2 H 1 3.873 0.010 . 2 . . . A 1 GLY HA2 . 11552 1
2 . 1 1 1 1 GLY HA3 H 1 3.691 0.010 . 2 . . . A 1 GLY HA3 . 11552 1
3 . 1 1 1 1 GLY CA C 13 43.865 0.100 . 1 . . . A 1 GLY CA . 11552 1
4 . 1 1 2 2 LEU HA H 1 4.113 0.010 . 1 . . . A 2 LEU HA . 11552 1
5 . 1 1 2 2 LEU HB2 H 1 1.664 0.010 . 2 . . . A 2 LEU HB2 . 11552 1
6 . 1 1 2 2 LEU HB3 H 1 1.712 0.010 . 2 . . . A 2 LEU HB3 . 11552 1
7 . 1 1 2 2 LEU HG H 1 1.731 0.010 . 1 . . . A 2 LEU HG . 11552 1
8 . 1 1 2 2 LEU HD11 H 1 1.001 0.010 . 2 . . . A 2 LEU HD11 . 11552 1
9 . 1 1 2 2 LEU HD12 H 1 1.001 0.010 . 2 . . . A 2 LEU HD12 . 11552 1
10 . 1 1 2 2 LEU HD13 H 1 1.001 0.010 . 2 . . . A 2 LEU HD13 . 11552 1
11 . 1 1 2 2 LEU HD21 H 1 0.902 0.010 . 2 . . . A 2 LEU HD21 . 11552 1
12 . 1 1 2 2 LEU HD22 H 1 0.902 0.010 . 2 . . . A 2 LEU HD22 . 11552 1
13 . 1 1 2 2 LEU HD23 H 1 0.902 0.010 . 2 . . . A 2 LEU HD23 . 11552 1
14 . 1 1 2 2 LEU CA C 13 58.625 0.100 . 1 . . . A 2 LEU CA . 11552 1
15 . 1 1 2 2 LEU CB C 13 42.802 0.100 . 1 . . . A 2 LEU CB . 11552 1
16 . 1 1 2 2 LEU CG C 13 27.226 0.100 . 1 . . . A 2 LEU CG . 11552 1
17 . 1 1 3 3 LEU H H 1 8.843 0.010 . 1 . . . A 3 LEU H . 11552 1
18 . 1 1 3 3 LEU HA H 1 3.994 0.010 . 1 . . . A 3 LEU HA . 11552 1
19 . 1 1 3 3 LEU HB2 H 1 1.709 0.010 . 2 . . . A 3 LEU HB2 . 11552 1
20 . 1 1 3 3 LEU HB3 H 1 1.592 0.010 . 2 . . . A 3 LEU HB3 . 11552 1
21 . 1 1 3 3 LEU HD11 H 1 0.912 0.010 . 2 . . . A 3 LEU HD11 . 11552 1
22 . 1 1 3 3 LEU HD12 H 1 0.912 0.010 . 2 . . . A 3 LEU HD12 . 11552 1
23 . 1 1 3 3 LEU HD13 H 1 0.912 0.010 . 2 . . . A 3 LEU HD13 . 11552 1
24 . 1 1 3 3 LEU HD21 H 1 0.866 0.010 . 2 . . . A 3 LEU HD21 . 11552 1
25 . 1 1 3 3 LEU HD22 H 1 0.866 0.010 . 2 . . . A 3 LEU HD22 . 11552 1
26 . 1 1 3 3 LEU HD23 H 1 0.866 0.010 . 2 . . . A 3 LEU HD23 . 11552 1
27 . 1 1 3 3 LEU CA C 13 58.625 0.100 . 1 . . . A 3 LEU CA . 11552 1
28 . 1 1 3 3 LEU CB C 13 40.832 0.100 . 1 . . . A 3 LEU CB . 11552 1
29 . 1 1 3 3 LEU CD1 C 13 24.592 0.100 . 2 . . . A 3 LEU CD1 . 11552 1
30 . 1 1 3 3 LEU CD2 C 13 24.334 0.100 . 2 . . . A 3 LEU CD2 . 11552 1
31 . 1 1 4 4 LYS H H 1 7.983 0.010 . 1 . . . A 4 LYS H . 11552 1
32 . 1 1 4 4 LYS HA H 1 3.865 0.010 . 1 . . . A 4 LYS HA . 11552 1
33 . 1 1 4 4 LYS HB2 H 1 1.791 0.010 . 1 . . . A 4 LYS HB2 . 11552 1
