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 20053
_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 TOCSY' . . . 20053 1
2 '2D DQF-COSY' . . . 20053 1
3 '2D 1H-1H NOESY' . . . 20053 1
4 '2D 1H-1H ROESY' . . . 20053 1
5 '2D 1H-13C HSQC' . . . 20053 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 LYS HA H 1 3.728 0.020 . 1 . . . . 1 LYS HA . 20053 1
2 . 1 1 1 1 LYS HB2 H 1 1.663 0.020 . 2 . . . . 1 LYS HB2 . 20053 1
3 . 1 1 1 1 LYS HB3 H 1 1.663 0.020 . 2 . . . . 1 LYS HB3 . 20053 1
4 . 1 1 1 1 LYS HD2 H 1 1.489 0.020 . 2 . . . . 1 LYS HD2 . 20053 1
5 . 1 1 1 1 LYS HD3 H 1 1.489 0.020 . 2 . . . . 1 LYS HD3 . 20053 1
6 . 1 1 1 1 LYS HE2 H 1 2.730 0.020 . 2 . . . . 1 LYS HE2 . 20053 1
7 . 1 1 1 1 LYS HE3 H 1 2.730 0.020 . 2 . . . . 1 LYS HE3 . 20053 1
8 . 1 1 1 1 LYS HG2 H 1 1.280 0.020 . 2 . . . . 1 LYS HG2 . 20053 1
9 . 1 1 1 1 LYS HG3 H 1 1.280 0.020 . 2 . . . . 1 LYS HG3 . 20053 1
10 . 1 1 1 1 LYS CA C 13 55.840 0.400 . 1 . . . . 1 LYS CA . 20053 1
11 . 1 1 1 1 LYS CB C 13 34.270 0.400 . 1 . . . . 1 LYS CB . 20053 1
12 . 1 1 1 1 LYS CD C 13 30.250 0.400 . 1 . . . . 1 LYS CD . 20053 1
13 . 1 1 1 1 LYS CE C 13 42.420 0.400 . 1 . . . . 1 LYS CE . 20053 1
14 . 1 1 1 1 LYS CG C 13 24.850 0.400 . 1 . . . . 1 LYS CG . 20053 1
15 . 1 1 2 2 ARG H H 1 8.624 0.020 . 1 . . . . 2 ARG H . 20053 1
16 . 1 1 2 2 ARG HA H 1 4.250 0.020 . 1 . . . . 2 ARG HA . 20053 1
17 . 1 1 2 2 ARG HB2 H 1 1.668 0.020 . 2 . . . . 2 ARG HB2 . 20053 1
18 . 1 1 2 2 ARG HB3 H 1 1.668 0.020 . 2 . . . . 2 ARG HB3 . 20053 1
19 . 1 1 2 2 ARG HD2 H 1 3.046 0.020 . 2 . . . . 2 ARG HD2 . 20053 1
20 . 1 1 2 2 ARG HD3 H 1 3.046 0.020 . 2 . . . . 2 ARG HD3 . 20053 1
21 . 1 1 2 2 ARG HG2 H 1 1.497 0.020 . 2 . . . . 2 ARG HG2 . 20053 1
22 . 1 1 2 2 ARG HG3 H 1 1.497 0.020 . 2 . . . . 2 ARG HG3 . 20053 1
23 . 1 1 2 2 ARG HE H 1 7.461 0.400 . 1 . . . . 2 ARG HE . 20053 1
24 . 1 1 2 2 ARG CA C 13 56.390 0.400 . 1 . . . . 2 ARG CA . 20053 1
25 . 1 1 2 2 ARG CB C 13 32.620 0.400 . 1 . . . . 2 ARG CB . 20053 1
26 . 1 1 2 2 ARG CD C 13 44.220 0.400 . 1 . . . . 2 ARG CD . 20053 1
27 . 1 1 2 2 ARG CG C 13 28.480 0.400 . 1 . . . . 2 ARG CG . 20053 1
28 . 1 1 3 3 GLY H H 1 8.333 0.020 . 1 . . . . 3 GLY H . 20053 1
29 . 1 1 3 3 GLY HA2 H 1 3.789 0.020 . 2 . . . . 3 GLY HA2 . 20053 1
30 . 1 1 3 3 GLY HA3 H 1 3.702 0.020 . 2 . . . . 3 GLY HA3 . 20053 1
31 . 1 1 3 3 GLY CA C 13 45.510 0.400 . 1 . . . . 3 GLY CA . 20053 1
