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 34858
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name .
_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 NOESY' . . . 34858 1
2 '2D 1H-1H TOCSY' . . . 34858 1
3 '2D 1H-1H COSY' . . . 34858 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_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 DC H1' H 1 5.799 0.005 . . . . . . A 1 DC H1' . 34858 1
2 . 1 . 1 1 1 DC H2' H 1 1.652 0.002 . . . . . . A 1 DC H2' . 34858 1
3 . 1 . 1 1 1 DC H2'' H 1 2.398 0.002 . . . . . . A 1 DC H2'' . 34858 1
4 . 1 . 1 1 1 DC H3' H 1 4.578 0.001 . . . . . . A 1 DC H3' . 34858 1
5 . 1 . 1 1 1 DC H4' H 1 3.735 0.001 . . . . . . A 1 DC H4' . 34858 1
6 . 1 . 1 1 1 DC H5 H 1 5.807 0.000 . . . . . . A 1 DC H5 . 34858 1
7 . 1 . 1 1 1 DC H5' H 1 2.564 0.001 . . . . . . A 1 DC H5' . 34858 1
8 . 1 . 1 1 1 DC H5'' H 1 3.128 0.003 . . . . . . A 1 DC H5'' . 34858 1
9 . 1 . 1 1 1 DC H6 H 1 7.474 0.002 . . . . . . A 1 DC H6 . 34858 1
10 . 1 . 1 1 1 DC H41 H 1 7.040 0.002 . . . . . . A 1 DC H41 . 34858 1
11 . 1 . 1 1 1 DC H42 H 1 8.302 0.002 . . . . . . A 1 DC H42 . 34858 1
12 . 1 . 1 2 2 GF2 H1' H 1 6.216 0.001 . . . . . . A 2 GF2 H1' . 34858 1
13 . 1 . 1 2 2 GF2 H2' H 1 5.287 0.000 . . . . . . A 2 GF2 H2' . 34858 1
14 . 1 . 1 2 2 GF2 H3' H 1 5.257 0.006 . . . . . . A 2 GF2 H3' . 34858 1
15 . 1 . 1 2 2 GF2 H4' H 1 4.329 0.001 . . . . . . A 2 GF2 H4' . 34858 1
16 . 1 . 1 2 2 GF2 H5' H 1 4.110 0.000 . . . . . . A 2 GF2 H5' . 34858 1
17 . 1 . 1 2 2 GF2 H5'A H 1 4.172 0.002 . . . . . . A 2 GF2 H5'A . 34858 1
18 . 1 . 1 2 2 GF2 H8 H 1 7.849 0.001 . . . . . . A 2 GF2 H8 . 34858 1
19 . 1 . 1 2 2 GF2 F F 19 -116.621 0.002 . . . . . . A 2 GF2 F . 34858 1
20 . 1 . 1 2 2 GF2 HN1 H 1 13.264 0.002 . . . . . . A 2 GF2 HN1 . 34858 1
21 . 1 . 1 2 2 GF2 HN2 H 1 6.838 0.002 . . . . . . A 2 GF2 HN2 . 34858 1
22 . 1 . 1 2 2 GF2 HN2A H 1 8.415 0.003 . . . . . . A 2 GF2 HN2A . 34858 1
23 . 1 . 1 3 3 DC H1' H 1 5.732 0.003 . . . . . . A 3 DC H1' . 34858 1
24 . 1 . 1 3 3 DC H2' H 1 1.726 0.003 . . . . . . A 3 DC H2' . 34858 1
25 . 1 . 1 3 3 DC H2'' H 1 2.612 0.003 . . . . . . A 3 DC H2'' . 34858 1
26 . 1 . 1 3 3 DC H3' H 1 4.854 0.002 . . . . . . A 3 DC H3' . 34858 1
27 . 1 . 1 3 3 DC H4' H 1 3.877 0.003 . . . . . . A 3 DC H4' . 34858 1
28 . 1 . 1 3 3 DC H5 H 1 5.052 0.001 . . . . . . A 3 DC H5 . 34858 1
29 . 1 . 1 3 3 DC H5' H 1 2.629 0.000 . . . . . . A 3 DC H5' . 34858 1
