Content for NMR-STAR saveframe, "assigned_chemical_shifts_1"
save_assigned_chemical_shifts_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1
_Assigned_chem_shift_list.Entry_ID 30109
_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 $chem_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' . . . 30109 1
2 '2D 1H-1H NOESY' . . . 30109 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 $software_3 . . 30109 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 2 2 GLY H H 1 8.5278 0.0000 . 1 . . . A 2 GLY H . 30109 1
2 . 1 1 2 2 GLY HA2 H 1 3.9180 0.0000 . 2 . . . A 2 GLY HA2 . 30109 1
3 . 1 1 3 3 ILE H H 1 7.6364 0.0000 . 1 . . . A 3 ILE H . 30109 1
4 . 1 1 3 3 ILE HA H 1 4.0572 0.0000 . 1 . . . A 3 ILE HA . 30109 1
5 . 1 1 3 3 ILE HB H 1 2.0151 0.0000 . 1 . . . A 3 ILE HB . 30109 1
6 . 1 1 3 3 ILE HG12 H 1 1.5970 0.0000 . 2 . . . A 3 ILE HG12 . 30109 1
7 . 1 1 3 3 ILE HG13 H 1 1.2875 0.0000 . 2 . . . A 3 ILE HG13 . 30109 1
8 . 1 1 3 3 ILE HG21 H 1 0.9800 0.0000 . 1 . . . A 3 ILE HG21 . 30109 1
9 . 1 1 3 3 ILE HG22 H 1 0.9800 0.0000 . 1 . . . A 3 ILE HG22 . 30109 1
10 . 1 1 3 3 ILE HG23 H 1 0.9800 0.0000 . 1 . . . A 3 ILE HG23 . 30109 1
11 . 1 1 3 3 ILE HD11 H 1 0.9361 0.0000 . 1 . . . A 3 ILE HD11 . 30109 1
12 . 1 1 3 3 ILE HD12 H 1 0.9361 0.0000 . 1 . . . A 3 ILE HD12 . 30109 1
13 . 1 1 3 3 ILE HD13 H 1 0.9361 0.0000 . 1 . . . A 3 ILE HD13 . 30109 1
14 . 1 1 4 4 ILE H H 1 7.5455 0.0000 . 1 . . . A 4 ILE H . 30109 1
15 . 1 1 4 4 ILE HA H 1 3.8814 0.0000 . 1 . . . A 4 ILE HA . 30109 1
16 . 1 1 4 4 ILE HB H 1 2.0172 0.0000 . 1 . . . A 4 ILE HB . 30109 1
17 . 1 1 4 4 ILE HG12 H 1 1.6284 0.0000 . 2 . . . A 4 ILE HG12 . 30109 1
18 . 1 1 4 4 ILE HG13 H 1 1.3372 0.0000 . 2 . . . A 4 ILE HG13 . 30109 1
19 . 1 1 4 4 ILE HG21 H 1 0.9811 0.0000 . 1 . . . A 4 ILE HG21 . 30109 1
20 . 1 1 4 4 ILE HG22 H 1 0.9811 0.0000 . 1 . . . A 4 ILE HG22 . 30109 1
21 . 1 1 4 4 ILE HG23 H 1 0.9811 0.0000 . 1 . . . A 4 ILE HG23 . 30109 1
22 . 1 1 4 4 ILE HD11 H 1 0.9079 0.0000 . 1 . . . A 4 ILE HD11 . 30109 1
23 . 1 1 4 4 ILE HD12 H 1 0.9079 0.0000 . 1 . . . A 4 ILE HD12 . 30109 1
24 . 1 1 4 4 ILE HD13 H 1 0.9079 0.0000 . 1 . . . A 4 ILE HD13 . 30109 1