32 . 1 1 4 4 ILE H H 1 7.909 0.020 . 1 . . . . 4 ILE H . 20053 1
33 . 1 1 4 4 ILE HA H 1 4.149 0.020 . 1 . . . . 4 ILE HA . 20053 1
34 . 1 1 4 4 ILE HB H 1 1.668 0.020 . 1 . . . . 4 ILE HB . 20053 1
35 . 1 1 4 4 ILE HD11 H 1 0.749 0.020 . 1 . . . . 4 ILE HD1 . 20053 1
36 . 1 1 4 4 ILE HD12 H 1 0.749 0.020 . 1 . . . . 4 ILE HD1 . 20053 1
37 . 1 1 4 4 ILE HD13 H 1 0.749 0.020 . 1 . . . . 4 ILE HD1 . 20053 1
38 . 1 1 4 4 ILE HG12 H 1 1.323 0.020 . 2 . . . . 4 ILE HG12 . 20053 1
39 . 1 1 4 4 ILE HG13 H 1 1.009 0.020 . 2 . . . . 4 ILE HG13 . 20053 1
40 . 1 1 4 4 ILE HG21 H 1 0.749 0.020 . 1 . . . . 4 ILE HG2 . 20053 1
41 . 1 1 4 4 ILE HG22 H 1 0.749 0.020 . 1 . . . . 4 ILE HG2 . 20053 1
42 . 1 1 4 4 ILE HG23 H 1 0.749 0.020 . 1 . . . . 4 ILE HG2 . 20053 1
43 . 1 1 4 4 ILE CB C 13 40.360 0.400 . 1 . . . . 4 ILE CB . 20053 1
44 . 1 1 4 4 ILE CD1 C 13 14.680 0.400 . 1 . . . . 4 ILE CD1 . 20053 1
45 . 1 1 4 4 ILE CG1 C 13 27.980 0.400 . 1 . . . . 4 ILE CG1 . 20053 1
46 . 1 1 4 4 ILE CG2 C 13 19.030 0.400 . 1 . . . . 4 ILE CG2 . 20053 1
47 . 1 1 5 5 VAL H H 1 8.028 0.020 . 1 . . . . 5 VAL H . 20053 1
48 . 1 1 5 5 VAL HA H 1 4.018 0.020 . 1 . . . . 5 VAL HA . 20053 1
49 . 1 1 5 5 VAL HB H 1 1.899 0.020 . 1 . . . . 5 VAL HB . 20053 1
50 . 1 1 5 5 VAL HG11 H 1 0.782 0.020 . 2 . . . . 5 VAL HG1 . 20053 1
51 . 1 1 5 5 VAL HG12 H 1 0.782 0.020 . 2 . . . . 5 VAL HG1 . 20053 1
52 . 1 1 5 5 VAL HG13 H 1 0.782 0.020 . 2 . . . . 5 VAL HG1 . 20053 1
53 . 1 1 5 5 VAL HG21 H 1 0.782 0.020 . 2 . . . . 5 VAL HG2 . 20053 1
54 . 1 1 5 5 VAL HG22 H 1 0.782 0.020 . 2 . . . . 5 VAL HG2 . 20053 1
55 . 1 1 5 5 VAL HG23 H 1 0.782 0.020 . 2 . . . . 5 VAL HG2 . 20053 1
56 . 1 1 5 5 VAL CB C 13 33.870 0.400 . 1 . . . . 5 VAL CB . 20053 1
57 . 1 1 5 5 VAL CG1 C 13 22.870 0.400 . 1 . . . . 5 VAL CG1 . 20053 1
58 . 1 1 5 5 VAL CG2 C 13 22.160 0.400 . 1 . . . . 5 VAL CG2 . 20053 1
59 . 1 1 6 6 GLU H H 1 8.129 0.020 . 1 . . . . 6 GLU H . 20053 1
60 . 1 1 6 6 GLU HA H 1 4.192 0.020 . 1 . . . . 6 GLU HA . 20053 1
61 . 1 1 6 6 GLU HB2 H 1 1.852 0.020 . 2 . . . . 6 GLU HB2 . 20053 1
62 . 1 1 6 6 GLU HB3 H 1 1.708 0.020 . 2 . . . . 6 GLU HB3 . 20053 1
63 . 1 1 6 6 GLU HG2 H 1 2.199 0.020 . 2 . . . . 6 GLU HG2 . 20053 1
64 . 1 1 6 6 GLU HG3 H 1 2.199 0.020 . 2 . . . . 6 GLU HG3 . 20053 1
65 . 1 1 6 6 GLU CA C 13 57.000 0.400 . 1 . . . . 6 GLU CA . 20053 1