30 . 1 . 1 3 3 DC H5'' H 1 3.888 0.003 . . . . . . A 3 DC H5'' . 34858 1
31 . 1 . 1 3 3 DC H6 H 1 7.410 0.003 . . . . . . A 3 DC H6 . 34858 1
32 . 1 . 1 3 3 DC H41 H 1 6.607 0.002 . . . . . . A 3 DC H41 . 34858 1
33 . 1 . 1 3 3 DC H42 H 1 8.396 0.005 . . . . . . A 3 DC H42 . 34858 1
34 . 1 . 1 4 4 GF2 H1' H 1 6.246 0.005 . . . . . . A 4 GF2 H1' . 34858 1
35 . 1 . 1 4 4 GF2 H2' H 1 5.309 0.000 . . . . . . A 4 GF2 H2' . 34858 1
36 . 1 . 1 4 4 GF2 H3' H 1 5.235 0.005 . . . . . . A 4 GF2 H3' . 34858 1
37 . 1 . 1 4 4 GF2 H4' H 1 4.327 0.000 . . . . . . A 4 GF2 H4' . 34858 1
38 . 1 . 1 4 4 GF2 H5' H 1 4.156 0.002 . . . . . . A 4 GF2 H5' . 34858 1
39 . 1 . 1 4 4 GF2 H5'A H 1 4.221 0.002 . . . . . . A 4 GF2 H5'A . 34858 1
40 . 1 . 1 4 4 GF2 H8 H 1 7.913 0.001 . . . . . . A 4 GF2 H8 . 34858 1
41 . 1 . 1 4 4 GF2 F F 19 -116.776 0.000 . . . . . . A 4 GF2 F . 34858 1
42 . 1 . 1 4 4 GF2 HN1 H 1 13.264 0.002 . . . . . . A 4 GF2 HN1 . 34858 1
43 . 1 . 1 4 4 GF2 HN2 H 1 6.761 0.003 . . . . . . A 4 GF2 HN2 . 34858 1
44 . 1 . 1 4 4 GF2 HN2A H 1 8.450 0.002 . . . . . . A 4 GF2 HN2A . 34858 1
45 . 1 . 1 5 5 DC H1' H 1 5.882 0.003 . . . . . . A 5 DC H1' . 34858 1
46 . 1 . 1 5 5 DC H2' H 1 1.770 0.006 . . . . . . A 5 DC H2' . 34858 1
47 . 1 . 1 5 5 DC H2'' H 1 2.651 0.005 . . . . . . A 5 DC H2'' . 34858 1
48 . 1 . 1 5 5 DC H3' H 1 4.862 0.003 . . . . . . A 5 DC H3' . 34858 1
49 . 1 . 1 5 5 DC H4' H 1 4.006 0.001 . . . . . . A 5 DC H4' . 34858 1
50 . 1 . 1 5 5 DC H5 H 1 5.173 0.001 . . . . . . A 5 DC H5 . 34858 1
51 . 1 . 1 5 5 DC H5' H 1 2.746 0.002 . . . . . . A 5 DC H5' . 34858 1
52 . 1 . 1 5 5 DC H5'' H 1 3.907 0.003 . . . . . . A 5 DC H5'' . 34858 1
53 . 1 . 1 5 5 DC H6 H 1 7.485 0.002 . . . . . . A 5 DC H6 . 34858 1
54 . 1 . 1 5 5 DC H41 H 1 6.685 0.004 . . . . . . A 5 DC H41 . 34858 1
55 . 1 . 1 5 5 DC H42 H 1 8.548 0.002 . . . . . . A 5 DC H42 . 34858 1
56 . 1 . 1 6 6 GF2 H1' H 1 6.193 0.001 . . . . . . A 6 GF2 H1' . 34858 1
57 . 1 . 1 6 6 GF2 H2' H 1 5.539 0.000 . . . . . . A 6 GF2 H2' . 34858 1
58 . 1 . 1 6 6 GF2 H3' H 1 5.210 0.001 . . . . . . A 6 GF2 H3' . 34858 1
59 . 1 . 1 6 6 GF2 H4' H 1 4.269 0.001 . . . . . . A 6 GF2 H4' . 34858 1
60 . 1 . 1 6 6 GF2 H5' H 1 4.204 0.001 . . . . . . A 6 GF2 H5' . 34858 1
61 . 1 . 1 6 6 GF2 H5'A H 1 4.253 0.000 . . . . . . A 6 GF2 H5'A . 34858 1
62 . 1 . 1 6 6 GF2 H8 H 1 7.876 0.001 . . . . . . A 6 GF2 H8 . 34858 1