25 . 1 1 5 5 ALA H H 1 8.0370 0.0000 . 1 . . . A 5 ALA H . 30109 1
26 . 1 1 5 5 ALA HA H 1 4.0666 0.0000 . 1 . . . A 5 ALA HA . 30109 1
27 . 1 1 5 5 ALA HB1 H 1 1.4836 0.0000 . 1 . . . A 5 ALA HB1 . 30109 1
28 . 1 1 5 5 ALA HB2 H 1 1.4836 0.0000 . 1 . . . A 5 ALA HB2 . 30109 1
29 . 1 1 5 5 ALA HB3 H 1 1.4836 0.0000 . 1 . . . A 5 ALA HB3 . 30109 1
30 . 1 1 6 6 GLY H H 1 7.7944 0.0000 . 1 . . . A 6 GLY H . 30109 1
31 . 1 1 6 6 GLY HA2 H 1 3.9009 0.0000 . 2 . . . A 6 GLY HA2 . 30109 1
32 . 1 1 7 7 ILE H H 1 7.9582 0.0000 . 1 . . . A 7 ILE H . 30109 1
33 . 1 1 7 7 ILE HA H 1 3.8409 0.0000 . 1 . . . A 7 ILE HA . 30109 1
34 . 1 1 7 7 ILE HB H 1 2.0796 0.0000 . 1 . . . A 7 ILE HB . 30109 1
35 . 1 1 7 7 ILE HG12 H 1 1.8076 0.0000 . 2 . . . A 7 ILE HG12 . 30109 1
36 . 1 1 7 7 ILE HG13 H 1 1.1706 0.0000 . 2 . . . A 7 ILE HG13 . 30109 1
37 . 1 1 7 7 ILE HG21 H 1 0.9721 0.0000 . 1 . . . A 7 ILE HG21 . 30109 1
38 . 1 1 7 7 ILE HG22 H 1 0.9721 0.0000 . 1 . . . A 7 ILE HG22 . 30109 1
39 . 1 1 7 7 ILE HG23 H 1 0.9721 0.0000 . 1 . . . A 7 ILE HG23 . 30109 1
40 . 1 1 7 7 ILE HD11 H 1 0.8837 0.0000 . 1 . . . A 7 ILE HD11 . 30109 1
41 . 1 1 7 7 ILE HD12 H 1 0.8837 0.0000 . 1 . . . A 7 ILE HD12 . 30109 1
42 . 1 1 7 7 ILE HD13 H 1 0.8837 0.0000 . 1 . . . A 7 ILE HD13 . 30109 1
43 . 1 1 8 8 ILE H H 1 8.2937 0.0000 . 1 . . . A 8 ILE H . 30109 1
44 . 1 1 8 8 ILE HA H 1 3.7224 0.0000 . 1 . . . A 8 ILE HA . 30109 1
45 . 1 1 8 8 ILE HB H 1 1.9969 0.0000 . 1 . . . A 8 ILE HB . 30109 1
46 . 1 1 8 8 ILE HG12 H 1 1.7613 0.0000 . 2 . . . A 8 ILE HG12 . 30109 1
47 . 1 1 8 8 ILE HG13 H 1 1.2712 0.0000 . 2 . . . A 8 ILE HG13 . 30109 1
48 . 1 1 8 8 ILE HG21 H 1 0.9528 0.0000 . 1 . . . A 8 ILE HG21 . 30109 1
49 . 1 1 8 8 ILE HG22 H 1 0.9528 0.0000 . 1 . . . A 8 ILE HG22 . 30109 1
50 . 1 1 8 8 ILE HG23 H 1 0.9528 0.0000 . 1 . . . A 8 ILE HG23 . 30109 1
51 . 1 1 8 8 ILE HD11 H 1 0.8504 0.0000 . 1 . . . A 8 ILE HD11 . 30109 1
52 . 1 1 8 8 ILE HD12 H 1 0.8504 0.0000 . 1 . . . A 8 ILE HD12 . 30109 1
53 . 1 1 8 8 ILE HD13 H 1 0.8504 0.0000 . 1 . . . A 8 ILE HD13 . 30109 1
54 . 1 1 9 9 LYS H H 1 7.7744 0.0000 . 1 . . . A 9 LYS H . 30109 1
55 . 1 1 9 9 LYS HA H 1 3.9859 0.0000 . 1 . . . A 9 LYS HA . 30109 1