66 . 1 1 6 6 GLU CB C 13 30.820 0.400 . 1 . . . . 6 GLU CB . 20053 1
67 . 1 1 6 6 GLU CG C 13 33.780 0.400 . 1 . . . . 6 GLU CG . 20053 1
68 . 1 1 7 7 GLN H H 1 8.179 0.020 . 1 . . . . 7 GLN H . 20053 1
69 . 1 1 7 7 GLN HA H 1 4.173 0.020 . 1 . . . . 7 GLN HA . 20053 1
70 . 1 1 7 7 GLN HB2 H 1 1.847 0.020 . 2 . . . . 7 GLN HB2 . 20053 1
71 . 1 1 7 7 GLN HB3 H 1 1.730 0.020 . 2 . . . . 7 GLN HB3 . 20053 1
72 . 1 1 7 7 GLN HE21 H 1 6.836 0.020 . 2 . . . . 7 GLN HE21 . 20053 1
73 . 1 1 7 7 GLN HE22 H 1 7.398 0.020 . 2 . . . . 7 GLN HE22 . 20053 1
74 . 1 1 7 7 GLN HG2 H 1 2.099 0.020 . 2 . . . . 7 GLN HG2 . 20053 1
75 . 1 1 7 7 GLN HG3 H 1 2.099 0.020 . 2 . . . . 7 GLN HG3 . 20053 1
76 . 1 1 7 7 GLN CB C 13 31.330 0.400 . 1 . . . . 7 GLN CB . 20053 1
77 . 1 1 7 7 GLN CG C 13 35.010 0.400 . 1 . . . . 7 GLN CG . 20053 1
78 . 1 1 8 8 CYS H H 1 8.239 0.020 . 1 . . . . 8 CYS H . 20053 1
79 . 1 1 8 8 CYS HA H 1 4.362 0.020 . 1 . . . . 8 CYS HA . 20053 1
80 . 1 1 8 8 CYS HB2 H 1 2.754 0.020 . 2 . . . . 8 CYS HB2 . 20053 1
81 . 1 1 8 8 CYS HB3 H 1 2.694 0.020 . 2 . . . . 8 CYS HB3 . 20053 1
82 . 1 1 8 8 CYS CA C 13 59.060 0.400 . 1 . . . . 8 CYS CA . 20053 1
83 . 1 1 8 8 CYS CB C 13 29.540 0.400 . 1 . . . . 8 CYS CB . 20053 1
84 . 1 1 9 9 CYS H H 1 8.320 0.020 . 1 . . . . 9 CYS H . 20053 1
85 . 1 1 9 9 CYS HA H 1 4.427 0.020 . 1 . . . . 9 CYS HA . 20053 1
86 . 1 1 9 9 CYS HB2 H 1 2.780 0.020 . 2 . . . . 9 CYS HB2 . 20053 1
87 . 1 1 9 9 CYS HB3 H 1 2.721 0.020 . 2 . . . . 9 CYS HB3 . 20053 1
88 . 1 1 9 9 CYS CA C 13 59.160 0.400 . 1 . . . . 9 CYS CA . 20053 1
89 . 1 1 9 9 CYS CB C 13 29.570 0.400 . 1 . . . . 9 CYS CB . 20053 1
90 . 1 1 10 10 THR H H 1 7.939 0.020 . 1 . . . . 10 THR H . 20053 1
91 . 1 1 10 10 THR HA H 1 4.188 0.020 . 1 . . . . 10 THR HA . 20053 1
92 . 1 1 10 10 THR HB H 1 3.992 0.020 . 1 . . . . 10 THR HB . 20053 1
93 . 1 1 10 10 THR HG21 H 1 1.013 0.020 . 1 . . . . 10 THR HG2 . 20053 1
94 . 1 1 10 10 THR HG22 H 1 1.013 0.020 . 1 . . . . 10 THR HG2 . 20053 1
95 . 1 1 10 10 THR HG23 H 1 1.013 0.020 . 1 . . . . 10 THR HG2 . 20053 1
96 . 1 1 10 10 THR CA C 13 63.370 0.400 . 1 . . . . 10 THR CA . 20053 1
97 . 1 1 10 10 THR CB C 13 70.010 0.400 . 1 . . . . 10 THR CB . 20053 1
98 . 1 1 10 10 THR CG2 C 13 23.180 0.400 . 1 . . . . 10 THR CG2 . 20053 1
99 . 1 1 11 11 SER H H 1 7.935 0.020 . 1 . . . . 11 SER H . 20053 1
100 . 1 1 11 11 SER HA H 1 4.324 0.020 . 1 . . . . 11 SER HA . 20053 1
