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 20020
_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' . . . 20020 1
2 '2D 1H-1H NOESY' . . . 20020 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
3 $XEASY . . 20020 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 ARG HA H 1 4.077 0.003 . 1 . . . . 1 ARG HA . 20020 1
2 . 1 1 1 1 ARG HB2 H 1 1.960 0.003 . 1 . . . . 1 ARG QB . 20020 1
3 . 1 1 1 1 ARG HB3 H 1 1.960 0.003 . 1 . . . . 1 ARG QB . 20020 1
4 . 1 1 1 1 ARG HD2 H 1 3.279 0.003 . 1 . . . . 1 ARG QD . 20020 1
5 . 1 1 1 1 ARG HD3 H 1 3.279 0.003 . 1 . . . . 1 ARG QD . 20020 1
6 . 1 1 1 1 ARG HG2 H 1 1.699 0.003 . 1 . . . . 1 ARG QG . 20020 1
7 . 1 1 1 1 ARG HG3 H 1 1.699 0.003 . 1 . . . . 1 ARG QG . 20020 1
8 . 1 1 2 2 LYS HA H 1 4.447 0.001 . 1 . . . . 2 LYS HA . 20020 1
9 . 1 1 2 2 LYS HB2 H 1 1.909 0.003 . 2 . . . . 2 LYS HB2 . 20020 1
10 . 1 1 2 2 LYS HB3 H 1 1.822 0.003 . 2 . . . . 2 LYS HB3 . 20020 1
11 . 1 1 2 2 LYS HD2 H 1 1.749 0.003 . 1 . . . . 2 LYS QD . 20020 1
12 . 1 1 2 2 LYS HD3 H 1 1.749 0.003 . 1 . . . . 2 LYS QD . 20020 1
13 . 1 1 2 2 LYS HE2 H 1 3.058 0.003 . 1 . . . . 2 LYS QE . 20020 1
14 . 1 1 2 2 LYS HE3 H 1 3.058 0.003 . 1 . . . . 2 LYS QE . 20020 1
15 . 1 1 2 2 LYS HG2 H 1 1.503 0.003 . 1 . . . . 2 LYS QG . 20020 1
16 . 1 1 2 2 LYS HG3 H 1 1.503 0.003 . 1 . . . . 2 LYS QG . 20020 1
17 . 1 1 3 3 SER H H 1 8.720 0.003 . 1 . . . . 3 SER HN . 20020 1
18 . 1 1 3 3 SER HA H 1 4.530 0.003 . 1 . . . . 3 SER HA . 20020 1
19 . 1 1 3 3 SER HB2 H 1 3.898 0.001 . 1 . . . . 3 SER QB . 20020 1
20 . 1 1 3 3 SER HB3 H 1 3.898 0.001 . 1 . . . . 3 SER QB . 20020 1
21 . 1 1 4 4 ILE H H 1 8.481 0.002 . 1 . . . . 4 ILE HN . 20020 1
22 . 1 1 4 4 ILE HA H 1 4.259 0.003 . 1 . . . . 4 ILE HA . 20020 1
23 . 1 1 4 4 ILE HB H 1 1.919 0.003 . 1 . . . . 4 ILE HB . 20020 1
24 . 1 1 4 4 ILE HD11 H 1 0.918 0.003 . 1 . . . . 4 ILE QD1 . 20020 1
25 . 1 1 4 4 ILE HD12 H 1 0.918 0.003 . 1 . . . . 4 ILE QD1 . 20020 1
26 . 1 1 4 4 ILE HD13 H 1 0.918 0.003 . 1 . . . . 4 ILE QD1 . 20020 1
