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 11582
_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' 1 $sample_1 anisotropic 11582 1
2 '2D 1H-1H NOESY' 1 $sample_1 anisotropic 11582 1
3 '2D 1H-13C HSQC' 1 $sample_1 anisotropic 11582 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 3.867 . . 2 . . . A 1 GLY HA2 . 11582 1
2 . 1 1 1 1 GLY HA3 H 1 3.851 . . 2 . . . A 1 GLY HA3 . 11582 1
3 . 1 1 1 1 GLY H H 1 8.814 . . 1 . . . A 1 GLY H . 11582 1
4 . 1 1 1 1 GLY CA C 13 43.085 . . 1 . . . A 1 GLY CA . 11582 1
5 . 1 1 2 2 ALA H H 1 8.816 . . 1 . . . A 2 ALA H . 11582 1
6 . 1 1 2 2 ALA HA H 1 4.277 . . 1 . . . A 2 ALA HA . 11582 1
7 . 1 1 2 2 ALA HB1 H 1 1.381 . . 1 . . . A 2 ALA HB1 . 11582 1
8 . 1 1 2 2 ALA HB2 H 1 1.381 . . 1 . . . A 2 ALA HB2 . 11582 1
9 . 1 1 2 2 ALA HB3 H 1 1.381 . . 1 . . . A 2 ALA HB3 . 11582 1
10 . 1 1 2 2 ALA CA C 13 52.796 . . 1 . . . A 2 ALA CA . 11582 1
11 . 1 1 3 3 ALA H H 1 8.528 . . 1 . . . A 3 ALA H . 11582 1
12 . 1 1 3 3 ALA HA H 1 4.224 . . 1 . . . A 3 ALA HA . 11582 1
13 . 1 1 3 3 ALA HB1 H 1 1.378 . . 1 . . . A 3 ALA HB1 . 11582 1
14 . 1 1 3 3 ALA HB2 H 1 1.378 . . 1 . . . A 3 ALA HB2 . 11582 1
15 . 1 1 3 3 ALA HB3 H 1 1.378 . . 1 . . . A 3 ALA HB3 . 11582 1
16 . 1 1 3 3 ALA CA C 13 52.851 . . 1 . . . A 3 ALA CA . 11582 1
17 . 1 1 4 4 LEU H H 1 8.031 . . 1 . . . A 4 LEU H . 11582 1
18 . 1 1 4 4 LEU HA H 1 4.277 . . 1 . . . A 4 LEU HA . 11582 1
19 . 1 1 4 4 LEU HB2 H 1 1.650 . . 2 . . . A 4 LEU HB2 . 11582 1
20 . 1 1 4 4 LEU HB3 H 1 1.650 . . 2 . . . A 4 LEU HB3 . 11582 1
21 . 1 1 4 4 LEU HG H 1 1.571 . . 1 . . . A 4 LEU HG . 11582 1
22 . 1 1 4 4 LEU HD11 H 1 0.897 . . 2 . . . A 4 LEU HD11 . 11582 1
23 . 1 1 4 4 LEU HD12 H 1 0.897 . . 2 . . . A 4 LEU HD12 . 11582 1
24 . 1 1 4 4 LEU HD13 H 1 0.897 . . 2 . . . A 4 LEU HD13 . 11582 1
25 . 1 1 4 4 LEU HD21 H 1 0.897 . . 2 . . . A 4 LEU HD21 . 11582 1
26 . 1 1 4 4 LEU HD22 H 1 0.897 . . 2 . . . A 4 LEU HD22 . 11582 1
27 . 1 1 4 4 LEU HD23 H 1 0.897 . . 2 . . . A 4 LEU HD23 . 11582 1
28 . 1 1 4 4 LEU CA C 13 55.165 . . 1 . . . A 4 LEU CA . 11582 1
29 . 1 1 5 5 GLN H H 1 8.191 . . 1 . . . A 5 GLN H . 11582 1
