Content for NMR-STAR saveframe, "assigned_chem_shift_list_3"
save_assigned_chem_shift_list_3
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_3
_Assigned_chem_shift_list.Entry_ID 15565
_Assigned_chem_shift_list.ID 3
_Assigned_chem_shift_list.Sample_condition_list_ID 3
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_3
_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 0.01
_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
7 '2D 1H-1H TOCSY' . . . 15565 3
8 '2D DQF-COSY' . . . 15565 3
9 '2D 1H-1H NOESY' . . . 15565 3
12 '2D 1H-1H ROESY' . . . 15565 3
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 VAL H H 1 8.061 0.01 . 1 . . . . 79 VAL H . 15565 3
2 . 1 1 2 2 VAL HA H 1 4.075 0.01 . 1 . . . . 79 VAL HA . 15565 3
3 . 1 1 2 2 VAL HB H 1 2.059 0.01 . 1 . . . . 79 VAL HB . 15565 3
4 . 1 1 2 2 VAL HG11 H 1 0.917 0.01 . 2 . . . . 79 VAL HG1 . 15565 3
5 . 1 1 2 2 VAL HG12 H 1 0.917 0.01 . 2 . . . . 79 VAL HG1 . 15565 3
6 . 1 1 2 2 VAL HG13 H 1 0.917 0.01 . 2 . . . . 79 VAL HG1 . 15565 3
7 . 1 1 2 2 VAL HG21 H 1 0.917 0.01 . 2 . . . . 79 VAL HG2 . 15565 3
8 . 1 1 2 2 VAL HG22 H 1 0.917 0.01 . 2 . . . . 79 VAL HG2 . 15565 3
9 . 1 1 2 2 VAL HG23 H 1 0.917 0.01 . 2 . . . . 79 VAL HG2 . 15565 3
10 . 1 1 3 3 GLU H H 1 8.543 0.01 . 1 . . . . 80 GLU H . 15565 3
11 . 1 1 3 3 GLU HA H 1 4.260 0.01 . 1 . . . . 80 GLU HA . 15565 3
12 . 1 1 3 3 GLU HB2 H 1 2.039 0.01 . 2 . . . . 80 GLU HB2 . 15565 3
13 . 1 1 3 3 GLU HB3 H 1 1.919 0.01 . 2 . . . . 80 GLU HB3 . 15565 3
14 . 1 1 3 3 GLU HG2 H 1 2.241 0.01 . 2 . . . . 80 GLU HG2 . 15565 3
15 . 1 1 4 4 ASP H H 1 8.221 0.01 . 1 . . . . 81 ASP H . 15565 3
16 . 1 1 4 4 ASP HA H 1 4.652 0.01 . 1 . . . . 81 ASP HA . 15565 3
17 . 1 1 4 4 ASP HB2 H 1 2.786 0.01 . 2 . . . . 81 ASP HB2 . 15565 3
18 . 1 1 4 4 ASP HB3 H 1 2.655 0.01 . 2 . . . . 81 ASP HB3 . 15565 3
19 . 1 1 5 5 LEU H H 1 8.332 0.01 . 1 . . . . 82 LEU H . 15565 3
20 . 1 1 5 5 LEU HA H 1 4.337 0.01 . 1 . . . . 82 LEU HA . 15565 3
21 . 1 1 5 5 LEU HB2 H 1 1.674 0.01 . 2 . . . . 82 LEU HB2 . 15565 3
22 . 1 1 5 5 LEU HB3 H 1 1.674 0.01 . 2 . . . . 82 LEU HB3 . 15565 3
23 . 1 1 5 5 LEU HD11 H 1 0.922 0.01 . 2 . . . . 82 LEU HD1 . 15565 3
24 . 1 1 5 5 LEU HD12 H 1 0.922 0.01 . 2 . . . . 82 LEU HD1 . 15565 3
25 . 1 1 5 5 LEU HD13 H 1 0.922 0.01 . 2 . . . . 82 LEU HD1 . 15565 3
