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 27389
_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 NOESY' . . . 27389 1
2 '2D 1H-13C HSQC' . . . 27389 1
3 '2D 1H-1H TOCSY' . . . 27389 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 PCA H H 1 7.772 0.004 . 1 . . . . . 1 PCA H . 27389 1
2 . 1 1 1 1 PCA HA H 1 4.227 0.012 . 1 . . . . . 1 PCA HA . 27389 1
3 . 1 1 1 1 PCA HB2 H 1 2.384 0.003 . 2 . . . . . 1 PCA HB2 . 27389 1
4 . 1 1 1 1 PCA HB3 H 1 1.865 0.015 . 2 . . . . . 1 PCA HB3 . 27389 1
5 . 1 1 1 1 PCA HG2 H 1 2.272 0.001 . 1 . . . . . 1 PCA HG2 . 27389 1
6 . 1 1 1 1 PCA HG3 H 1 2.272 0.001 . 1 . . . . . 1 PCA HG3 . 27389 1
7 . 1 1 1 1 PCA CA C 13 59.321 0.000 . 1 . . . . . 1 PCA CA . 27389 1
8 . 1 1 1 1 PCA CB C 13 27.991 0.028 . 1 . . . . . 1 PCA CB . 27389 1
9 . 1 1 1 1 PCA CG C 13 32.010 0.000 . 1 . . . . . 1 PCA CG . 27389 1
10 . 1 1 2 2 ARG H H 1 8.331 0.001 . 1 . . . . . 2 ARG H . 27389 1
11 . 1 1 2 2 ARG HA H 1 4.180 0.009 . 1 . . . . . 2 ARG HA . 27389 1
12 . 1 1 2 2 ARG HB2 H 1 1.743 0.002 . 2 . . . . . 2 ARG HB2 . 27389 1
13 . 1 1 2 2 ARG HB3 H 1 1.636 0.002 . 2 . . . . . 2 ARG HB3 . 27389 1
14 . 1 1 2 2 ARG HG2 H 1 1.512 0.002 . 1 . . . . . 2 ARG HG2 . 27389 1
15 . 1 1 2 2 ARG HG3 H 1 1.512 0.002 . 1 . . . . . 2 ARG HG3 . 27389 1
16 . 1 1 3 3 LEU H H 1 8.324 0.009 . 1 . . . . . 3 LEU H . 27389 1
17 . 1 1 3 3 LEU HA H 1 4.250 0.005 . 1 . . . . . 3 LEU HA . 27389 1
18 . 1 1 3 3 LEU HB2 H 1 1.463 0.007 . 2 . . . . . 3 LEU HB2 . 27389 1
19 . 1 1 3 3 LEU HB3 H 1 1.469 0.000 . 2 . . . . . 3 LEU HB3 . 27389 1
20 . 1 1 3 3 LEU HD11 H 1 0.767 0.000 . 2 . . . . . 3 LEU HD11 . 27389 1
21 . 1 1 3 3 LEU HD12 H 1 0.767 0.000 . 2 . . . . . 3 LEU HD12 . 27389 1
22 . 1 1 3 3 LEU HD13 H 1 0.767 0.000 . 2 . . . . . 3 LEU HD13 . 27389 1
23 . 1 1 3 3 LEU HD21 H 1 0.701 0.006 . 2 . . . . . 3 LEU HD21 . 27389 1
24 . 1 1 3 3 LEU HD22 H 1 0.701 0.006 . 2 . . . . . 3 LEU HD22 . 27389 1
25 . 1 1 3 3 LEU HD23 H 1 0.701 0.006 . 2 . . . . . 3 LEU HD23 . 27389 1
26 . 1 1 4 4 CYS H H 1 8.610 0.002 . 1 . . . . . 4 CYS H . 27389 1
27 . 1 1 4 4 CYS HA H 1 4.149 0.003 . 1 . . . . . 4 CYS HA . 27389 1
28 . 1 1 4 4 CYS HB2 H 1 3.261 0.002 . 2 . . . . . 4 CYS HB2 . 27389 1
29 . 1 1 4 4 CYS HB3 H 1 3.540 0.008 . 2 . . . . . 4 CYS HB3 . 27389 1