63 . 1 . 1 6 6 GF2 F F 19 -121.944 0.001 . . . . . . A 6 GF2 F . 34858 1
64 . 1 . 1 6 6 GF2 HN1 H 1 13.398 0.001 . . . . . . A 6 GF2 HN1 . 34858 1
65 . 2 . 1 1 1 DC H1' H 1 5.799 0.005 . . . . . . B 7 DC H1' . 34858 1
66 . 2 . 1 1 1 DC H2' H 1 1.652 0.002 . . . . . . B 7 DC H2' . 34858 1
67 . 2 . 1 1 1 DC H2'' H 1 2.398 0.002 . . . . . . B 7 DC H2'' . 34858 1
68 . 2 . 1 1 1 DC H3' H 1 4.578 0.001 . . . . . . B 7 DC H3' . 34858 1
69 . 2 . 1 1 1 DC H4' H 1 3.735 0.001 . . . . . . B 7 DC H4' . 34858 1
70 . 2 . 1 1 1 DC H5 H 1 5.807 0.000 . . . . . . B 7 DC H5 . 34858 1
71 . 2 . 1 1 1 DC H5' H 1 2.564 0.001 . . . . . . B 7 DC H5' . 34858 1
72 . 2 . 1 1 1 DC H5'' H 1 3.128 0.003 . . . . . . B 7 DC H5'' . 34858 1
73 . 2 . 1 1 1 DC H6 H 1 7.474 0.002 . . . . . . B 7 DC H6 . 34858 1
74 . 2 . 1 1 1 DC H41 H 1 7.040 0.002 . . . . . . B 7 DC H41 . 34858 1
75 . 2 . 1 1 1 DC H42 H 1 8.302 0.002 . . . . . . B 7 DC H42 . 34858 1
76 . 2 . 1 2 2 GF2 H1' H 1 6.216 0.001 . . . . . . B 8 GF2 H1' . 34858 1
77 . 2 . 1 2 2 GF2 H2' H 1 5.287 0.000 . . . . . . B 8 GF2 H2' . 34858 1
78 . 2 . 1 2 2 GF2 H3' H 1 5.257 0.006 . . . . . . B 8 GF2 H3' . 34858 1
79 . 2 . 1 2 2 GF2 H4' H 1 4.329 0.001 . . . . . . B 8 GF2 H4' . 34858 1
80 . 2 . 1 2 2 GF2 H5' H 1 4.110 0.000 . . . . . . B 8 GF2 H5' . 34858 1
81 . 2 . 1 2 2 GF2 H5'A H 1 4.172 0.002 . . . . . . B 8 GF2 H5'A . 34858 1
82 . 2 . 1 2 2 GF2 H8 H 1 7.849 0.001 . . . . . . B 8 GF2 H8 . 34858 1
83 . 2 . 1 2 2 GF2 F F 19 -116.621 0.002 . . . . . . B 8 GF2 F . 34858 1
84 . 2 . 1 2 2 GF2 HN1 H 1 13.264 0.002 . . . . . . B 8 GF2 HN1 . 34858 1
85 . 2 . 1 2 2 GF2 HN2 H 1 6.838 0.002 . . . . . . B 8 GF2 HN2 . 34858 1
86 . 2 . 1 2 2 GF2 HN2A H 1 8.415 0.003 . . . . . . B 8 GF2 HN2A . 34858 1
87 . 2 . 1 3 3 DC H1' H 1 5.732 0.003 . . . . . . B 9 DC H1' . 34858 1
88 . 2 . 1 3 3 DC H2' H 1 1.726 0.003 . . . . . . B 9 DC H2' . 34858 1
89 . 2 . 1 3 3 DC H2'' H 1 2.612 0.003 . . . . . . B 9 DC H2'' . 34858 1
90 . 2 . 1 3 3 DC H3' H 1 4.854 0.002 . . . . . . B 9 DC H3' . 34858 1
91 . 2 . 1 3 3 DC H4' H 1 3.877 0.003 . . . . . . B 9 DC H4' . 34858 1
92 . 2 . 1 3 3 DC H5 H 1 5.052 0.001 . . . . . . B 9 DC H5 . 34858 1
93 . 2 . 1 3 3 DC H5' H 1 2.629 0.000 . . . . . . B 9 DC H5' . 34858 1
94 . 2 . 1 3 3 DC H5'' H 1 3.888 0.003 . . . . . . B 9 DC H5'' . 34858 1
95 . 2 . 1 3 3 DC H6 H 1 7.410 0.003 . . . . . . B 9 DC H6 . 34858 1
96 . 2 . 1 3 3 DC H41 H 1 6.607 0.002 . . . . . . B 9 DC H41 . 34858 1