56 . 1 1 9 9 LYS HB2 H 1 2.0582 0.0000 . 2 . . . A 9 LYS HB2 . 30109 1
57 . 1 1 9 9 LYS HG2 H 1 1.6703 0.0000 . 2 . . . A 9 LYS HG2 . 30109 1
58 . 1 1 9 9 LYS HG3 H 1 1.4614 0.0000 . 2 . . . A 9 LYS HG3 . 30109 1
59 . 1 1 9 9 LYS HD2 H 1 1.7526 0.0000 . 2 . . . A 9 LYS HD2 . 30109 1
60 . 1 1 9 9 LYS HE2 H 1 3.0021 0.0000 . 2 . . . A 9 LYS HE2 . 30109 1
61 . 1 1 10 10 VAL H H 1 7.8562 0.0000 . 1 . . . A 10 VAL H . 30109 1
62 . 1 1 10 10 VAL HA H 1 3.6601 0.0000 . 1 . . . A 10 VAL HA . 30109 1
63 . 1 1 10 10 VAL HB H 1 2.4386 0.0000 . 1 . . . A 10 VAL HB . 30109 1
64 . 1 1 10 10 VAL HG11 H 1 1.1260 0.0000 . 2 . . . A 10 VAL HG11 . 30109 1
65 . 1 1 10 10 VAL HG12 H 1 1.1260 0.0000 . 2 . . . A 10 VAL HG12 . 30109 1
66 . 1 1 10 10 VAL HG13 H 1 1.1260 0.0000 . 2 . . . A 10 VAL HG13 . 30109 1
67 . 1 1 10 10 VAL HG21 H 1 0.9756 0.0000 . 2 . . . A 10 VAL HG21 . 30109 1
68 . 1 1 10 10 VAL HG22 H 1 0.9756 0.0000 . 2 . . . A 10 VAL HG22 . 30109 1
69 . 1 1 10 10 VAL HG23 H 1 0.9756 0.0000 . 2 . . . A 10 VAL HG23 . 30109 1
70 . 1 1 11 11 ILE H H 1 8.5968 0.0000 . 1 . . . A 11 ILE H . 30109 1
71 . 1 1 11 11 ILE HA H 1 3.7007 0.0000 . 1 . . . A 11 ILE HA . 30109 1
72 . 1 1 11 11 ILE HB H 1 2.0104 0.0000 . 1 . . . A 11 ILE HB . 30109 1
73 . 1 1 11 11 ILE HG12 H 1 1.8078 0.0000 . 2 . . . A 11 ILE HG12 . 30109 1
74 . 1 1 11 11 ILE HG13 H 1 1.2199 0.0000 . 2 . . . A 11 ILE HG13 . 30109 1
75 . 1 1 11 11 ILE HG21 H 1 0.9586 0.0000 . 1 . . . A 11 ILE HG21 . 30109 1
76 . 1 1 11 11 ILE HG22 H 1 0.9586 0.0000 . 1 . . . A 11 ILE HG22 . 30109 1
77 . 1 1 11 11 ILE HG23 H 1 0.9586 0.0000 . 1 . . . A 11 ILE HG23 . 30109 1
78 . 1 1 11 11 ILE HD11 H 1 0.8404 0.0000 . 1 . . . A 11 ILE HD11 . 30109 1
79 . 1 1 11 11 ILE HD12 H 1 0.8404 0.0000 . 1 . . . A 11 ILE HD12 . 30109 1
80 . 1 1 11 11 ILE HD13 H 1 0.8404 0.0000 . 1 . . . A 11 ILE HD13 . 30109 1
81 . 1 1 12 12 LYS H H 1 8.8652 0.0000 . 1 . . . A 12 LYS H . 30109 1
82 . 1 1 12 12 LYS HA H 1 3.9569 0.0000 . 1 . . . A 12 LYS HA . 30109 1
83 . 1 1 12 12 LYS HB2 H 1 1.9778 0.0000 . 2 . . . A 12 LYS HB2 . 30109 1
84 . 1 1 12 12 LYS HB3 H 1 1.8995 0.0000 . 2 . . . A 12 LYS HB3 . 30109 1