34 . 1 1 4 4 LYS HB3 H 1 1.791 0.010 . 1 . . . A 4 LYS HB3 . 11552 1
35 . 1 1 4 4 LYS HG2 H 1 1.290 0.010 . 2 . . . A 4 LYS HG2 . 11552 1
36 . 1 1 4 4 LYS HG3 H 1 1.365 0.010 . 2 . . . A 4 LYS HG3 . 11552 1
37 . 1 1 4 4 LYS HD2 H 1 1.590 0.010 . 2 . . . A 4 LYS HD2 . 11552 1
38 . 1 1 4 4 LYS HD3 H 1 1.590 0.010 . 2 . . . A 4 LYS HD3 . 11552 1
39 . 1 1 4 4 LYS HE2 H 1 2.861 0.010 . 1 . . . A 4 LYS HE2 . 11552 1
40 . 1 1 4 4 LYS HE3 H 1 2.861 0.010 . 1 . . . A 4 LYS HE3 . 11552 1
41 . 1 1 4 4 LYS CA C 13 59.452 0.100 . 1 . . . A 4 LYS CA . 11552 1
42 . 1 1 4 4 LYS CB C 13 32.096 0.100 . 1 . . . A 4 LYS CB . 11552 1
43 . 1 1 4 4 LYS CG C 13 24.902 0.100 . 1 . . . A 4 LYS CG . 11552 1
44 . 1 1 4 4 LYS CD C 13 29.526 0.100 . 1 . . . A 4 LYS CD . 11552 1
45 . 1 1 5 5 TRP H H 1 7.932 0.010 . 1 . . . A 5 TRP H . 11552 1
46 . 1 1 5 5 TRP HA H 1 4.370 0.010 . 1 . . . A 5 TRP HA . 11552 1
47 . 1 1 5 5 TRP HB2 H 1 3.311 0.010 . 2 . . . A 5 TRP HB2 . 11552 1
48 . 1 1 5 5 TRP HB3 H 1 3.439 0.010 . 2 . . . A 5 TRP HB3 . 11552 1
49 . 1 1 5 5 TRP HD1 H 1 7.256 0.010 . 1 . . . A 5 TRP HD1 . 11552 1
50 . 1 1 5 5 TRP HE1 H 1 10.54 0.010 . 1 . . . A 5 TRP HE1 . 11552 1
51 . 1 1 5 5 TRP HE3 H 1 7.466 0.010 . 1 . . . A 5 TRP HE3 . 11552 1
52 . 1 1 5 5 TRP HZ2 H 1 7.408 0.010 . 1 . . . A 5 TRP HZ2 . 11552 1
53 . 1 1 5 5 TRP HZ3 H 1 6.863 0.010 . 1 . . . A 5 TRP HZ3 . 11552 1
54 . 1 1 5 5 TRP HH2 H 1 7.005 0.010 . 1 . . . A 5 TRP HH2 . 11552 1
55 . 1 1 5 5 TRP CB C 13 28.729 0.100 . 1 . . . A 5 TRP CB . 11552 1
56 . 1 1 6 6 ILE H H 1 8.479 0.010 . 1 . . . A 6 ILE H . 11552 1
57 . 1 1 6 6 ILE HA H 1 3.392 0.010 . 1 . . . A 6 ILE HA . 11552 1
58 . 1 1 6 6 ILE HB H 1 1.980 0.010 . 1 . . . A 6 ILE HB . 11552 1
59 . 1 1 6 6 ILE HG12 H 1 1.845 0.010 . 2 . . . A 6 ILE HG12 . 11552 1
60 . 1 1 6 6 ILE HG13 H 1 1.137 0.010 . 2 . . . A 6 ILE HG13 . 11552 1
61 . 1 1 6 6 ILE HG21 H 1 0.844 0.010 . 1 . . . A 6 ILE HG21 . 11552 1
62 . 1 1 6 6 ILE HG22 H 1 0.844 0.010 . 1 . . . A 6 ILE HG22 . 11552 1
63 . 1 1 6 6 ILE HG23 H 1 0.844 0.010 . 1 . . . A 6 ILE HG23 . 11552 1
64 . 1 1 6 6 ILE HD11 H 1 0.783 0.010 . 1 . . . A 6 ILE HD11 . 11552 1
65 . 1 1 6 6 ILE HD12 H 1 0.783 0.010 . 1 . . . A 6 ILE HD12 . 11552 1