26 . 1 1 5 5 LEU HD21 H 1 0.847 0.01 . 2 . . . . 82 LEU HD2 . 15565 3
27 . 1 1 5 5 LEU HD22 H 1 0.847 0.01 . 2 . . . . 82 LEU HD2 . 15565 3
28 . 1 1 5 5 LEU HD23 H 1 0.847 0.01 . 2 . . . . 82 LEU HD2 . 15565 3
29 . 1 1 5 5 LEU HG H 1 1.623 0.01 . 1 . . . . 82 LEU HG . 15565 3
30 . 1 1 6 6 SER H H 1 8.452 0.01 . 1 . . . . 83 SER H . 15565 3
31 . 1 1 6 6 SER HA H 1 4.342 0.01 . 1 . . . . 83 SER HA . 15565 3
32 . 1 1 6 6 SER HB2 H 1 3.965 0.01 . 2 . . . . 83 SER HB2 . 15565 3
33 . 1 1 7 7 SER H H 1 8.189 0.01 . 1 . . . . 84 SER H . 15565 3
34 . 1 1 7 7 SER HA H 1 4.483 0.01 . 1 . . . . 84 SER HA . 15565 3
35 . 1 1 7 7 SER HB2 H 1 4.013 0.01 . 2 . . . . 84 SER HB2 . 15565 3
36 . 1 1 7 7 SER HB3 H 1 3.954 0.01 . 2 . . . . 84 SER HB3 . 15565 3
37 . 1 1 8 8 LEU H H 1 8.120 0.01 . 1 . . . . 85 LEU H . 15565 3
38 . 1 1 8 8 LEU HA H 1 4.293 0.01 . 1 . . . . 85 LEU HA . 15565 3
39 . 1 1 8 8 LEU HB2 H 1 1.841 0.01 . 2 . . . . 85 LEU HB2 . 15565 3
40 . 1 1 8 8 LEU HD11 H 1 0.987 0.01 . 2 . . . . 85 LEU HD1 . 15565 3
41 . 1 1 8 8 LEU HD12 H 1 0.987 0.01 . 2 . . . . 85 LEU HD1 . 15565 3
42 . 1 1 8 8 LEU HD13 H 1 0.987 0.01 . 2 . . . . 85 LEU HD1 . 15565 3
43 . 1 1 8 8 LEU HD21 H 1 0.912 0.01 . 2 . . . . 85 LEU HD2 . 15565 3
44 . 1 1 8 8 LEU HD22 H 1 0.912 0.01 . 2 . . . . 85 LEU HD2 . 15565 3
45 . 1 1 8 8 LEU HD23 H 1 0.912 0.01 . 2 . . . . 85 LEU HD2 . 15565 3
46 . 1 1 8 8 LEU HG H 1 1.679 0.01 . 1 . . . . 85 LEU HG . 15565 3
47 . 1 1 9 9 GLU H H 1 8.468 0.01 . 1 . . . . 86 GLU H . 15565 3
48 . 1 1 9 9 GLU HA H 1 3.951 0.01 . 1 . . . . 86 GLU HA . 15565 3
49 . 1 1 9 9 GLU HB2 H 1 2.136 0.01 . 2 . . . . 86 GLU HB2 . 15565 3
50 . 1 1 9 9 GLU HB3 H 1 2.066 0.01 . 2 . . . . 86 GLU HB3 . 15565 3
51 . 1 1 9 9 GLU HG2 H 1 2.313 0.01 . 2 . . . . 86 GLU HG2 . 15565 3
52 . 1 1 9 9 GLU HG3 H 1 2.372 0.01 . 2 . . . . 86 GLU HG3 . 15565 3
53 . 1 1 10 10 GLU H H 1 8.157 0.01 . 1 . . . . 87 GLU H . 15565 3
54 . 1 1 10 10 GLU HA H 1 4.105 0.01 . 1 . . . . 87 GLU HA . 15565 3
55 . 1 1 10 10 GLU HB3 H 1 2.125 0.01 . 2 . . . . 87 GLU HB3 . 15565 3
56 . 1 1 10 10 GLU HG2 H 1 2.302 0.01 . 2 . . . . 87 GLU HG2 . 15565 3
57 . 1 1 10 10 GLU HG3 H 1 2.354 0.01 . 2 . . . . 87 GLU HG3 . 15565 3
58 . 1 1 11 11 TYR H H 1 8.125 0.01 . 1 . . . . 88 TYR H . 15565 3
59 . 1 1 11 11 TYR HA H 1 4.306 0.01 . 1 . . . . 88 TYR HA . 15565 3
60 . 1 1 11 11 TYR HB2 H 1 3.213 0.01 . 2 . . . . 88 TYR HB2 . 15565 3
