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 17295
_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 NOESY' . . . 17295 1
2 '2D 1H-1H TOCSY' . . . 17295 1
3 '3D 1H-15N TOCSY' . . . 17295 1
4 '3D 1H- 15N NOESY' . . . 17295 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 . . 17295 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 3 3 GLY H H 1 8.706 0.020 . 1 . . . . 3 GLY H . 17295 1
2 . 1 1 3 3 GLY HA2 H 1 3.716 0.020 . 2 . . . . 3 GLY HA2 . 17295 1
3 . 1 1 3 3 GLY HA3 H 1 4.035 0.020 . 2 . . . . 3 GLY HA3 . 17295 1
4 . 1 1 3 3 GLY N N 15 111.481 0.400 . 1 . . . . 3 GLY N . 17295 1
5 . 1 1 4 4 CYS H H 1 8.143 0.020 . 1 . . . . 4 CYS H . 17295 1
6 . 1 1 4 4 CYS HA H 1 4.508 0.020 . 1 . . . . 4 CYS HA . 17295 1
7 . 1 1 4 4 CYS HB2 H 1 2.751 0.020 . 2 . . . . 4 CYS HB2 . 17295 1
8 . 1 1 4 4 CYS HB3 H 1 3.563 0.020 . 2 . . . . 4 CYS HB3 . 17295 1
9 . 1 1 4 4 CYS N N 15 120.743 0.400 . 1 . . . . 4 CYS N . 17295 1
10 . 1 1 5 5 ASP H H 1 9.043 0.020 . 1 . . . . 5 ASP H . 17295 1
11 . 1 1 5 5 ASP HA H 1 4.565 0.020 . 1 . . . . 5 ASP HA . 17295 1
12 . 1 1 5 5 ASP HB2 H 1 2.673 0.020 . 2 . . . . 5 ASP HB2 . 17295 1
13 . 1 1 5 5 ASP HB3 H 1 2.874 0.020 . 2 . . . . 5 ASP HB3 . 17295 1
14 . 1 1 5 5 ASP N N 15 125.018 0.400 . 1 . . . . 5 ASP N . 17295 1
15 . 1 1 6 6 ASP H H 1 8.600 0.020 . 1 . . . . 6 ASP H . 17295 1
16 . 1 1 6 6 ASP HA H 1 4.256 0.020 . 1 . . . . 6 ASP HA . 17295 1
17 . 1 1 6 6 ASP HB2 H 1 2.470 0.020 . 2 . . . . 6 ASP HB2 . 17295 1
18 . 1 1 6 6 ASP HB3 H 1 2.753 0.020 . 2 . . . . 6 ASP HB3 . 17295 1
19 . 1 1 6 6 ASP N N 15 116.125 0.400 . 1 . . . . 6 ASP N . 17295 1
20 . 1 1 7 7 LYS H H 1 8.430 0.020 . 1 . . . . 7 LYS H . 17295 1
21 . 1 1 7 7 LYS HA H 1 4.458 0.020 . 1 . . . . 7 LYS HA . 17295 1
22 . 1 1 7 7 LYS HB2 H 1 1.663 0.020 . 1 . . . . 7 LYS HB2 . 17295 1
23 . 1 1 7 7 LYS HB3 H 1 1.663 0.020 . 1 . . . . 7 LYS HB3 . 17295 1
24 . 1 1 7 7 LYS HG2 H 1 1.190 0.020 . 1 . . . . 7 LYS HG2 . 17295 1
25 . 1 1 7 7 LYS HG3 H 1 1.190 0.020 . 1 . . . . 7 LYS HG3 . 17295 1
26 . 1 1 7 7 LYS HD2 H 1 1.430 0.020 . 1 . . . . 7 LYS HD2 . 17295 1
27 . 1 1 7 7 LYS HD3 H 1 1.430 0.020 . 1 . . . . 7 LYS HD3 . 17295 1
28 . 1 1 7 7 LYS HE2 H 1 2.819 0.020 . 1 . . . . 7 LYS HE2 . 17295 1
29 . 1 1 7 7 LYS HE3 H 1 2.819 0.020 . 1 . . . . 7 LYS HE3 . 17295 1
30 . 1 1 7 7 LYS N N 15 117.741 0.400 . 1 . . . . 7 LYS N . 17295 1
31 . 1 1 8 8 CYS H H 1 7.428 0.020 . 1 . . . . 8 CYS H . 17295 1
32 . 1 1 8 8 CYS HA H 1 4.303 0.020 . 1 . . . . 8 CYS HA . 17295 1
33 . 1 1 8 8 CYS HB2 H 1 3.005 0.020 . 1 . . . . 8 CYS HB2 . 17295 1