66 . 1 1 6 6 ILE HD13 H 1 0.783 0.010 . 1 . . . A 6 ILE HD13 . 11552 1
67 . 1 1 6 6 ILE CA C 13 64.935 0.100 . 1 . . . A 6 ILE CA . 11552 1
68 . 1 1 6 6 ILE CB C 13 37.522 0.100 . 1 . . . A 6 ILE CB . 11552 1
69 . 1 1 6 6 ILE CG1 C 13 29.207 0.100 . 1 . . . A 6 ILE CG1 . 11552 1
70 . 1 1 6 6 ILE CG2 C 13 17.661 0.100 . 1 . . . A 6 ILE CG2 . 11552 1
71 . 1 1 6 6 ILE CD1 C 13 13.109 0.100 . 1 . . . A 6 ILE CD1 . 11552 1
72 . 1 1 7 7 LYS H H 1 8.196 0.010 . 1 . . . A 7 LYS H . 11552 1
73 . 1 1 7 7 LYS HA H 1 3.775 0.010 . 1 . . . A 7 LYS HA . 11552 1
74 . 1 1 7 7 LYS HB2 H 1 1.865 0.010 . 1 . . . A 7 LYS HB2 . 11552 1
75 . 1 1 7 7 LYS HB3 H 1 1.865 0.010 . 1 . . . A 7 LYS HB3 . 11552 1
76 . 1 1 7 7 LYS HG2 H 1 1.322 0.010 . 1 . . . A 7 LYS HG2 . 11552 1
77 . 1 1 7 7 LYS HG3 H 1 1.322 0.010 . 1 . . . A 7 LYS HG3 . 11552 1
78 . 1 1 7 7 LYS HD2 H 1 1.581 0.010 . 2 . . . A 7 LYS HD2 . 11552 1
79 . 1 1 7 7 LYS HD3 H 1 1.630 0.010 . 2 . . . A 7 LYS HD3 . 11552 1
80 . 1 1 7 7 LYS HE2 H 1 2.816 0.010 . 1 . . . A 7 LYS HE2 . 11552 1
81 . 1 1 7 7 LYS HE3 H 1 2.816 0.010 . 1 . . . A 7 LYS HE3 . 11552 1
82 . 1 1 7 7 LYS CA C 13 60.383 0.100 . 1 . . . A 7 LYS CA . 11552 1
83 . 1 1 7 7 LYS CB C 13 32.143 0.100 . 1 . . . A 7 LYS CB . 11552 1
84 . 1 1 7 7 LYS CG C 13 24.903 0.100 . 1 . . . A 7 LYS CG . 11552 1
85 . 1 1 7 7 LYS CD C 13 29.346 0.100 . 1 . . . A 7 LYS CD . 11552 1
86 . 1 1 7 7 LYS CE C 13 41.763 0.100 . 1 . . . A 7 LYS CE . 11552 1
87 . 1 1 8 8 THR H H 1 7.867 0.010 . 1 . . . A 8 THR H . 11552 1
88 . 1 1 8 8 THR HA H 1 3.889 0.010 . 1 . . . A 8 THR HA . 11552 1
89 . 1 1 8 8 THR HB H 1 4.276 0.010 . 1 . . . A 8 THR HB . 11552 1
90 . 1 1 8 8 THR HG21 H 1 1.217 0.010 . . . . . A 8 THR HG21 . 11552 1
91 . 1 1 8 8 THR HG22 H 1 1.217 0.010 . . . . . A 8 THR HG22 . 11552 1
92 . 1 1 8 8 THR HG23 H 1 1.217 0.010 . . . . . A 8 THR HG23 . 11552 1
93 . 1 1 8 8 THR CA C 13 65.866 0.100 . 1 . . . A 8 THR CA . 11552 1
94 . 1 1 8 8 THR CB C 13 68.969 0.100 . 1 . . . A 8 THR CB . 11552 1
95 . 1 1 8 8 THR CG2 C 13 21.502 0.100 . 1 . . . A 8 THR CG2 . 11552 1
96 . 1 1 9 9 LEU H H 1 7.682 0.010 . 1 . . . A 9 LEU H . 11552 1
97 . 1 1 9 9 LEU HA H 1 3.924 0.010 . 1 . . . A 9 LEU HA . 11552 1
98 . 1 1 9 9 LEU HB2 H 1 1.554 0.010 . 2 . . . A 9 LEU HB2 . 11552 1