30 . 1 1 5 5 CYS H H 1 7.926 0.009 . 1 . . . . . 5 CYS H . 27389 1
31 . 1 1 5 5 CYS HA H 1 4.883 0.008 . 1 . . . . . 5 CYS HA . 27389 1
32 . 1 1 5 5 CYS HB2 H 1 2.908 0.001 . 2 . . . . . 5 CYS HB2 . 27389 1
33 . 1 1 5 5 CYS HB3 H 1 3.001 0.001 . 2 . . . . . 5 CYS HB3 . 27389 1
34 . 1 1 6 6 GLY H H 1 8.499 0.003 . 1 . . . . . 6 GLY H . 27389 1
35 . 1 1 6 6 GLY HA2 H 1 3.752 0.004 . 2 . . . . . 6 GLY HA2 . 27389 1
36 . 1 1 6 6 GLY HA3 H 1 3.753 0.004 . 2 . . . . . 6 GLY HA3 . 27389 1
37 . 1 1 6 6 GLY CA C 13 44.996 0.000 . 1 . . . . . 6 GLY CA . 27389 1
38 . 1 1 7 7 PHE H H 1 8.093 0.003 . 1 . . . . . 7 PHE H . 27389 1
39 . 1 1 7 7 PHE HA H 1 4.735 0.005 . 1 . . . . . 7 PHE HA . 27389 1
40 . 1 1 7 7 PHE HB2 H 1 2.773 0.006 . 2 . . . . . 7 PHE HB2 . 27389 1
41 . 1 1 7 7 PHE HB3 H 1 2.990 0.005 . 2 . . . . . 7 PHE HB3 . 27389 1
42 . 1 1 7 7 PHE HD1 H 1 7.177 0.000 . 1 . . . . . 7 PHE HD1 . 27389 1
43 . 1 1 7 7 PHE HD2 H 1 7.177 0.000 . 1 . . . . . 7 PHE HD2 . 27389 1
44 . 1 1 7 7 PHE CB C 13 38.817 0.083 . 1 . . . . . 7 PHE CB . 27389 1
45 . 1 1 7 7 PHE CD1 C 13 129.887 0.000 . 1 . . . . . 7 PHE CD1 . 27389 1
46 . 1 1 7 7 PHE CD2 C 13 129.887 0.000 . 1 . . . . . 7 PHE CD2 . 27389 1
47 . 1 1 8 8 HYP HA H 1 4.449 0.008 . 1 . . . . . 8 HYP HA . 27389 1
48 . 1 1 8 8 HYP HB2 H 1 2.200 0.008 . 2 . . . . . 8 HYP HB2 . 27389 1
49 . 1 1 8 8 HYP HB3 H 1 1.915 0.002 . 2 . . . . . 8 HYP HB3 . 27389 1
50 . 1 1 8 8 HYP HG H 1 4.463 0.000 . 1 . . . . . 8 HYP HG . 27389 1
51 . 1 1 8 8 HYP HD22 H 1 3.574 0.006 . 2 . . . . . 8 HYP HD22 . 27389 1
52 . 1 1 8 8 HYP HD23 H 1 3.762 0.008 . 2 . . . . . 8 HYP HD23 . 27389 1
53 . 1 1 8 8 HYP CA C 13 61.798 0.000 . 1 . . . . . 8 HYP CA . 27389 1
54 . 1 1 8 8 HYP CG C 13 72.631 0.000 . 1 . . . . . 8 HYP CG . 27389 1
55 . 1 1 8 8 HYP CD C 13 58.187 0.007 . 1 . . . . . 8 HYP CD . 27389 1
56 . 1 1 9 9 LYS H H 1 8.529 0.002 . 1 . . . . . 9 LYS H . 27389 1
57 . 1 1 9 9 LYS HA H 1 4.153 0.002 . 1 . . . . . 9 LYS HA . 27389 1
58 . 1 1 9 9 LYS HB2 H 1 1.737 0.005 . 2 . . . . . 9 LYS HB2 . 27389 1
59 . 1 1 9 9 LYS HB3 H 1 1.665 0.001 . 2 . . . . . 9 LYS HB3 . 27389 1
60 . 1 1 9 9 LYS HG2 H 1 1.400 0.013 . 2 . . . . . 9 LYS HG2 . 27389 1
61 . 1 1 9 9 LYS HG3 H 1 1.346 0.004 . 2 . . . . . 9 LYS HG3 . 27389 1
62 . 1 1 9 9 LYS HD2 H 1 1.571 0.006 . 2 . . . . . 9 LYS HD2 . 27389 1