34 . 1 1 8 8 CYS HB3 H 1 3.005 0.020 . 1 . . . . 8 CYS HB3 . 17295 1
35 . 1 1 8 8 CYS N N 15 119.025 0.400 . 1 . . . . 8 CYS N . 17295 1
36 . 1 1 9 9 GLY H H 1 8.627 0.020 . 1 . . . . 9 GLY H . 17295 1
37 . 1 1 9 9 GLY HA2 H 1 3.412 0.020 . 2 . . . . 9 GLY HA2 . 17295 1
38 . 1 1 9 9 GLY HA3 H 1 4.405 0.020 . 2 . . . . 9 GLY HA3 . 17295 1
39 . 1 1 9 9 GLY N N 15 112.263 0.400 . 1 . . . . 9 GLY N . 17295 1
40 . 1 1 10 10 CYS H H 1 8.690 0.020 . 1 . . . . 10 CYS H . 17295 1
41 . 1 1 10 10 CYS HA H 1 4.264 0.020 . 1 . . . . 10 CYS HA . 17295 1
42 . 1 1 10 10 CYS HB2 H 1 3.181 0.020 . 2 . . . . 10 CYS HB2 . 17295 1
43 . 1 1 10 10 CYS HB3 H 1 3.520 0.020 . 2 . . . . 10 CYS HB3 . 17295 1
44 . 1 1 10 10 CYS N N 15 123.700 0.400 . 1 . . . . 10 CYS N . 17295 1
45 . 1 1 11 11 ALA H H 1 8.411 0.020 . 1 . . . . 11 ALA H . 17295 1
46 . 1 1 11 11 ALA HA H 1 3.976 0.020 . 1 . . . . 11 ALA HA . 17295 1
47 . 1 1 11 11 ALA HB1 H 1 1.191 0.020 . 1 . . . . 11 ALA HB1 . 17295 1
48 . 1 1 11 11 ALA HB2 H 1 1.191 0.020 . 1 . . . . 11 ALA HB2 . 17295 1
49 . 1 1 11 11 ALA HB3 H 1 1.191 0.020 . 1 . . . . 11 ALA HB3 . 17295 1
50 . 1 1 11 11 ALA N N 15 124.393 0.400 . 1 . . . . 11 ALA N . 17295 1
51 . 1 1 12 12 VAL H H 1 7.956 0.020 . 1 . . . . 12 VAL H . 17295 1
52 . 1 1 12 12 VAL HA H 1 4.042 0.020 . 1 . . . . 12 VAL HA . 17295 1
53 . 1 1 12 12 VAL HB H 1 1.735 0.020 . 1 . . . . 12 VAL HB . 17295 1
54 . 1 1 12 12 VAL HG11 H 1 0.640 0.020 . 2 . . . . 12 VAL HG11 . 17295 1
55 . 1 1 12 12 VAL HG12 H 1 0.640 0.020 . 2 . . . . 12 VAL HG12 . 17295 1
56 . 1 1 12 12 VAL HG13 H 1 0.640 0.020 . 2 . . . . 12 VAL HG13 . 17295 1
57 . 1 1 12 12 VAL HG21 H 1 0.640 0.020 . 2 . . . . 12 VAL HG21 . 17295 1
58 . 1 1 12 12 VAL HG22 H 1 0.640 0.020 . 2 . . . . 12 VAL HG22 . 17295 1
59 . 1 1 12 12 VAL HG23 H 1 0.640 0.020 . 2 . . . . 12 VAL HG23 . 17295 1
60 . 1 1 12 12 VAL N N 15 118.562 0.400 . 1 . . . . 12 VAL N . 17295 1
61 . 1 1 13 13 PRO HA H 1 4.579 0.020 . 1 . . . . 13 PRO HA . 17295 1
62 . 1 1 13 13 PRO HB2 H 1 1.737 0.020 . 2 . . . . 13 PRO HB2 . 17295 1
63 . 1 1 13 13 PRO HB3 H 1 2.157 0.020 . 2 . . . . 13 PRO HB3 . 17295 1
64 . 1 1 13 13 PRO HG2 H 1 1.641 0.020 . 1 . . . . 13 PRO HG2 . 17295 1
65 . 1 1 13 13 PRO HG3 H 1 1.641 0.020 . 1 . . . . 13 PRO HG3 . 17295 1
66 . 1 1 13 13 PRO HD2 H 1 3.301 0.020 . 2 . . . . 13 PRO HD2 . 17295 1
67 . 1 1 13 13 PRO HD3 H 1 3.402 0.020 . 2 . . . . 13 PRO HD3 . 17295 1
68 . 1 1 14 14 CYS H H 1 8.286 0.020 . 1 . . . . 14 CYS H . 17295 1
69 . 1 1 14 14 CYS HA H 1 4.386 0.020 . 1 . . . . 14 CYS HA . 17295 1