61 . 1 1 11 11 TYR HD1 H 1 7.031 0.01 . 3 . . . . 88 TYR HD . 15565 3
62 . 1 1 11 11 TYR HD2 H 1 7.031 0.01 . 3 . . . . 88 TYR HD . 15565 3
63 . 1 1 11 11 TYR HE1 H 1 6.760 0.01 . 3 . . . . 88 TYR HE . 15565 3
64 . 1 1 11 11 TYR HE2 H 1 6.760 0.01 . 3 . . . . 88 TYR HE . 15565 3
65 . 1 1 12 12 LEU H H 1 8.714 0.01 . 1 . . . . 89 LEU H . 15565 3
66 . 1 1 12 12 LEU HA H 1 3.839 0.01 . 1 . . . . 89 LEU HA . 15565 3
67 . 1 1 12 12 LEU HB2 H 1 1.871 0.01 . 2 . . . . 89 LEU HB2 . 15565 3
68 . 1 1 12 12 LEU HD11 H 1 0.888 0.01 . 2 . . . . 89 LEU HD1 . 15565 3
69 . 1 1 12 12 LEU HD12 H 1 0.888 0.01 . 2 . . . . 89 LEU HD1 . 15565 3
70 . 1 1 12 12 LEU HD13 H 1 0.888 0.01 . 2 . . . . 89 LEU HD1 . 15565 3
71 . 1 1 12 12 LEU HG H 1 1.414 0.01 . 1 . . . . 89 LEU HG . 15565 3
72 . 1 1 13 13 ALA H H 1 8.130 0.01 . 1 . . . . 90 ALA H . 15565 3
73 . 1 1 13 13 ALA HA H 1 4.152 0.01 . 1 . . . . 90 ALA HA . 15565 3
74 . 1 1 13 13 ALA HB1 H 1 1.493 0.01 . 1 . . . . 90 ALA HB . 15565 3
75 . 1 1 13 13 ALA HB2 H 1 1.493 0.01 . 1 . . . . 90 ALA HB . 15565 3
76 . 1 1 13 13 ALA HB3 H 1 1.493 0.01 . 1 . . . . 90 ALA HB . 15565 3
77 . 1 1 14 14 SER H H 1 7.949 0.01 . 1 . . . . 91 SER H . 15565 3
78 . 1 1 14 14 SER HA H 1 4.236 0.01 . 1 . . . . 91 SER HA . 15565 3
79 . 1 1 14 14 SER HB2 H 1 3.992 0.01 . 2 . . . . 91 SER HB2 . 15565 3
80 . 1 1 14 14 SER HB3 H 1 3.992 0.01 . 2 . . . . 91 SER HB3 . 15565 3
81 . 1 1 15 15 LEU H H 1 7.574 0.01 . 1 . . . . 92 LEU H . 15565 3
82 . 1 1 15 15 LEU HA H 1 4.100 0.01 . 1 . . . . 92 LEU HA . 15565 3
83 . 1 1 15 15 LEU HB3 H 1 1.653 0.01 . 2 . . . . 92 LEU HB3 . 15565 3
84 . 1 1 15 15 LEU HD21 H 1 0.708 0.01 . 2 . . . . 92 LEU HD2 . 15565 3
85 . 1 1 15 15 LEU HD22 H 1 0.708 0.01 . 2 . . . . 92 LEU HD2 . 15565 3
86 . 1 1 15 15 LEU HD23 H 1 0.708 0.01 . 2 . . . . 92 LEU HD2 . 15565 3
87 . 1 1 15 15 LEU HG H 1 1.463 0.01 . 1 . . . . 92 LEU HG . 15565 3
88 . 1 1 16 16 GLY H H 1 8.002 0.01 . 1 . . . . 93 GLY H . 15565 3
89 . 1 1 16 16 GLY HA3 H 1 3.911 0.01 . 2 . . . . 93 GLY HA3 . 15565 3
90 . 1 1 17 17 ARG H H 1 7.788 0.01 . 1 . . . . 94 ARG H . 15565 3
91 . 1 1 17 17 ARG HA H 1 4.255 0.01 . 1 . . . . 94 ARG HA . 15565 3
92 . 1 1 17 17 ARG HB2 H 1 1.878 0.01 . 2 . . . . 94 ARG HB2 . 15565 3
93 . 1 1 17 17 ARG HB3 H 1 1.795 0.01 . 2 . . . . 94 ARG HB3 . 15565 3