85 . 1 1 12 12 LYS HG2 H 1 1.4303 0.0000 . 2 . . . A 12 LYS HG2 . 30109 1
86 . 1 1 12 12 LYS HD2 H 1 1.7002 0.0000 . 2 . . . A 12 LYS HD2 . 30109 1
87 . 1 1 12 12 LYS HE2 H 1 2.9527 0.0000 . 2 . . . A 12 LYS HE2 . 30109 1
88 . 1 1 13 13 SER H H 1 7.9213 0.0000 . 1 . . . A 13 SER H . 30109 1
89 . 1 1 13 13 SER HA H 1 4.2846 0.0000 . 1 . . . A 13 SER HA . 30109 1
90 . 1 1 13 13 SER HB2 H 1 4.2353 0.0000 . 2 . . . A 13 SER HB2 . 30109 1
91 . 1 1 13 13 SER HB3 H 1 4.0062 0.0000 . 2 . . . A 13 SER HB3 . 30109 1
92 . 1 1 14 14 LEU H H 1 8.4170 0.0000 . 1 . . . A 14 LEU H . 30109 1
93 . 1 1 14 14 LEU HA H 1 4.1137 0.0000 . 1 . . . A 14 LEU HA . 30109 1
94 . 1 1 14 14 LEU HB2 H 1 2.0833 0.0000 . 2 . . . A 14 LEU HB2 . 30109 1
95 . 1 1 14 14 LEU HB3 H 1 1.5502 0.0000 . 2 . . . A 14 LEU HB3 . 30109 1
96 . 1 1 14 14 LEU HG H 1 1.8731 0.0000 . 1 . . . A 14 LEU HG . 30109 1
97 . 1 1 14 14 LEU HD11 H 1 0.8844 0.0000 . 2 . . . A 14 LEU HD11 . 30109 1
98 . 1 1 14 14 LEU HD12 H 1 0.8844 0.0000 . 2 . . . A 14 LEU HD12 . 30109 1
99 . 1 1 14 14 LEU HD13 H 1 0.8844 0.0000 . 2 . . . A 14 LEU HD13 . 30109 1
100 . 1 1 15 15 ILE H H 1 8.6136 0.0000 . 1 . . . A 15 ILE H . 30109 1
101 . 1 1 15 15 ILE HA H 1 3.7726 0.0000 . 1 . . . A 15 ILE HA . 30109 1
102 . 1 1 15 15 ILE HB H 1 2.0079 0.0000 . 1 . . . A 15 ILE HB . 30109 1
103 . 1 1 15 15 ILE HG12 H 1 1.8842 0.0000 . 2 . . . A 15 ILE HG12 . 30109 1
104 . 1 1 15 15 ILE HG13 H 1 1.2067 0.0000 . 2 . . . A 15 ILE HG13 . 30109 1
105 . 1 1 15 15 ILE HG21 H 1 0.9639 0.0000 . 1 . . . A 15 ILE HG21 . 30109 1
106 . 1 1 15 15 ILE HG22 H 1 0.9639 0.0000 . 1 . . . A 15 ILE HG22 . 30109 1
107 . 1 1 15 15 ILE HG23 H 1 0.9639 0.0000 . 1 . . . A 15 ILE HG23 . 30109 1
108 . 1 1 15 15 ILE HD11 H 1 0.8624 0.0000 . 1 . . . A 15 ILE HD11 . 30109 1
109 . 1 1 15 15 ILE HD12 H 1 0.8624 0.0000 . 1 . . . A 15 ILE HD12 . 30109 1
110 . 1 1 15 15 ILE HD13 H 1 0.8624 0.0000 . 1 . . . A 15 ILE HD13 . 30109 1
111 . 1 1 16 16 GLU H H 1 8.3517 0.0000 . 1 . . . A 16 GLU H . 30109 1
112 . 1 1 16 16 GLU HA H 1 4.0846 0.0000 . 1 . . . A 16 GLU HA . 30109 1
113 . 1 1 16 16 GLU HB2 H 1 2.3104 0.0000 . 2 . . . A 16 GLU HB2 . 30109 1
114 . 1 1 16 16 GLU HB3 H 1 2.2117 0.0000 . 2 . . . A 16 GLU HB3 . 30109 1