70 . 1 1 14 14 CYS HB2 H 1 2.723 0.020 . 2 . . . . 14 CYS HB2 . 17295 1
71 . 1 1 14 14 CYS HB3 H 1 3.131 0.020 . 2 . . . . 14 CYS HB3 . 17295 1
72 . 1 1 14 14 CYS N N 15 124.784 0.400 . 1 . . . . 14 CYS N . 17295 1
73 . 1 1 15 15 PRO HA H 1 4.344 0.020 . 1 . . . . 15 PRO HA . 17295 1
74 . 1 1 15 15 PRO HB2 H 1 1.904 0.020 . 2 . . . . 15 PRO HB2 . 17295 1
75 . 1 1 15 15 PRO HB3 H 1 2.061 0.020 . 2 . . . . 15 PRO HB3 . 17295 1
76 . 1 1 15 15 PRO HG2 H 1 1.762 0.020 . 1 . . . . 15 PRO HG2 . 17295 1
77 . 1 1 15 15 PRO HG3 H 1 1.762 0.020 . 1 . . . . 15 PRO HG3 . 17295 1
78 . 1 1 15 15 PRO HD2 H 1 3.664 0.020 . 2 . . . . 15 PRO HD2 . 17295 1
79 . 1 1 15 15 PRO HD3 H 1 4.072 0.020 . 2 . . . . 15 PRO HD3 . 17295 1
80 . 1 1 16 16 GLY H H 1 8.359 0.020 . 1 . . . . 16 GLY H . 17295 1
81 . 1 1 16 16 GLY HA2 H 1 3.574 0.020 . 2 . . . . 16 GLY HA2 . 17295 1
82 . 1 1 16 16 GLY HA3 H 1 4.028 0.020 . 2 . . . . 16 GLY HA3 . 17295 1
83 . 1 1 16 16 GLY N N 15 110.530 0.400 . 1 . . . . 16 GLY N . 17295 1
84 . 1 1 17 17 GLY H H 1 8.332 0.020 . 1 . . . . 17 GLY H . 17295 1
85 . 1 1 17 17 GLY HA2 H 1 3.630 0.020 . 2 . . . . 17 GLY HA2 . 17295 1
86 . 1 1 17 17 GLY HA3 H 1 3.880 0.020 . 2 . . . . 17 GLY HA3 . 17295 1
87 . 1 1 17 17 GLY N N 15 107.409 0.400 . 1 . . . . 17 GLY N . 17295 1
88 . 1 1 18 18 THR HA H 1 4.169 0.020 . 1 . . . . 18 THR HA . 17295 1
89 . 1 1 18 18 THR HB H 1 3.933 0.020 . 1 . . . . 18 THR HB . 17295 1
90 . 1 1 18 18 THR HG21 H 1 1.116 0.020 . 1 . . . . 18 THR HG21 . 17295 1
91 . 1 1 18 18 THR HG22 H 1 1.116 0.020 . 1 . . . . 18 THR HG22 . 17295 1
92 . 1 1 18 18 THR HG23 H 1 1.116 0.020 . 1 . . . . 18 THR HG23 . 17295 1
93 . 1 1 19 19 GLY H H 1 8.061 0.020 . 1 . . . . 19 GLY H . 17295 1
94 . 1 1 19 19 GLY HA2 H 1 3.462 0.020 . 2 . . . . 19 GLY HA2 . 17295 1
95 . 1 1 19 19 GLY HA3 H 1 3.992 0.020 . 2 . . . . 19 GLY HA3 . 17295 1
96 . 1 1 19 19 GLY N N 15 108.276 0.400 . 1 . . . . 19 GLY N . 17295 1
97 . 1 1 20 20 CYS H H 1 7.047 0.020 . 1 . . . . 20 CYS H . 17295 1
98 . 1 1 20 20 CYS HA H 1 4.337 0.020 . 1 . . . . 20 CYS HA . 17295 1
99 . 1 1 20 20 CYS HB2 H 1 2.124 0.020 . 2 . . . . 20 CYS HB2 . 17295 1
100 . 1 1 20 20 CYS HB3 H 1 2.838 0.020 . 2 . . . . 20 CYS HB3 . 17295 1
101 . 1 1 20 20 CYS N N 15 122.822 0.400 . 1 . . . . 20 CYS N . 17295 1
102 . 1 1 21 21 ARG H H 1 8.088 0.020 . 1 . . . . 21 ARG H . 17295 1
103 . 1 1 21 21 ARG HA H 1 4.203 0.020 . 1 . . . . 21 ARG HA . 17295 1
104 . 1 1 21 21 ARG HB2 H 1 1.854 0.020 . 1 . . . . 21 ARG HB2 . 17295 1
105 . 1 1 21 21 ARG HB3 H 1 1.854 0.020 . 1 . . . . 21 ARG HB3 . 17295 1