97 . 2 . 1 3 3 DC H42 H 1 8.396 0.005 . . . . . . B 9 DC H42 . 34858 1
98 . 2 . 1 4 4 GF2 H1' H 1 6.246 0.005 . . . . . . B 10 GF2 H1' . 34858 1
99 . 2 . 1 4 4 GF2 H2' H 1 5.309 0.000 . . . . . . B 10 GF2 H2' . 34858 1
100 . 2 . 1 4 4 GF2 H3' H 1 5.235 0.005 . . . . . . B 10 GF2 H3' . 34858 1
101 . 2 . 1 4 4 GF2 H4' H 1 4.327 0.000 . . . . . . B 10 GF2 H4' . 34858 1
102 . 2 . 1 4 4 GF2 H5' H 1 4.156 0.002 . . . . . . B 10 GF2 H5' . 34858 1
103 . 2 . 1 4 4 GF2 H5'A H 1 4.221 0.002 . . . . . . B 10 GF2 H5'A . 34858 1
104 . 2 . 1 4 4 GF2 H8 H 1 7.913 0.001 . . . . . . B 10 GF2 H8 . 34858 1
105 . 2 . 1 4 4 GF2 F F 19 -116.776 0.000 . . . . . . B 10 GF2 F . 34858 1
106 . 2 . 1 4 4 GF2 HN1 H 1 13.264 0.002 . . . . . . B 10 GF2 HN1 . 34858 1
107 . 2 . 1 4 4 GF2 HN2 H 1 6.761 0.003 . . . . . . B 10 GF2 HN2 . 34858 1
108 . 2 . 1 4 4 GF2 HN2A H 1 8.450 0.002 . . . . . . B 10 GF2 HN2A . 34858 1
109 . 2 . 1 5 5 DC H1' H 1 5.882 0.003 . . . . . . B 11 DC H1' . 34858 1
110 . 2 . 1 5 5 DC H2' H 1 1.770 0.006 . . . . . . B 11 DC H2' . 34858 1
111 . 2 . 1 5 5 DC H2'' H 1 2.651 0.005 . . . . . . B 11 DC H2'' . 34858 1
112 . 2 . 1 5 5 DC H3' H 1 4.862 0.003 . . . . . . B 11 DC H3' . 34858 1
113 . 2 . 1 5 5 DC H4' H 1 4.006 0.001 . . . . . . B 11 DC H4' . 34858 1
114 . 2 . 1 5 5 DC H5 H 1 5.173 0.001 . . . . . . B 11 DC H5 . 34858 1
115 . 2 . 1 5 5 DC H5' H 1 2.746 0.002 . . . . . . B 11 DC H5' . 34858 1
116 . 2 . 1 5 5 DC H5'' H 1 3.907 0.003 . . . . . . B 11 DC H5'' . 34858 1
117 . 2 . 1 5 5 DC H6 H 1 7.485 0.002 . . . . . . B 11 DC H6 . 34858 1
118 . 2 . 1 5 5 DC H41 H 1 6.685 0.004 . . . . . . B 11 DC H41 . 34858 1
119 . 2 . 1 5 5 DC H42 H 1 8.548 0.002 . . . . . . B 11 DC H42 . 34858 1
120 . 2 . 1 6 6 GF2 H1' H 1 6.193 0.001 . . . . . . B 12 GF2 H1' . 34858 1
121 . 2 . 1 6 6 GF2 H2' H 1 5.539 0.000 . . . . . . B 12 GF2 H2' . 34858 1
122 . 2 . 1 6 6 GF2 H3' H 1 5.210 0.001 . . . . . . B 12 GF2 H3' . 34858 1
123 . 2 . 1 6 6 GF2 H4' H 1 4.269 0.001 . . . . . . B 12 GF2 H4' . 34858 1
124 . 2 . 1 6 6 GF2 H5' H 1 4.204 0.001 . . . . . . B 12 GF2 H5' . 34858 1
125 . 2 . 1 6 6 GF2 H5'A H 1 4.253 0.000 . . . . . . B 12 GF2 H5'A . 34858 1
126 . 2 . 1 6 6 GF2 H8 H 1 7.876 0.001 . . . . . . B 12 GF2 H8 . 34858 1
127 . 2 . 1 6 6 GF2 F F 19 -121.944 0.001 . . . . . . B 12 GF2 F . 34858 1
128 . 2 . 1 6 6 GF2 HN1 H 1 13.398 0.001 . . . . . . B 12 GF2 HN1 . 34858 1
stop_
save_