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 27386
_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' . . . 27386 1
2 '2D 1H-1H TOCSY' . . . 27386 1
3 '2D 1H-13C HSQC' . . . 27386 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 7.798 0.001 . 1 . . . . . 1 PCA H . 27386 1
2 . 1 1 1 1 PCA HA H 1 4.298 0.004 . 1 . . . . . 1 PCA HA . 27386 1
3 . 1 1 1 1 PCA HB2 H 1 2.464 0.003 . 1 . . . . . 1 PCA HB2 . 27386 1
4 . 1 1 1 1 PCA HG2 H 1 2.346 0.003 . 1 . . . . . 1 PCA HG2 . 27386 1
5 . 1 1 2 2 ARG H H 1 8.349 0.003 . 1 . . . . . 2 ARG H . 27386 1
6 . 1 1 2 2 ARG HA H 1 4.221 0.003 . 1 . . . . . 2 ARG HA . 27386 1
7 . 1 1 2 2 ARG HB2 H 1 1.737 0.001 . 2 . . . . . 2 ARG HB2 . 27386 1
8 . 1 1 2 2 ARG HB3 H 1 1.696 0.005 . 2 . . . . . 2 ARG HB3 . 27386 1
9 . 1 1 2 2 ARG HG2 H 1 1.532 0.008 . 1 . . . . . 2 ARG HG2 . 27386 1
10 . 1 1 2 2 ARG HD2 H 1 3.118 0.007 . 1 . . . . . 2 ARG HD2 . 27386 1
11 . 1 1 3 3 LEU H H 1 8.303 0.003 . 1 . . . . . 3 LEU H . 27386 1
12 . 1 1 3 3 LEU HA H 1 4.346 0.003 . 1 . . . . . 3 LEU HA . 27386 1
13 . 1 1 3 3 LEU HB2 H 1 1.528 0.005 . 2 . . . . . 3 LEU HB2 . 27386 1
14 . 1 1 3 3 LEU HB3 H 1 1.602 0.002 . 2 . . . . . 3 LEU HB3 . 27386 1
15 . 1 1 3 3 LEU HD11 H 1 0.836 0.002 . 2 . . . . . 3 LEU HD11 . 27386 1
16 . 1 1 3 3 LEU HD12 H 1 0.836 0.002 . 2 . . . . . 3 LEU HD12 . 27386 1
17 . 1 1 3 3 LEU HD13 H 1 0.836 0.002 . 2 . . . . . 3 LEU HD13 . 27386 1
18 . 1 1 3 3 LEU HD21 H 1 0.782 0.005 . 2 . . . . . 3 LEU HD21 . 27386 1
19 . 1 1 3 3 LEU HD22 H 1 0.782 0.005 . 2 . . . . . 3 LEU HD22 . 27386 1
20 . 1 1 3 3 LEU HD23 H 1 0.782 0.005 . 2 . . . . . 3 LEU HD23 . 27386 1
21 . 1 1 3 3 LEU CD2 C 13 23.392 0.000 . 1 . . . . . 3 LEU CD2 . 27386 1
22 . 1 1 4 4 CYS H H 1 8.441 0.003 . 1 . . . . . 4 CYS H . 27386 1
23 . 1 1 4 4 CYS HA H 1 4.598 0.003 . 1 . . . . . 4 CYS HA . 27386 1
24 . 1 1 4 4 CYS HB2 H 1 3.017 0.005 . 2 . . . . . 4 CYS HB2 . 27386 1
25 . 1 1 4 4 CYS HB3 H 1 3.134 0.005 . 2 . . . . . 4 CYS HB3 . 27386 1
26 . 1 1 5 5 CYS H H 1 8.281 0.001 . 1 . . . . . 5 CYS H . 27386 1
27 . 1 1 5 5 CYS HA H 1 4.652 0.002 . 1 . . . . . 5 CYS HA . 27386 1
28 . 1 1 5 5 CYS HB2 H 1 3.053 0.005 . 2 . . . . . 5 CYS HB2 . 27386 1
29 . 1 1 5 5 CYS HB3 H 1 3.166 0.003 . 2 . . . . . 5 CYS HB3 . 27386 1
30 . 1 1 6 6 GLY H H 1 8.394 0.001 . 1 . . . . . 6 GLY H . 27386 1