101 . 1 1 11 11 SER HB2 H 1 3.616 0.020 . 2 . . . . 11 SER HB2 . 20053 1
102 . 1 1 11 11 SER HB3 H 1 3.574 0.020 . 2 . . . . 11 SER HB3 . 20053 1
103 . 1 1 11 11 SER CA C 13 59.300 0.400 . 1 . . . . 11 SER CA . 20053 1
104 . 1 1 11 11 SER CB C 13 65.140 0.400 . 1 . . . . 11 SER CB . 20053 1
105 . 1 1 12 12 ILE H H 1 7.965 0.020 . 1 . . . . 12 ILE H . 20053 1
106 . 1 1 12 12 ILE HA H 1 4.094 0.020 . 1 . . . . 12 ILE HA . 20053 1
107 . 1 1 12 12 ILE HB H 1 1.743 0.020 . 1 . . . . 12 ILE HB . 20053 1
108 . 1 1 12 12 ILE HD11 H 1 0.772 0.020 . 1 . . . . 12 ILE HD1 . 20053 1
109 . 1 1 12 12 ILE HD12 H 1 0.772 0.020 . 1 . . . . 12 ILE HD1 . 20053 1
110 . 1 1 12 12 ILE HD13 H 1 0.772 0.020 . 1 . . . . 12 ILE HD1 . 20053 1
111 . 1 1 12 12 ILE HG12 H 1 1.367 0.020 . 2 . . . . 12 ILE HG12 . 20053 1
112 . 1 1 12 12 ILE HG13 H 1 1.066 0.020 . 2 . . . . 12 ILE HG13 . 20053 1
113 . 1 1 12 12 ILE HG21 H 1 0.772 0.020 . 1 . . . . 12 ILE HG2 . 20053 1
114 . 1 1 12 12 ILE HG22 H 1 0.772 0.020 . 1 . . . . 12 ILE HG2 . 20053 1
115 . 1 1 12 12 ILE HG23 H 1 0.772 0.020 . 1 . . . . 12 ILE HG2 . 20053 1
116 . 1 1 12 12 ILE CB C 13 39.800 0.400 . 1 . . . . 12 ILE CB . 20053 1
117 . 1 1 12 12 ILE CD1 C 13 14.830 0.400 . 1 . . . . 12 ILE CD1 . 20053 1
118 . 1 1 12 12 ILE CG1 C 13 28.090 0.400 . 1 . . . . 12 ILE CG1 . 20053 1
119 . 1 1 12 12 ILE CG2 C 13 19.100 0.400 . 1 . . . . 12 ILE CG2 . 20053 1
120 . 1 1 13 13 CYS H H 1 8.132 0.020 . 1 . . . . 13 CYS H . 20053 1
121 . 1 1 13 13 CYS HA H 1 4.324 0.020 . 1 . . . . 13 CYS HA . 20053 1
122 . 1 1 13 13 CYS HB2 H 1 2.758 0.020 . 2 . . . . 13 CYS HB2 . 20053 1
123 . 1 1 13 13 CYS HB3 H 1 2.675 0.020 . 2 . . . . 13 CYS HB3 . 20053 1
124 . 1 1 13 13 CYS CA C 13 58.830 0.400 . 1 . . . . 13 CYS CA . 20053 1
125 . 1 1 13 13 CYS CB C 13 29.500 0.400 . 1 . . . . 13 CYS CB . 20053 1
126 . 1 1 14 14 SER H H 1 8.001 0.020 . 1 . . . . 14 SER H . 20053 1
127 . 1 1 14 14 SER HA H 1 4.243 0.020 . 1 . . . . 14 SER HA . 20053 1
128 . 1 1 14 14 SER HB2 H 1 3.642 0.020 . 2 . . . . 14 SER HB2 . 20053 1
129 . 1 1 14 14 SER HB3 H 1 3.561 0.020 . 2 . . . . 14 SER HB3 . 20053 1
130 . 1 1 14 14 SER CA C 13 59.130 0.400 . 1 . . . . 14 SER CA . 20053 1
131 . 1 1 14 14 SER CB C 13 65.070 0.400 . 1 . . . . 14 SER CB . 20053 1
132 . 1 1 15 15 LEU H H 1 8.013 0.020 . 1 . . . . 15 LEU H . 20053 1