63 . 1 1 9 9 LYS HD3 H 1 1.568 0.006 . 2 . . . . . 9 LYS HD3 . 27389 1
64 . 1 1 9 9 LYS HE2 H 1 2.873 0.007 . 1 . . . . . 9 LYS HE2 . 27389 1
65 . 1 1 9 9 LYS CA C 13 56.963 0.000 . 1 . . . . . 9 LYS CA . 27389 1
66 . 1 1 9 9 LYS CE C 13 42.066 0.000 . 1 . . . . . 9 LYS CE . 27389 1
67 . 1 1 10 10 SER H H 1 8.150 0.003 . 1 . . . . . 10 SER H . 27389 1
68 . 1 1 10 10 SER HA H 1 4.274 0.002 . 1 . . . . . 10 SER HA . 27389 1
69 . 1 1 10 10 SER HB2 H 1 3.732 0.006 . 2 . . . . . 10 SER HB2 . 27389 1
70 . 1 1 10 10 SER HB3 H 1 3.732 0.006 . 2 . . . . . 10 SER HB3 . 27389 1
71 . 1 1 10 10 SER CA C 13 58.228 0.000 . 1 . . . . . 10 SER CA . 27389 1
72 . 1 1 10 10 SER CB C 13 63.714 0.000 . 1 . . . . . 10 SER CB . 27389 1
73 . 1 1 11 11 CYS H H 1 8.318 0.003 . 1 . . . . . 11 CYS H . 27389 1
74 . 1 1 11 11 CYS HA H 1 4.585 0.002 . 1 . . . . . 11 CYS HA . 27389 1
75 . 1 1 11 11 CYS HB2 H 1 3.067 0.004 . 2 . . . . . 11 CYS HB2 . 27389 1
76 . 1 1 11 11 CYS HB3 H 1 2.987 0.002 . 2 . . . . . 11 CYS HB3 . 27389 1
77 . 1 1 11 11 CYS CB C 13 41.535 0.019 . 1 . . . . . 11 CYS CB . 27389 1
78 . 1 1 12 12 ARG H H 1 8.626 0.001 . 1 . . . . . 12 ARG H . 27389 1
79 . 1 1 12 12 ARG HA H 1 4.309 0.002 . 1 . . . . . 12 ARG HA . 27389 1
80 . 1 1 12 12 ARG HB2 H 1 1.594 0.002 . 2 . . . . . 12 ARG HB2 . 27389 1
81 . 1 1 12 12 ARG HB3 H 1 1.848 0.005 . 2 . . . . . 12 ARG HB3 . 27389 1
82 . 1 1 12 12 ARG HG2 H 1 1.493 0.007 . 1 . . . . . 12 ARG HG2 . 27389 1
83 . 1 1 12 12 ARG HG3 H 1 1.493 0.007 . 1 . . . . . 12 ARG HG3 . 27389 1
84 . 1 1 12 12 ARG HD2 H 1 3.062 0.001 . 1 . . . . . 12 ARG HD2 . 27389 1
85 . 1 1 12 12 ARG HD3 H 1 3.062 0.001 . 1 . . . . . 12 ARG HD3 . 27389 1
86 . 1 1 13 13 SER H H 1 7.785 0.005 . 1 . . . . . 13 SER H . 27389 1
87 . 1 1 13 13 SER HA H 1 4.370 0.003 . 1 . . . . . 13 SER HA . 27389 1
88 . 1 1 13 13 SER HB2 H 1 3.890 0.003 . 2 . . . . . 13 SER HB2 . 27389 1
89 . 1 1 13 13 SER HB3 H 1 3.784 0.003 . 2 . . . . . 13 SER HB3 . 27389 1
90 . 1 1 13 13 SER CA C 13 57.992 0.000 . 1 . . . . . 13 SER CA . 27389 1
91 . 1 1 13 13 SER CB C 13 64.186 0.030 . 1 . . . . . 13 SER CB . 27389 1
92 . 1 1 14 14 ARG H H 1 8.301 0.001 . 1 . . . . . 14 ARG H . 27389 1
93 . 1 1 14 14 ARG HA H 1 4.020 0.003 . 1 . . . . . 14 ARG HA . 27389 1