31 . 1 1 6 6 GLY HA2 H 1 3.715 0.002 . 2 . . . . . 6 GLY HA2 . 27386 1
32 . 1 1 6 6 GLY HA3 H 1 3.787 0.004 . 2 . . . . . 6 GLY HA3 . 27386 1
33 . 1 1 7 7 PHE HA H 1 4.830 0.001 . 1 . . . . . 7 PHE HA . 27386 1
34 . 1 1 7 7 PHE HB2 H 1 3.166 0.017 . 2 . . . . . 7 PHE HB2 . 27386 1
35 . 1 1 7 7 PHE HB3 H 1 2.931 0.004 . 2 . . . . . 7 PHE HB3 . 27386 1
36 . 1 1 7 7 PHE HE1 H 1 7.268 0.025 . 1 . . . . . 7 PHE HE1 . 27386 1
37 . 1 1 7 7 PHE HE2 H 1 7.268 0.025 . 1 . . . . . 7 PHE HE2 . 27386 1
38 . 1 1 7 7 PHE CD1 C 13 131.792 0.000 . 1 . . . . . 7 PHE CD1 . 27386 1
39 . 1 1 7 7 PHE CD2 C 13 131.792 0.000 . 1 . . . . . 7 PHE CD2 . 27386 1
40 . 1 1 7 7 PHE CE1 C 13 131.535 0.000 . 1 . . . . . 7 PHE CE1 . 27386 1
41 . 1 1 7 7 PHE CE2 C 13 131.535 0.000 . 1 . . . . . 7 PHE CE2 . 27386 1
42 . 1 1 8 8 HYP HA H 1 4.411 0.003 . 1 . . . . . 8 HYP HA . 27386 1
43 . 1 1 8 8 HYP HB2 H 1 2.279 0.003 . 2 . . . . . 8 HYP HB2 . 27386 1
44 . 1 1 8 8 HYP HB3 H 1 2.033 0.000 . 2 . . . . . 8 HYP HB3 . 27386 1
45 . 1 1 8 8 HYP HG H 1 4.569 0.003 . 1 . . . . . 8 HYP HG . 27386 1
46 . 1 1 8 8 HYP HD22 H 1 3.835 0.004 . 2 . . . . . 8 HYP HD22 . 27386 1
47 . 1 1 8 8 HYP HD23 H 1 3.802 0.014 . 2 . . . . . 8 HYP HD23 . 27386 1
48 . 1 1 8 8 HYP CA C 13 63.722 0.000 . 1 . . . . . 8 HYP CA . 27386 1
49 . 1 1 8 8 HYP CG C 13 72.648 0.000 . 1 . . . . . 8 HYP CG . 27386 1
50 . 1 1 8 8 HYP CD C 13 58.549 0.000 . 1 . . . . . 8 HYP CD . 27386 1
51 . 1 1 9 9 LYS H H 1 8.420 0.003 . 1 . . . . . 9 LYS H . 27386 1
52 . 1 1 9 9 LYS HA H 1 4.002 0.004 . 1 . . . . . 9 LYS HA . 27386 1
53 . 1 1 9 9 LYS HB2 H 1 1.807 0.005 . 1 . . . . . 9 LYS HB2 . 27386 1
54 . 1 1 9 9 LYS HG2 H 1 1.368 0.008 . 1 . . . . . 9 LYS HG2 . 27386 1
55 . 1 1 9 9 LYS HD2 H 1 1.606 0.007 . 1 . . . . . 9 LYS HD2 . 27386 1
56 . 1 1 9 9 LYS HE2 H 1 2.908 0.009 . 1 . . . . . 9 LYS HE2 . 27386 1
57 . 1 1 9 9 LYS HZ1 H 1 7.486 0.000 . 1 . . . . . 9 LYS HZ1 . 27386 1
58 . 1 1 9 9 LYS HZ2 H 1 7.486 0.000 . 1 . . . . . 9 LYS HZ2 . 27386 1
59 . 1 1 9 9 LYS HZ3 H 1 7.486 0.000 . 1 . . . . . 9 LYS HZ3 . 27386 1
60 . 1 1 10 10 SER H H 1 7.889 0.004 . 1 . . . . . 10 SER H . 27386 1
61 . 1 1 10 10 SER HA H 1 4.420 0.002 . 1 . . . . . 10 SER HA . 27386 1
62 . 1 1 10 10 SER HB2 H 1 3.874 0.002 . 2 . . . . . 10 SER HB2 . 27386 1
63 . 1 1 10 10 SER HB3 H 1 3.796 0.002 . 2 . . . . . 10 SER HB3 . 27386 1