115 . 1 1 16 16 GLU HG2 H 1 2.6521 0.0000 . 2 . . . A 16 GLU HG2 . 30109 1
116 . 1 1 16 16 GLU HG3 H 1 2.5043 0.0000 . 2 . . . A 16 GLU HG3 . 30109 1
117 . 1 1 17 17 GLN H H 1 8.0511 0.0000 . 1 . . . A 17 GLN H . 30109 1
118 . 1 1 17 17 GLN HA H 1 4.1000 0.0000 . 1 . . . A 17 GLN HA . 30109 1
119 . 1 1 17 17 GLN HB2 H 1 2.3022 0.0000 . 2 . . . A 17 GLN HB2 . 30109 1
120 . 1 1 17 17 GLN HB3 H 1 2.1830 0.0000 . 2 . . . A 17 GLN HB3 . 30109 1
121 . 1 1 17 17 GLN HG2 H 1 2.0893 0.0000 . 2 . . . A 17 GLN HG2 . 30109 1
122 . 1 1 18 18 PHE H H 1 8.4203 0.0000 . 1 . . . A 18 PHE H . 30109 1
123 . 1 1 18 18 PHE HA H 1 4.6530 0.0000 . 1 . . . A 18 PHE HA . 30109 1
124 . 1 1 18 18 PHE HB2 H 1 3.3097 0.0000 . 2 . . . A 18 PHE HB2 . 30109 1
125 . 1 1 18 18 PHE HB3 H 1 3.1871 0.0000 . 2 . . . A 18 PHE HB3 . 30109 1
126 . 1 1 18 18 PHE HD1 H 1 7.3320 0.0000 . 3 . . . A 18 PHE HD1 . 30109 1
127 . 1 1 18 18 PHE HD2 H 1 7.3320 0.0000 . 3 . . . A 18 PHE HD2 . 30109 1
128 . 1 1 19 19 THR H H 1 8.1033 0.0000 . 1 . . . A 19 THR H . 30109 1
129 . 1 1 19 19 THR HA H 1 4.4816 0.0000 . 1 . . . A 19 THR HA . 30109 1
130 . 1 1 19 19 THR HB H 1 4.3790 0.0000 . 1 . . . A 19 THR HB . 30109 1
131 . 1 1 19 19 THR HG21 H 1 1.3809 0.0000 . 1 . . . A 19 THR HG21 . 30109 1
132 . 1 1 19 19 THR HG22 H 1 1.3809 0.0000 . 1 . . . A 19 THR HG22 . 30109 1
133 . 1 1 19 19 THR HG23 H 1 1.3809 0.0000 . 1 . . . A 19 THR HG23 . 30109 1
134 . 1 1 20 20 GLY H H 1 8.0886 0.0000 . 1 . . . A 20 GLY H . 30109 1
135 . 1 1 20 20 GLY HA2 H 1 4.0992 0.0000 . 2 . . . A 20 GLY HA2 . 30109 1
136 . 1 1 20 20 GLY HA3 H 1 4.0155 0.0000 . 2 . . . A 20 GLY HA3 . 30109 1
137 . 1 1 21 21 LYS H H 1 7.9560 0.0000 . 1 . . . A 21 LYS H . 30109 1
138 . 1 1 21 21 LYS HA H 1 4.5195 0.0000 . 1 . . . A 21 LYS HA . 30109 1
139 . 1 1 21 21 LYS HB2 H 1 1.8097 0.0000 . 2 . . . A 21 LYS HB2 . 30109 1
140 . 1 1 21 21 LYS HG2 H 1 1.9690 0.0000 . 2 . . . A 21 LYS HG2 . 30109 1
141 . 1 1 21 21 LYS HG3 H 1 1.4701 0.0000 . 2 . . . A 21 LYS HG3 . 30109 1
142 . 1 1 21 21 LYS HD2 H 1 1.7092 0.0000 . 2 . . . A 21 LYS HD2 . 30109 1
143 . 1 1 21 21 LYS HE2 H 1 3.0379 0.0000 . 2 . . . A 21 LYS HE2 . 30109 1
stop_
save_