133 . 1 1 15 15 LEU HA H 1 4.039 0.020 . 1 . . . . 15 LEU HA . 20053 1
134 . 1 1 15 15 LEU HB2 H 1 1.254 0.020 . 2 . . . . 15 LEU HB2 . 20053 1
135 . 1 1 15 15 LEU HB3 H 1 1.254 0.020 . 2 . . . . 15 LEU HB3 . 20053 1
136 . 1 1 15 15 LEU HD11 H 1 0.770 0.020 . 2 . . . . 15 LEU HD1 . 20053 1
137 . 1 1 15 15 LEU HD12 H 1 0.770 0.020 . 2 . . . . 15 LEU HD1 . 20053 1
138 . 1 1 15 15 LEU HD13 H 1 0.770 0.020 . 2 . . . . 15 LEU HD1 . 20053 1
139 . 1 1 15 15 LEU HD21 H 1 0.705 0.020 . 2 . . . . 15 LEU HD2 . 20053 1
140 . 1 1 15 15 LEU HD22 H 1 0.705 0.020 . 2 . . . . 15 LEU HD2 . 20053 1
141 . 1 1 15 15 LEU HD23 H 1 0.705 0.020 . 2 . . . . 15 LEU HD2 . 20053 1
142 . 1 1 15 15 LEU HG H 1 1.466 0.020 . 1 . . . . 15 LEU HG . 20053 1
143 . 1 1 15 15 LEU CB C 13 43.620 0.400 . 1 . . . . 15 LEU CB . 20053 1
144 . 1 1 15 15 LEU CD1 C 13 26.660 0.400 . 1 . . . . 15 LEU CD1 . 20053 1
145 . 1 1 15 15 LEU CD2 C 13 24.940 0.400 . 1 . . . . 15 LEU CD2 . 20053 1
146 . 1 1 15 15 LEU CG C 13 28.490 0.400 . 1 . . . . 15 LEU CG . 20053 1
147 . 1 1 16 16 TYR H H 1 7.739 0.020 . 1 . . . . 16 TYR H . 20053 1
148 . 1 1 16 16 TYR HA H 1 4.328 0.020 . 1 . . . . 16 TYR HA . 20053 1
149 . 1 1 16 16 TYR HB2 H 1 2.948 0.020 . 2 . . . . 16 TYR HB2 . 20053 1
150 . 1 1 16 16 TYR HB3 H 1 2.585 0.020 . 2 . . . . 16 TYR HB3 . 20053 1
151 . 1 1 16 16 TYR HD1 H 1 6.984 0.020 . 1 . . . . 16 TYR HD1 . 20053 1
152 . 1 1 16 16 TYR HD2 H 1 6.984 0.020 . 1 . . . . 16 TYR HD2 . 20053 1
153 . 1 1 16 16 TYR HE1 H 1 6.608 0.020 . 1 . . . . 16 TYR HE1 . 20053 1
154 . 1 1 16 16 TYR HE2 H 1 6.608 0.020 . 1 . . . . 16 TYR HE2 . 20053 1
155 . 1 1 16 16 TYR CB C 13 40.030 0.400 . 1 . . . . 16 TYR CB . 20053 1
156 . 1 1 17 17 GLN H H 1 7.984 0.020 . 1 . . . . 17 GLN H . 20053 1
157 . 1 1 17 17 GLN HA H 1 4.109 0.020 . 1 . . . . 17 GLN HA . 20053 1
158 . 1 1 17 17 GLN HB2 H 1 1.948 0.020 . 2 . . . . 17 GLN HB2 . 20053 1
159 . 1 1 17 17 GLN HB3 H 1 1.781 0.020 . 2 . . . . 17 GLN HB3 . 20053 1
160 . 1 1 17 17 GLN HE21 H 1 6.840 0.020 . 2 . . . . 17 GLN HE21 . 20053 1
161 . 1 1 17 17 GLN HE22 H 1 7.432 0.020 . 2 . . . . 17 GLN HE22 . 20053 1
162 . 1 1 17 17 GLN HG2 H 1 2.120 0.020 . 2 . . . . 17 GLN HG2 . 20053 1
163 . 1 1 17 17 GLN HG3 H 1 2.120 0.020 . 2 . . . . 17 GLN HG3 . 20053 1
164 . 1 1 17 17 GLN CB C 13 30.560 0.400 . 1 . . . . 17 GLN CB . 20053 1
165 . 1 1 17 17 GLN CG C 13 35.010 0.400 . 1 . . . . 17 GLN CG . 20053 1
stop_
save_