64 . 1 1 11 11 CYS H H 1 8.135 0.003 . 1 . . . . . 11 CYS H . 27386 1
65 . 1 1 11 11 CYS HA H 1 4.665 0.002 . 1 . . . . . 11 CYS HA . 27386 1
66 . 1 1 11 11 CYS HB2 H 1 3.105 0.001 . 2 . . . . . 11 CYS HB2 . 27386 1
67 . 1 1 11 11 CYS HB3 H 1 3.195 0.003 . 2 . . . . . 11 CYS HB3 . 27386 1
68 . 1 1 12 12 ARG H H 1 8.313 0.002 . 1 . . . . . 12 ARG H . 27386 1
69 . 1 1 12 12 ARG HA H 1 4.288 0.002 . 1 . . . . . 12 ARG HA . 27386 1
70 . 1 1 12 12 ARG HB2 H 1 1.754 0.001 . 2 . . . . . 12 ARG HB2 . 27386 1
71 . 1 1 12 12 ARG HB3 H 1 1.736 0.009 . 2 . . . . . 12 ARG HB3 . 27386 1
72 . 1 1 12 12 ARG HG2 H 1 1.529 0.005 . 1 . . . . . 12 ARG HG2 . 27386 1
73 . 1 1 13 13 SER H H 1 7.975 0.003 . 1 . . . . . 13 SER H . 27386 1
74 . 1 1 13 13 SER HA H 1 4.416 0.002 . 1 . . . . . 13 SER HA . 27386 1
75 . 1 1 13 13 SER HB2 H 1 3.842 0.002 . 2 . . . . . 13 SER HB2 . 27386 1
76 . 1 1 13 13 SER HB3 H 1 3.792 0.004 . 2 . . . . . 13 SER HB3 . 27386 1
77 . 1 1 14 14 ARG H H 1 8.208 0.002 . 1 . . . . . 14 ARG H . 27386 1
78 . 1 1 14 14 ARG HA H 1 4.311 0.006 . 1 . . . . . 14 ARG HA . 27386 1
79 . 1 1 14 14 ARG HB2 H 1 1.836 0.003 . 2 . . . . . 14 ARG HB2 . 27386 1
80 . 1 1 14 14 ARG HB3 H 1 1.713 0.005 . 2 . . . . . 14 ARG HB3 . 27386 1
81 . 1 1 14 14 ARG HG2 H 1 1.578 0.002 . 1 . . . . . 14 ARG HG2 . 27386 1
82 . 1 1 14 14 ARG HD2 H 1 3.127 0.002 . 1 . . . . . 14 ARG HD2 . 27386 1
83 . 1 1 14 14 ARG HE H 1 7.116 0.000 . 1 . . . . . 14 ARG HE . 27386 1
84 . 1 1 15 15 GLN H H 1 8.289 0.020 . 1 . . . . . 15 GLN H . 27386 1
85 . 1 1 15 15 GLN HA H 1 4.455 0.001 . 1 . . . . . 15 GLN HA . 27386 1
86 . 1 1 15 15 GLN HB2 H 1 2.041 0.006 . 2 . . . . . 15 GLN HB2 . 27386 1
87 . 1 1 15 15 GLN HB3 H 1 1.906 0.004 . 2 . . . . . 15 GLN HB3 . 27386 1
88 . 1 1 15 15 GLN HG2 H 1 2.272 0.004 . 1 . . . . . 15 GLN HG2 . 27386 1
89 . 1 1 16 16 CYS H H 1 8.692 0.001 . 1 . . . . . 16 CYS H . 27386 1
90 . 1 1 16 16 CYS HA H 1 4.595 0.001 . 1 . . . . . 16 CYS HA . 27386 1
91 . 1 1 17 17 LYS H H 1 8.383 0.002 . 1 . . . . . 17 LYS H . 27386 1
92 . 1 1 17 17 LYS HA H 1 4.458 0.007 . 1 . . . . . 17 LYS HA . 27386 1
93 . 1 1 17 17 LYS HB2 H 1 1.751 0.006 . 2 . . . . . 17 LYS HB2 . 27386 1
94 . 1 1 17 17 LYS HB3 H 1 1.771 0.004 . 2 . . . . . 17 LYS HB3 . 27386 1
95 . 1 1 17 17 LYS HG2 H 1 1.404 0.000 . 1 . . . . . 17 LYS HG2 . 27386 1
96 . 1 1 17 17 LYS HD2 H 1 1.503 0.011 . 1 . . . . . 17 LYS HD2 . 27386 1