30 . 1 1 5 5 GLN HA H 1 4.448 . . 1 . . . A 5 GLN HA . 11582 1
31 . 1 1 5 5 GLN HB2 H 1 1.969 . . 2 . . . A 5 GLN HB2 . 11582 1
32 . 1 1 5 5 GLN HB3 H 1 2.136 . . 2 . . . A 5 GLN HB3 . 11582 1
33 . 1 1 5 5 GLN HG2 H 1 2.320 . . 2 . . . A 5 GLN HG2 . 11582 1
34 . 1 1 5 5 GLN HG3 H 1 2.320 . . 2 . . . A 5 GLN HG3 . 11582 1
35 . 1 1 5 5 GLN CA C 13 55.140 . . 1 . . . A 5 GLN CA . 11582 1
36 . 1 1 6 6 ILE H H 1 8.213 . . 1 . . . A 6 ILE H . 11582 1
37 . 1 1 6 6 ILE HA H 1 4.204 . . 1 . . . A 6 ILE HA . 11582 1
38 . 1 1 6 6 ILE HB H 1 1.964 . . 1 . . . A 6 ILE HB . 11582 1
39 . 1 1 6 6 ILE HG12 H 1 1.149 . . 2 . . . A 6 ILE HG12 . 11582 1
40 . 1 1 6 6 ILE HG13 H 1 1.149 . . 2 . . . A 6 ILE HG13 . 11582 1
41 . 1 1 6 6 ILE HG21 H 1 0.914 . . 1 . . . A 6 ILE HG21 . 11582 1
42 . 1 1 6 6 ILE HG22 H 1 0.914 . . 1 . . . A 6 ILE HG22 . 11582 1
43 . 1 1 6 6 ILE HG23 H 1 0.914 . . 1 . . . A 6 ILE HG23 . 11582 1
44 . 1 1 6 6 ILE HD11 H 1 0.862 . . 1 . . . A 6 ILE HD11 . 11582 1
45 . 1 1 6 6 ILE HD12 H 1 0.862 . . 1 . . . A 6 ILE HD12 . 11582 1
46 . 1 1 6 6 ILE HD13 H 1 0.862 . . 1 . . . A 6 ILE HD13 . 11582 1
47 . 1 1 6 6 ILE CA C 13 61.542 . . 1 . . . A 6 ILE CA . 11582 1
48 . 1 1 7 7 PRO HA H 1 3.871 . . 1 . . . A 7 PRO HA . 11582 1
49 . 1 1 7 7 PRO HB2 H 1 1.868 . . 2 . . . A 7 PRO HB2 . 11582 1
50 . 1 1 7 7 PRO HB3 H 1 2.341 . . 2 . . . A 7 PRO HB3 . 11582 1
51 . 1 1 7 7 PRO HG2 H 1 2.018 . . 2 . . . A 7 PRO HG2 . 11582 1
52 . 1 1 7 7 PRO HG3 H 1 1.973 . . 2 . . . A 7 PRO HG3 . 11582 1
53 . 1 1 7 7 PRO HD2 H 1 3.652 . . 2 . . . A 7 PRO HD2 . 11582 1
54 . 1 1 7 7 PRO HD3 H 1 3.652 . . 2 . . . A 7 PRO HD3 . 11582 1
55 . 1 1 7 7 PRO CA C 13 68.323 . . 1 . . . A 7 PRO CA . 11582 1
56 . 1 1 8 8 PHE H H 1 8.171 . . 1 . . . A 8 PHE H . 11582 1
57 . 1 1 8 8 PHE HA H 1 4.374 . . 1 . . . A 8 PHE HA . 11582 1
58 . 1 1 8 8 PHE HB2 H 1 3.132 . . 2 . . . A 8 PHE HB2 . 11582 1
59 . 1 1 8 8 PHE HB3 H 1 3.284 . . 2 . . . A 8 PHE HB3 . 11582 1
60 . 1 1 8 8 PHE HD1 H 1 7.236 . . 1 . . . A 8 PHE HD1 . 11582 1
61 . 1 1 8 8 PHE HD2 H 1 7.247 . . 1 . . . A 8 PHE HD2 . 11582 1
62 . 1 1 8 8 PHE HE1 H 1 7.310 . . 1 . . . A 8 PHE HE1 . 11582 1