27 . 1 1 4 4 ILE HG12 H 1 1.505 0.001 . 2 . . . . 4 ILE HG12 . 20020 1
28 . 1 1 4 4 ILE HG13 H 1 1.247 0.003 . 2 . . . . 4 ILE HG13 . 20020 1
29 . 1 1 4 4 ILE HG21 H 1 0.957 0.003 . 1 . . . . 4 ILE QG2 . 20020 1
30 . 1 1 4 4 ILE HG22 H 1 0.957 0.003 . 1 . . . . 4 ILE QG2 . 20020 1
31 . 1 1 4 4 ILE HG23 H 1 0.957 0.003 . 1 . . . . 4 ILE QG2 . 20020 1
32 . 1 1 5 5 ARG H H 1 8.584 0.003 . 1 . . . . 5 ARG HN . 20020 1
33 . 1 1 5 5 ARG HA H 1 4.419 0.003 . 1 . . . . 5 ARG HA . 20020 1
34 . 1 1 5 5 ARG HB2 H 1 1.841 0.003 . 2 . . . . 5 ARG HB2 . 20020 1
35 . 1 1 5 5 ARG HB3 H 1 1.789 0.003 . 2 . . . . 5 ARG HB3 . 20020 1
36 . 1 1 5 5 ARG HD2 H 1 3.231 0.003 . 1 . . . . 5 ARG QD . 20020 1
37 . 1 1 5 5 ARG HD3 H 1 3.231 0.003 . 1 . . . . 5 ARG QD . 20020 1
38 . 1 1 5 5 ARG HE H 1 7.307 0.003 . 1 . . . . 5 ARG HE . 20020 1
39 . 1 1 5 5 ARG HG2 H 1 1.675 0.003 . 2 . . . . 5 ARG HG2 . 20020 1
40 . 1 1 5 5 ARG HG3 H 1 1.598 0.003 . 2 . . . . 5 ARG HG3 . 20020 1
41 . 1 1 6 6 ILE H H 1 8.504 0.002 . 1 . . . . 6 ILE HN . 20020 1
42 . 1 1 6 6 ILE HA H 1 4.185 0.003 . 1 . . . . 6 ILE HA . 20020 1
43 . 1 1 6 6 ILE HB H 1 1.874 0.003 . 1 . . . . 6 ILE HB . 20020 1
44 . 1 1 6 6 ILE HD11 H 1 0.903 0.003 . 1 . . . . 6 ILE QD1 . 20020 1
45 . 1 1 6 6 ILE HD12 H 1 0.903 0.003 . 1 . . . . 6 ILE QD1 . 20020 1
46 . 1 1 6 6 ILE HD13 H 1 0.903 0.003 . 1 . . . . 6 ILE QD1 . 20020 1
47 . 1 1 6 6 ILE HG12 H 1 1.537 0.003 . 2 . . . . 6 ILE HG12 . 20020 1
48 . 1 1 6 6 ILE HG13 H 1 1.244 0.001 . 2 . . . . 6 ILE HG13 . 20020 1
49 . 1 1 6 6 ILE HG21 H 1 0.930 0.003 . 1 . . . . 6 ILE QG2 . 20020 1
50 . 1 1 6 6 ILE HG22 H 1 0.930 0.003 . 1 . . . . 6 ILE QG2 . 20020 1
51 . 1 1 6 6 ILE HG23 H 1 0.930 0.003 . 1 . . . . 6 ILE QG2 . 20020 1
52 . 1 1 7 7 GLN H H 1 8.721 0.001 . 1 . . . . 7 GLN HN . 20020 1
53 . 1 1 7 7 GLN HA H 1 4.413 0.003 . 1 . . . . 7 GLN HA . 20020 1
54 . 1 1 7 7 GLN HB2 H 1 2.116 0.002 . 2 . . . . 7 GLN HB2 . 20020 1
55 . 1 1 7 7 GLN HB3 H 1 2.014 0.001 . 2 . . . . 7 GLN HB3 . 20020 1