99 . 1 1 9 9 LEU HB3 H 1 1.348 0.010 . 2 . . . A 9 LEU HB3 . 11552 1
100 . 1 1 9 9 LEU HG H 1 1.449 0.010 . 1 . . . A 9 LEU HG . 11552 1
101 . 1 1 9 9 LEU HD11 H 1 0.634 0.010 . 2 . . . A 9 LEU HD11 . 11552 1
102 . 1 1 9 9 LEU HD12 H 1 0.634 0.010 . 2 . . . A 9 LEU HD12 . 11552 1
103 . 1 1 9 9 LEU HD13 H 1 0.634 0.010 . 2 . . . A 9 LEU HD13 . 11552 1
104 . 1 1 9 9 LEU HD21 H 1 0.452 0.010 . 2 . . . A 9 LEU HD21 . 11552 1
105 . 1 1 9 9 LEU HD22 H 1 0.452 0.010 . 2 . . . A 9 LEU HD22 . 11552 1
106 . 1 1 9 9 LEU HD23 H 1 0.452 0.010 . 2 . . . A 9 LEU HD23 . 11552 1
107 . 1 1 9 9 LEU CA C 13 57.280 0.100 . 1 . . . A 9 LEU CA . 11552 1
108 . 1 1 9 9 LEU CB C 13 42.384 0.100 . 1 . . . A 9 LEU CB . 11552 1
109 . 1 1 9 9 LEU CG C 13 26.557 0.100 . 1 . . . A 9 LEU CG . 11552 1
110 . 1 1 9 9 LEU CD1 C 13 23.557 0.100 . 2 . . . A 9 LEU CD1 . 11552 1
111 . 1 1 9 9 LEU CD2 C 13 24.799 0.100 . 2 . . . A 9 LEU CD2 . 11552 1
112 . 1 1 10 10 LEU H H 1 7.518 0.010 . 1 . . . A 10 LEU H . 11552 1
113 . 1 1 10 10 LEU HA H 1 4.055 0.010 . 1 . . . A 10 LEU HA . 11552 1
114 . 1 1 10 10 LEU HB2 H 1 1.512 0.010 . 2 . . . A 10 LEU HB2 . 11552 1
115 . 1 1 10 10 LEU HB3 H 1 1.661 0.010 . 2 . . . A 10 LEU HB3 . 11552 1
116 . 1 1 10 10 LEU HG H 1 1.739 0.010 . 1 . . . A 10 LEU HG . 11552 1
117 . 1 1 10 10 LEU HD11 H 1 0.791 0.010 . 2 . . . A 10 LEU HD11 . 11552 1
118 . 1 1 10 10 LEU HD12 H 1 0.791 0.010 . 2 . . . A 10 LEU HD12 . 11552 1
119 . 1 1 10 10 LEU HD13 H 1 0.791 0.010 . 2 . . . A 10 LEU HD13 . 11552 1
120 . 1 1 10 10 LEU HD21 H 1 0.763 0.010 . 2 . . . A 10 LEU HD21 . 11552 1
121 . 1 1 10 10 LEU HD22 H 1 0.763 0.010 . 2 . . . A 10 LEU HD22 . 11552 1
122 . 1 1 10 10 LEU HD23 H 1 0.763 0.010 . 2 . . . A 10 LEU HD23 . 11552 1
123 . 1 1 10 10 LEU CA C 13 55.418 0.100 . 1 . . . A 10 LEU CA . 11552 1
124 . 1 1 10 10 LEU CB C 13 42.694 0.100 . 1 . . . A 10 LEU CB . 11552 1
125 . 1 1 10 10 LEU CG C 13 27.178 0.100 . 1 . . . A 10 LEU CG . 11552 1
126 . 1 1 10 10 LEU CD1 C 13 24.281 0.100 . 1 . . . A 10 LEU CD1 . 11552 1
127 . 1 1 10 10 LEU CD2 C 13 24.281 0.100 . 1 . . . A 10 LEU CD2 . 11552 1
128 . 1 1 11 11 NH2 HN1 H 1 6.960 0.010 . . . . . . 11 NH2 H1 . 11552 1
129 . 1 1 11 11 NH2 HN2 H 1 6.911 0.010 . . . . . . 11 NH2 H2 . 11552 1
stop_
save_