63 . 1 1 8 8 PHE HE2 H 1 7.310 . . 1 . . . A 8 PHE HE2 . 11582 1
64 . 1 1 8 8 PHE HZ H 1 7.436 . . 1 . . . A 8 PHE HZ . 11582 1
65 . 1 1 8 8 PHE CA C 13 58.413 . . 1 . . . A 8 PHE CA . 11582 1
66 . 1 1 9 9 ALA H H 1 8.486 . . 1 . . . A 9 ALA H . 11582 1
67 . 1 1 9 9 ALA HA H 1 3.984 . . 1 . . . A 9 ALA HA . 11582 1
68 . 1 1 9 9 ALA HB1 H 1 1.442 . . 1 . . . A 9 ALA HB1 . 11582 1
69 . 1 1 9 9 ALA HB2 H 1 1.442 . . 1 . . . A 9 ALA HB2 . 11582 1
70 . 1 1 9 9 ALA HB3 H 1 1.442 . . 1 . . . A 9 ALA HB3 . 11582 1
71 . 1 1 9 9 ALA CA C 13 53.999 . . 1 . . . A 9 ALA CA . 11582 1
72 . 1 1 10 10 MET H H 1 7.990 . . 1 . . . A 10 MET H . 11582 1
73 . 1 1 10 10 MET HA H 1 4.149 . . 1 . . . A 10 MET HA . 11582 1
74 . 1 1 10 10 MET HB2 H 1 2.082 . . 2 . . . A 10 MET HB2 . 11582 1
75 . 1 1 10 10 MET HB3 H 1 2.033 . . 2 . . . A 10 MET HB3 . 11582 1
76 . 1 1 10 10 MET HG2 H 1 2.613 . . 2 . . . A 10 MET HG2 . 11582 1
77 . 1 1 10 10 MET HG3 H 1 2.462 . . 2 . . . A 10 MET HG3 . 11582 1
78 . 1 1 10 10 MET CA C 13 55.967 . . 1 . . . A 10 MET CA . 11582 1
79 . 1 1 11 11 GLN H H 1 7.976 . . 1 . . . A 11 GLN H . 11582 1
80 . 1 1 11 11 GLN HA H 1 4.207 . . 1 . . . A 11 GLN HA . 11582 1
81 . 1 1 11 11 GLN HB2 H 1 2.089 . . 2 . . . A 11 GLN HB2 . 11582 1
82 . 1 1 11 11 GLN HB3 H 1 1.925 . . 2 . . . A 11 GLN HB3 . 11582 1
83 . 1 1 11 11 GLN HG2 H 1 2.419 . . 2 . . . A 11 GLN HG2 . 11582 1
84 . 1 1 11 11 GLN HG3 H 1 2.256 . . 2 . . . A 11 GLN HG3 . 11582 1
85 . 1 1 11 11 GLN CA C 13 57.289 . . 1 . . . A 11 GLN CA . 11582 1
86 . 1 1 12 12 MET H H 1 7.991 . . 1 . . . A 12 MET H . 11582 1
87 . 1 1 12 12 MET HA H 1 3.988 . . 1 . . . A 12 MET HA . 11582 1
88 . 1 1 12 12 MET HB2 H 1 2.095 . . 2 . . . A 12 MET HB2 . 11582 1
89 . 1 1 12 12 MET HB3 H 1 2.095 . . 2 . . . A 12 MET HB3 . 11582 1
90 . 1 1 12 12 MET HG2 H 1 2.422 . . 2 . . . A 12 MET HG2 . 11582 1
91 . 1 1 12 12 MET HG3 H 1 2.320 . . 2 . . . A 12 MET HG3 . 11582 1
92 . 1 1 13 13 ALA H H 1 7.996 . . 1 . . . A 13 ALA H . 11582 1
93 . 1 1 13 13 ALA HA H 1 4.051 . . 1 . . . A 13 ALA HA . 11582 1
94 . 1 1 13 13 ALA HB1 H 1 1.436 . . 1 . . . A 13 ALA HB1 . 11582 1