97 . 1 1 17 17 LYS HD3 H 1 1.503 0.011 . 1 . . . . . 17 LYS HD3 . 27386 1
98 . 1 1 18 18 HYP HA H 1 4.290 0.004 . 1 . . . . . 18 HYP HA . 27386 1
99 . 1 1 18 18 HYP HB2 H 1 1.993 0.001 . 2 . . . . . 18 HYP HB2 . 27386 1
100 . 1 1 18 18 HYP HB3 H 1 2.271 0.000 . 2 . . . . . 18 HYP HB3 . 27386 1
101 . 1 1 18 18 HYP HG H 1 4.529 0.005 . 1 . . . . . 18 HYP HG . 27386 1
102 . 1 1 18 18 HYP HD22 H 1 3.695 0.001 . 2 . . . . . 18 HYP HD22 . 27386 1
103 . 1 1 18 18 HYP HD23 H 1 3.683 0.007 . 2 . . . . . 18 HYP HD23 . 27386 1
104 . 1 1 18 18 HYP CA C 13 62.470 0.000 . 1 . . . . . 18 HYP CA . 27386 1
105 . 1 1 18 18 HYP CG C 13 72.753 0.000 . 1 . . . . . 18 HYP CG . 27386 1
106 . 1 1 18 18 HYP CD C 13 58.097 0.000 . 1 . . . . . 18 HYP CD . 27386 1
107 . 1 1 19 19 HIS H H 1 8.387 0.010 . 1 . . . . . 19 HIS H . 27386 1
108 . 1 1 19 19 HIS HA H 1 4.639 0.009 . 1 . . . . . 19 HIS HA . 27386 1
109 . 1 1 19 19 HIS HB2 H 1 3.168 0.000 . 2 . . . . . 19 HIS HB2 . 27386 1
110 . 1 1 19 19 HIS HB3 H 1 3.055 0.000 . 2 . . . . . 19 HIS HB3 . 27386 1
111 . 1 1 19 19 HIS HD2 H 1 7.140 0.000 . 1 . . . . . 19 HIS HD2 . 27386 1
112 . 1 1 19 19 HIS HE1 H 1 8.552 0.000 . 1 . . . . . 19 HIS HE1 . 27386 1
113 . 1 1 19 19 HIS CD2 C 13 119.738 0.000 . 1 . . . . . 19 HIS CD2 . 27386 1
114 . 1 1 19 19 HIS CE1 C 13 136.395 0.000 . 1 . . . . . 19 HIS CE1 . 27386 1
115 . 1 1 20 20 ARG H H 1 8.437 0.002 . 1 . . . . . 20 ARG H . 27386 1
116 . 1 1 20 20 ARG HA H 1 4.003 0.002 . 1 . . . . . 20 ARG HA . 27386 1
117 . 1 1 20 20 ARG HB2 H 1 1.801 0.001 . 1 . . . . . 20 ARG HB2 . 27386 1
118 . 1 1 20 20 ARG HG2 H 1 1.599 0.000 . 1 . . . . . 20 ARG HG2 . 27386 1
119 . 1 1 20 20 ARG HD2 H 1 3.130 0.001 . 1 . . . . . 20 ARG HD2 . 27386 1
120 . 1 1 21 21 CYS H H 1 8.512 0.008 . 1 . . . . . 21 CYS H . 27386 1
121 . 1 1 21 21 CYS HA H 1 4.783 0.005 . 1 . . . . . 21 CYS HA . 27386 1
122 . 1 1 21 21 CYS HB2 H 1 3.014 0.000 . 2 . . . . . 21 CYS HB2 . 27386 1
123 . 1 1 21 21 CYS HB3 H 1 3.076 0.000 . 2 . . . . . 21 CYS HB3 . 27386 1
124 . 1 1 22 22 CYS H H 1 8.735 0.002 . 1 . . . . . 22 CYS H . 27386 1
125 . 1 1 22 22 CYS HA H 1 4.745 0.006 . 1 . . . . . 22 CYS HA . 27386 1
126 . 1 1 22 22 CYS HB2 H 1 3.057 0.002 . 2 . . . . . 22 CYS HB2 . 27386 1
127 . 1 1 22 22 CYS HB3 H 1 3.209 0.000 . 2 . . . . . 22 CYS HB3 . 27386 1
stop_
save_