56 . 1 1 7 7 GLN HE21 H 1 7.026 0.003 . 2 . . . . 7 GLN HE21 . 20020 1
57 . 1 1 7 7 GLN HE22 H 1 7.699 0.001 . 2 . . . . 7 GLN HE22 . 20020 1
58 . 1 1 7 7 GLN HG2 H 1 2.389 0.003 . 1 . . . . 7 GLN QG . 20020 1
59 . 1 1 7 7 GLN HG3 H 1 2.389 0.003 . 1 . . . . 7 GLN QG . 20020 1
60 . 1 1 8 8 ARG H H 1 8.685 0.003 . 1 . . . . 8 ARG HN . 20020 1
61 . 1 1 8 8 ARG HA H 1 4.447 0.003 . 1 . . . . 8 ARG HA . 20020 1
62 . 1 1 8 8 ARG HB2 H 1 1.913 0.003 . 2 . . . . 8 ARG HB2 . 20020 1
63 . 1 1 8 8 ARG HB3 H 1 1.805 0.003 . 2 . . . . 8 ARG HB3 . 20020 1
64 . 1 1 8 8 ARG HD2 H 1 3.224 0.003 . 1 . . . . 8 ARG QD . 20020 1
65 . 1 1 8 8 ARG HD3 H 1 3.224 0.003 . 1 . . . . 8 ARG QD . 20020 1
66 . 1 1 8 8 ARG HE H 1 7.307 0.002 . 1 . . . . 8 ARG HE . 20020 1
67 . 1 1 8 8 ARG HG2 H 1 1.678 0.003 . 1 . . . . 8 ARG QG . 20020 1
68 . 1 1 8 8 ARG HG3 H 1 1.678 0.003 . 1 . . . . 8 ARG QG . 20020 1
69 . 1 1 9 9 GLY H H 1 8.509 0.003 . 1 . . . . 9 GLY HN . 20020 1
70 . 1 1 9 9 GLY HA2 H 1 4.188 0.002 . 2 . . . . 9 GLY HA1 . 20020 1
71 . 1 1 9 9 GLY HA3 H 1 4.126 0.001 . 2 . . . . 9 GLY HA2 . 20020 1
72 . 1 1 10 10 PRO HA H 1 4.498 0.003 . 1 . . . . 10 PRO HA . 20020 1
73 . 1 1 10 10 PRO HB2 H 1 2.333 0.003 . 2 . . . . 10 PRO HB2 . 20020 1
74 . 1 1 10 10 PRO HB3 H 1 2.082 0.003 . 2 . . . . 10 PRO HB3 . 20020 1
75 . 1 1 10 10 PRO HD2 H 1 3.683 0.003 . 1 . . . . 10 PRO QD . 20020 1
76 . 1 1 10 10 PRO HD3 H 1 3.683 0.003 . 1 . . . . 10 PRO QD . 20020 1
77 . 1 1 10 10 PRO HG2 H 1 2.033 0.003 . 1 . . . . 10 PRO QG . 20020 1
78 . 1 1 10 10 PRO HG3 H 1 2.033 0.003 . 1 . . . . 10 PRO QG . 20020 1
79 . 1 1 11 11 GLY H H 1 8.709 0.003 . 1 . . . . 11 GLY HN . 20020 1
80 . 1 1 11 11 GLY HA2 H 1 3.992 0.001 . 1 . . . . 11 GLY QA . 20020 1
81 . 1 1 11 11 GLY HA3 H 1 3.992 0.001 . 1 . . . . 11 GLY QA . 20020 1
82 . 1 1 12 12 ARG H H 1 8.257 0.003 . 1 . . . . 12 ARG HN . 20020 1
83 . 1 1 12 12 ARG HA H 1 4.350 0.003 . 1 . . . . 12 ARG HA . 20020 1
84 . 1 1 12 12 ARG HB2 H 1 1.839 0.002 . 2 . . . . 12 ARG HB2 . 20020 1
85 . 1 1 12 12 ARG HB3 H 1 1.752 0.003 . 2 . . . . 12 ARG HB3 . 20020 1