94 . 1 1 14 14 ARG HB2 H 1 1.764 0.000 . 2 . . . . . 14 ARG HB2 . 27389 1
95 . 1 1 14 14 ARG HB3 H 1 1.751 0.002 . 2 . . . . . 14 ARG HB3 . 27389 1
96 . 1 1 14 14 ARG HG2 H 1 1.526 0.001 . 2 . . . . . 14 ARG HG2 . 27389 1
97 . 1 1 14 14 ARG HG3 H 1 1.507 0.000 . 2 . . . . . 14 ARG HG3 . 27389 1
98 . 1 1 14 14 ARG HD2 H 1 3.071 0.005 . 1 . . . . . 14 ARG HD2 . 27389 1
99 . 1 1 14 14 ARG CA C 13 57.871 0.000 . 1 . . . . . 14 ARG CA . 27389 1
100 . 1 1 15 15 GLN H H 1 8.102 0.003 . 1 . . . . . 15 GLN H . 27389 1
101 . 1 1 15 15 GLN HA H 1 4.167 0.008 . 1 . . . . . 15 GLN HA . 27389 1
102 . 1 1 15 15 GLN HB2 H 1 1.959 0.004 . 2 . . . . . 15 GLN HB2 . 27389 1
103 . 1 1 15 15 GLN HB3 H 1 1.850 0.004 . 2 . . . . . 15 GLN HB3 . 27389 1
104 . 1 1 15 15 GLN HG2 H 1 2.210 0.003 . 1 . . . . . 15 GLN HG2 . 27389 1
105 . 1 1 15 15 GLN HG3 H 1 2.210 0.002 . 1 . . . . . 15 GLN HG3 . 27389 1
106 . 1 1 15 15 GLN CA C 13 56.256 0.000 . 1 . . . . . 15 GLN CA . 27389 1
107 . 1 1 15 15 GLN CB C 13 28.844 0.010 . 1 . . . . . 15 GLN CB . 27389 1
108 . 1 1 15 15 GLN CG C 13 33.907 0.000 . 1 . . . . . 15 GLN CG . 27389 1
109 . 1 1 16 16 CYS H H 1 7.971 0.005 . 1 . . . . . 16 CYS H . 27389 1
110 . 1 1 16 16 CYS HA H 1 4.459 0.001 . 1 . . . . . 16 CYS HA . 27389 1
111 . 1 1 16 16 CYS HB2 H 1 3.079 0.004 . 2 . . . . . 16 CYS HB2 . 27389 1
112 . 1 1 16 16 CYS HB3 H 1 2.956 0.002 . 2 . . . . . 16 CYS HB3 . 27389 1
113 . 1 1 16 16 CYS CB C 13 41.867 0.022 . 1 . . . . . 16 CYS CB . 27389 1
114 . 1 1 17 17 LYS H H 1 8.068 0.003 . 1 . . . . . 17 LYS H . 27389 1
115 . 1 1 17 17 LYS HA H 1 4.449 0.004 . 1 . . . . . 17 LYS HA . 27389 1
116 . 1 1 17 17 LYS HB2 H 1 1.660 0.003 . 2 . . . . . 17 LYS HB2 . 27389 1
117 . 1 1 17 17 LYS HB3 H 1 1.580 0.002 . 2 . . . . . 17 LYS HB3 . 27389 1
118 . 1 1 17 17 LYS HG2 H 1 1.333 0.000 . 2 . . . . . 17 LYS HG2 . 27389 1
119 . 1 1 17 17 LYS HG3 H 1 1.305 0.007 . 2 . . . . . 17 LYS HG3 . 27389 1
120 . 1 1 17 17 LYS HD2 H 1 1.521 0.000 . 1 . . . . . 17 LYS HD2 . 27389 1
121 . 1 1 17 17 LYS HE2 H 1 2.842 0.000 . 1 . . . . . 17 LYS HE2 . 27389 1
122 . 1 1 17 17 LYS HE3 H 1 2.842 0.000 . 1 . . . . . 17 LYS HE3 . 27389 1
123 . 1 1 17 17 LYS CE C 13 42.051 0.000 . 1 . . . . . 17 LYS CE . 27389 1
124 . 1 1 18 18 HYP HA H 1 4.398 0.006 . 1 . . . . . 18 HYP HA . 27389 1