95 . 1 1 13 13 ALA HB2 H 1 1.436 . . 1 . . . A 13 ALA HB2 . 11582 1
96 . 1 1 13 13 ALA HB3 H 1 1.436 . . 1 . . . A 13 ALA HB3 . 11582 1
97 . 1 1 13 13 ALA CA C 13 54.164 . . 1 . . . A 13 ALA CA . 11582 1
98 . 1 1 14 14 TYR H H 1 7.895 . . 1 . . . A 14 TYR H . 11582 1
99 . 1 1 14 14 TYR HA H 1 4.247 . . 1 . . . A 14 TYR HA . 11582 1
100 . 1 1 14 14 TYR HB2 H 1 3.056 . . 2 . . . A 14 TYR HB2 . 11582 1
101 . 1 1 14 14 TYR HB3 H 1 3.056 . . 2 . . . A 14 TYR HB3 . 11582 1
102 . 1 1 14 14 TYR HD1 H 1 7.064 . . 1 . . . A 14 TYR HD1 . 11582 1
103 . 1 1 14 14 TYR HD2 H 1 7.052 . . 1 . . . A 14 TYR HD2 . 11582 1
104 . 1 1 14 14 TYR HE1 H 1 6.784 . . 1 . . . A 14 TYR HE1 . 11582 1
105 . 1 1 14 14 TYR HE2 H 1 6.784 . . 1 . . . A 14 TYR HE2 . 11582 1
106 . 1 1 14 14 TYR CA C 13 60.720 . . 1 . . . A 14 TYR CA . 11582 1
107 . 1 1 15 15 ARG H H 1 7.675 . . 1 . . . A 15 ARG H . 11582 1
108 . 1 1 15 15 ARG HA H 1 4.001 . . 1 . . . A 15 ARG HA . 11582 1
109 . 1 1 15 15 ARG HB2 H 1 1.643 . . 2 . . . A 15 ARG HB2 . 11582 1
110 . 1 1 15 15 ARG HB3 H 1 1.720 . . 2 . . . A 15 ARG HB3 . 11582 1
111 . 1 1 15 15 ARG HG2 H 1 1.371 . . 2 . . . A 15 ARG HG2 . 11582 1
112 . 1 1 15 15 ARG HG3 H 1 1.465 . . 2 . . . A 15 ARG HG3 . 11582 1
113 . 1 1 15 15 ARG HD2 H 1 3.039 . . 2 . . . A 15 ARG HD2 . 11582 1
114 . 1 1 15 15 ARG HD3 H 1 3.039 . . 2 . . . A 15 ARG HD3 . 11582 1
115 . 1 1 15 15 ARG HE H 1 7.346 . . 1 . . . A 15 ARG HE . 11582 1
116 . 1 1 15 15 ARG CA C 13 58.001 . . 1 . . . A 15 ARG CA . 11582 1
117 . 1 1 16 16 PHE H H 1 7.809 . . 1 . . . A 16 PHE H . 11582 1
118 . 1 1 16 16 PHE HA H 1 4.423 . . 1 . . . A 16 PHE HA . 11582 1
119 . 1 1 16 16 PHE HB2 H 1 2.971 . . 2 . . . A 16 PHE HB2 . 11582 1
120 . 1 1 16 16 PHE HB3 H 1 3.248 . . 2 . . . A 16 PHE HB3 . 11582 1
121 . 1 1 16 16 PHE HD1 H 1 7.226 . . 1 . . . A 16 PHE HD1 . 11582 1
122 . 1 1 16 16 PHE HD2 H 1 7.259 . . 1 . . . A 16 PHE HD2 . 11582 1
123 . 1 1 16 16 PHE HE1 H 1 7.316 . . 1 . . . A 16 PHE HE1 . 11582 1
124 . 1 1 16 16 PHE HE2 H 1 7.328 . . 1 . . . A 16 PHE HE2 . 11582 1
125 . 1 1 16 16 PHE CA C 13 59.553 . . 1 . . . A 16 PHE CA . 11582 1
stop_
save_