94 . 1 1 17 17 ARG HD2 H 1 3.192 0.01 . 2 . . . . 94 ARG HD2 . 15565 3
95 . 1 1 17 17 ARG HD3 H 1 3.192 0.01 . 2 . . . . 94 ARG HD3 . 15565 3
96 . 1 1 17 17 ARG HG2 H 1 1.608 0.01 . 2 . . . . 94 ARG HG2 . 15565 3
97 . 1 1 17 17 ARG HG3 H 1 1.688 0.01 . 2 . . . . 94 ARG HG3 . 15565 3
98 . 1 1 18 18 LYS H H 1 8.050 0.01 . 1 . . . . 95 LYS H . 15565 3
99 . 1 1 18 18 LYS HA H 1 4.223 0.01 . 1 . . . . 95 LYS HA . 15565 3
100 . 1 1 18 18 LYS HB2 H 1 1.763 0.01 . 2 . . . . 95 LYS HB2 . 15565 3
101 . 1 1 18 18 LYS HB3 H 1 1.650 0.01 . 2 . . . . 95 LYS HB3 . 15565 3
102 . 1 1 18 18 LYS HD2 H 1 1.472 0.01 . 2 . . . . 95 LYS HD2 . 15565 3
103 . 1 1 18 18 LYS HD3 H 1 1.472 0.01 . 2 . . . . 95 LYS HD3 . 15565 3
104 . 1 1 18 18 LYS HE2 H 1 2.912 0.01 . 2 . . . . 95 LYS HE2 . 15565 3
105 . 1 1 18 18 LYS HE3 H 1 2.912 0.01 . 2 . . . . 95 LYS HE3 . 15565 3
106 . 1 1 18 18 LYS HG2 H 1 1.355 0.01 . 2 . . . . 95 LYS HG2 . 15565 3
107 . 1 1 18 18 LYS HG3 H 1 1.355 0.01 . 2 . . . . 95 LYS HG3 . 15565 3
108 . 1 1 19 19 HIS H H 1 8.252 0.01 . 1 . . . . 96 HIS H . 15565 3
109 . 1 1 19 19 HIS HA H 1 4.617 0.01 . 1 . . . . 96 HIS HA . 15565 3
110 . 1 1 19 19 HIS HB2 H 1 3.216 0.01 . 2 . . . . 96 HIS HB2 . 15565 3
111 . 1 1 19 19 HIS HB3 H 1 3.127 0.01 . 2 . . . . 96 HIS HB3 . 15565 3
112 . 1 1 19 19 HIS HD2 H 1 7.155 0.01 . 1 . . . . 96 HIS HD2 . 15565 3
113 . 1 1 21 21 ALA H H 1 8.312 0.01 . 1 . . . . 98 ALA H . 15565 3
114 . 1 1 21 21 ALA HA H 1 4.354 0.01 . 1 . . . . 98 ALA HA . 15565 3
115 . 1 1 21 21 ALA HB1 H 1 1.403 0.01 . 1 . . . . 98 ALA HB . 15565 3
116 . 1 1 21 21 ALA HB2 H 1 1.403 0.01 . 1 . . . . 98 ALA HB . 15565 3
117 . 1 1 21 21 ALA HB3 H 1 1.403 0.01 . 1 . . . . 98 ALA HB . 15565 3
118 . 1 1 22 22 VAL H H 1 8.082 0.01 . 1 . . . . 99 VAL H . 15565 3
119 . 1 1 22 22 VAL HA H 1 4.121 0.01 . 1 . . . . 99 VAL HA . 15565 3
120 . 1 1 22 22 VAL HB H 1 2.107 0.01 . 1 . . . . 99 VAL HB . 15565 3
121 . 1 1 22 22 VAL HG11 H 1 0.952 0.01 . 2 . . . . 99 VAL HG1 . 15565 3
122 . 1 1 22 22 VAL HG12 H 1 0.952 0.01 . 2 . . . . 99 VAL HG1 . 15565 3
123 . 1 1 22 22 VAL HG13 H 1 0.952 0.01 . 2 . . . . 99 VAL HG1 . 15565 3
124 . 1 1 22 22 VAL HG21 H 1 0.952 0.01 . 2 . . . . 99 VAL HG2 . 15565 3
125 . 1 1 22 22 VAL HG22 H 1 0.952 0.01 . 2 . . . . 99 VAL HG2 . 15565 3
126 . 1 1 22 22 VAL HG23 H 1 0.952 0.01 . 2 . . . . 99 VAL HG2 . 15565 3
stop_
save_