125 . 1 1 18 18 HYP HB2 H 1 1.829 0.002 . 2 . . . . . 18 HYP HB2 . 27389 1
126 . 1 1 18 18 HYP HB3 H 1 2.164 0.005 . 2 . . . . . 18 HYP HB3 . 27389 1
127 . 1 1 18 18 HYP HG H 1 4.452 0.004 . 1 . . . . . 18 HYP HG . 27389 1
128 . 1 1 18 18 HYP HD22 H 1 3.723 0.003 . 2 . . . . . 18 HYP HD22 . 27389 1
129 . 1 1 18 18 HYP HD23 H 1 3.643 0.002 . 2 . . . . . 18 HYP HD23 . 27389 1
130 . 1 1 18 18 HYP CA C 13 61.663 0.000 . 1 . . . . . 18 HYP CA . 27389 1
131 . 1 1 18 18 HYP CD C 13 58.227 0.020 . 1 . . . . . 18 HYP CD . 27389 1
132 . 1 1 19 19 HIS H H 1 8.671 0.001 . 1 . . . . . 19 HIS H . 27389 1
133 . 1 1 19 19 HIS HA H 1 4.528 0.001 . 1 . . . . . 19 HIS HA . 27389 1
134 . 1 1 19 19 HIS HB2 H 1 3.081 0.008 . 2 . . . . . 19 HIS HB2 . 27389 1
135 . 1 1 19 19 HIS HB3 H 1 3.080 0.008 . 2 . . . . . 19 HIS HB3 . 27389 1
136 . 1 1 19 19 HIS HD2 H 1 7.178 0.000 . 1 . . . . . 19 HIS HD2 . 27389 1
137 . 1 1 19 19 HIS HE1 H 1 8.470 0.000 . 1 . . . . . 19 HIS HE1 . 27389 1
138 . 1 1 19 19 HIS CA C 13 55.333 0.000 . 1 . . . . . 19 HIS CA . 27389 1
139 . 1 1 19 19 HIS CB C 13 29.049 0.000 . 1 . . . . . 19 HIS CB . 27389 1
140 . 1 1 19 19 HIS CD2 C 13 120.041 0.000 . 1 . . . . . 19 HIS CD2 . 27389 1
141 . 1 1 19 19 HIS CE1 C 13 136.510 0.000 . 1 . . . . . 19 HIS CE1 . 27389 1
142 . 1 1 20 20 ARG H H 1 8.358 0.001 . 1 . . . . . 20 ARG H . 27389 1
143 . 1 1 20 20 ARG HA H 1 4.179 0.005 . 1 . . . . . 20 ARG HA . 27389 1
144 . 1 1 20 20 ARG HB2 H 1 1.660 0.004 . 2 . . . . . 20 ARG HB2 . 27389 1
145 . 1 1 20 20 ARG HB3 H 1 1.593 0.002 . 2 . . . . . 20 ARG HB3 . 27389 1
146 . 1 1 20 20 ARG HG2 H 1 1.474 0.007 . 2 . . . . . 20 ARG HG2 . 27389 1
147 . 1 1 20 20 ARG HG3 H 1 1.479 0.002 . 2 . . . . . 20 ARG HG3 . 27389 1
148 . 1 1 20 20 ARG HD2 H 1 3.071 0.000 . 1 . . . . . 20 ARG HD2 . 27389 1
149 . 1 1 20 20 ARG HD3 H 1 3.071 0.000 . 1 . . . . . 20 ARG HD3 . 27389 1
150 . 1 1 21 21 CYS H H 1 8.161 0.004 . 1 . . . . . 21 CYS H . 27389 1
151 . 1 1 21 21 CYS HA H 1 4.823 0.006 . 1 . . . . . 21 CYS HA . 27389 1
152 . 1 1 21 21 CYS HB2 H 1 3.477 0.006 . 2 . . . . . 21 CYS HB2 . 27389 1
153 . 1 1 21 21 CYS HB3 H 1 3.285 0.007 . 2 . . . . . 21 CYS HB3 . 27389 1
154 . 1 1 22 22 CYS H H 1 8.674 0.004 . 1 . . . . . 22 CYS H . 27389 1
155 . 1 1 22 22 CYS HA H 1 3.813 0.000 . 1 . . . . . 22 CYS HA . 27389 1
stop_
save_