106 . 1 1 21 21 ARG HG2 H 1 1.613 0.020 . 1 . . . . 21 ARG HG2 . 17295 1
107 . 1 1 21 21 ARG HG3 H 1 1.613 0.020 . 1 . . . . 21 ARG HG3 . 17295 1
108 . 1 1 21 21 ARG HD2 H 1 3.028 0.020 . 1 . . . . 21 ARG HD2 . 17295 1
109 . 1 1 21 21 ARG HD3 H 1 3.028 0.020 . 1 . . . . 21 ARG HD3 . 17295 1
110 . 1 1 21 21 ARG N N 15 131.038 0.400 . 1 . . . . 21 ARG N . 17295 1
111 . 1 1 22 22 CYS H H 1 8.379 0.020 . 1 . . . . 22 CYS H . 17295 1
112 . 1 1 22 22 CYS HA H 1 4.207 0.020 . 1 . . . . 22 CYS HA . 17295 1
113 . 1 1 22 22 CYS HB2 H 1 2.441 0.020 . 2 . . . . 22 CYS HB2 . 17295 1
114 . 1 1 22 22 CYS HB3 H 1 2.840 0.020 . 2 . . . . 22 CYS HB3 . 17295 1
115 . 1 1 22 22 CYS N N 15 122.500 0.400 . 1 . . . . 22 CYS N . 17295 1
116 . 1 1 23 23 THR H H 1 7.530 0.020 . 1 . . . . 23 THR H . 17295 1
117 . 1 1 23 23 THR HB H 1 4.124 0.020 . 1 . . . . 23 THR HB . 17295 1
118 . 1 1 23 23 THR HG21 H 1 1.044 0.020 . 1 . . . . 23 THR HG21 . 17295 1
119 . 1 1 23 23 THR HG22 H 1 1.044 0.020 . 1 . . . . 23 THR HG22 . 17295 1
120 . 1 1 23 23 THR HG23 H 1 1.044 0.020 . 1 . . . . 23 THR HG23 . 17295 1
121 . 1 1 23 23 THR N N 15 113.838 0.400 . 1 . . . . 23 THR N . 17295 1
122 . 1 1 24 24 SER H H 1 7.925 0.020 . 1 . . . . 24 SER H . 17295 1
123 . 1 1 24 24 SER HA H 1 4.277 0.020 . 1 . . . . 24 SER HA . 17295 1
124 . 1 1 24 24 SER HB2 H 1 3.732 0.020 . 1 . . . . 24 SER HB2 . 17295 1
125 . 1 1 24 24 SER HB3 H 1 3.732 0.020 . 1 . . . . 24 SER HB3 . 17295 1
126 . 1 1 24 24 SER N N 15 117.756 0.400 . 1 . . . . 24 SER N . 17295 1
127 . 1 1 25 25 ALA H H 1 8.006 0.020 . 1 . . . . 25 ALA H . 17295 1
128 . 1 1 25 25 ALA HA H 1 4.176 0.020 . 1 . . . . 25 ALA HA . 17295 1
129 . 1 1 25 25 ALA HB1 H 1 1.225 0.020 . 1 . . . . 25 ALA HB1 . 17295 1
130 . 1 1 25 25 ALA HB2 H 1 1.225 0.020 . 1 . . . . 25 ALA HB2 . 17295 1
131 . 1 1 25 25 ALA HB3 H 1 1.225 0.020 . 1 . . . . 25 ALA HB3 . 17295 1
132 . 1 1 25 25 ALA N N 15 126.257 0.400 . 1 . . . . 25 ALA N . 17295 1
133 . 1 1 26 26 ARG H H 1 7.713 0.020 . 1 . . . . 26 ARG H . 17295 1
134 . 1 1 26 26 ARG HA H 1 3.989 0.020 . 1 . . . . 26 ARG HA . 17295 1
135 . 1 1 26 26 ARG HB2 H 1 1.533 0.020 . 2 . . . . 26 ARG HB2 . 17295 1
136 . 1 1 26 26 ARG HB3 H 1 1.688 0.020 . 2 . . . . 26 ARG HB3 . 17295 1
137 . 1 1 26 26 ARG HG2 H 1 1.430 0.020 . 1 . . . . 26 ARG HG2 . 17295 1
138 . 1 1 26 26 ARG HG3 H 1 1.430 0.020 . 1 . . . . 26 ARG HG3 . 17295 1
139 . 1 1 26 26 ARG HD2 H 1 3.027 0.020 . 1 . . . . 26 ARG HD2 . 17295 1
140 . 1 1 26 26 ARG HD3 H 1 3.027 0.020 . 1 . . . . 26 ARG HD3 . 17295 1
141 . 1 1 26 26 ARG N N 15 125.425 0.400 . 1 . . . . 26 ARG N . 17295 1
stop_
save_