86 . 1 1 12 12 ARG HD2 H 1 3.194 0.001 . 1 . . . . 12 ARG QD . 20020 1
87 . 1 1 12 12 ARG HD3 H 1 3.194 0.001 . 1 . . . . 12 ARG QD . 20020 1
88 . 1 1 12 12 ARG HE H 1 7.255 0.003 . 1 . . . . 12 ARG HE . 20020 1
89 . 1 1 12 12 ARG HG2 H 1 1.596 0.001 . 1 . . . . 12 ARG QG . 20020 1
90 . 1 1 12 12 ARG HG3 H 1 1.596 0.001 . 1 . . . . 12 ARG QG . 20020 1
91 . 1 1 13 13 ALA H H 1 8.478 0.001 . 1 . . . . 13 ALA HN . 20020 1
92 . 1 1 13 13 ALA HA H 1 4.323 0.002 . 1 . . . . 13 ALA HA . 20020 1
93 . 1 1 13 13 ALA HB1 H 1 1.349 0.003 . 1 . . . . 13 ALA QB . 20020 1
94 . 1 1 13 13 ALA HB2 H 1 1.349 0.003 . 1 . . . . 13 ALA QB . 20020 1
95 . 1 1 13 13 ALA HB3 H 1 1.349 0.003 . 1 . . . . 13 ALA QB . 20020 1
96 . 1 1 14 14 PHE H H 1 8.357 0.003 . 1 . . . . 14 PHE HN . 20020 1
97 . 1 1 14 14 PHE HA H 1 4.708 0.003 . 1 . . . . 14 PHE HA . 20020 1
98 . 1 1 14 14 PHE HB2 H 1 3.223 0.003 . 2 . . . . 14 PHE HB2 . 20020 1
99 . 1 1 14 14 PHE HB3 H 1 3.056 0.003 . 2 . . . . 14 PHE HB3 . 20020 1
100 . 1 1 14 14 PHE HD1 H 1 7.305 0.003 . 1 . . . . 14 PHE QD . 20020 1
101 . 1 1 14 14 PHE HD2 H 1 7.305 0.003 . 1 . . . . 14 PHE QD . 20020 1
102 . 1 1 14 14 PHE HE1 H 1 7.391 0.003 . 1 . . . . 14 PHE QE . 20020 1
103 . 1 1 14 14 PHE HE2 H 1 7.391 0.003 . 1 . . . . 14 PHE QE . 20020 1
104 . 1 1 14 14 PHE HZ H 1 7.346 0.003 . 1 . . . . 14 PHE HZ . 20020 1
105 . 1 1 15 15 VAL H H 1 7.787 0.003 . 1 . . . . 15 VAL HN . 20020 1
106 . 1 1 15 15 VAL HA H 1 4.050 0.003 . 1 . . . . 15 VAL HA . 20020 1
107 . 1 1 15 15 VAL HB H 1 2.093 0.003 . 1 . . . . 15 VAL HB . 20020 1
108 . 1 1 15 15 VAL HG11 H 1 0.940 0.003 . 1 . . . . 15 VAL QQG . 20020 1
109 . 1 1 15 15 VAL HG12 H 1 0.940 0.003 . 1 . . . . 15 VAL QQG . 20020 1
110 . 1 1 15 15 VAL HG13 H 1 0.940 0.003 . 1 . . . . 15 VAL QQG . 20020 1
111 . 1 1 15 15 VAL HG21 H 1 0.940 0.003 . 1 . . . . 15 VAL QQG . 20020 1
112 . 1 1 15 15 VAL HG22 H 1 0.940 0.003 . 1 . . . . 15 VAL QQG . 20020 1
113 . 1 1 15 15 VAL HG23 H 1 0.940 0.003 . 1 . . . . 15 VAL QQG . 20020 1
stop_
save_