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 30383
_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' . . . 30383 1
2 '2D 1H-1H NOESY' . . . 30383 1
3 '2D 1H-13C HSQC' . . . 30383 1
4 '2D 1H-15N HSQC' . . . 30383 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.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 CYS H H 1 8.802 0.001 . . . . . . A 1 CYS H1 . 30383 1
2 . 1 1 1 1 CYS HA H 1 5.132 0.006 . . . . . . A 1 CYS HA . 30383 1
3 . 1 1 1 1 CYS HB2 H 1 3.420 0.011 . . . . . . A 1 CYS HB2 . 30383 1
4 . 1 1 1 1 CYS HB3 H 1 2.778 0.003 . . . . . . A 1 CYS HB3 . 30383 1
5 . 1 1 1 1 CYS CA C 13 57.599 0.000 . . . . . . A 1 CYS CA . 30383 1
6 . 1 1 1 1 CYS CB C 13 47.525 0.010 . . . . . . A 1 CYS CB . 30383 1
7 . 1 1 1 1 CYS N N 15 121.888 0.000 . . . . . . A 1 CYS N . 30383 1
8 . 1 1 2 2 THR H H 1 8.978 0.001 . . . . . . A 2 THR H . 30383 1
9 . 1 1 2 2 THR HA H 1 4.307 0.008 . . . . . . A 2 THR HA . 30383 1
10 . 1 1 2 2 THR HB H 1 4.502 0.003 . . . . . . A 2 THR HB . 30383 1
11 . 1 1 2 2 THR HG21 H 1 1.413 0.005 . . . . . . A 2 THR HG21 . 30383 1
12 . 1 1 2 2 THR HG22 H 1 1.413 0.005 . . . . . . A 2 THR HG22 . 30383 1
13 . 1 1 2 2 THR HG23 H 1 1.413 0.005 . . . . . . A 2 THR HG23 . 30383 1
14 . 1 1 2 2 THR CA C 13 62.078 0.000 . . . . . . A 2 THR CA . 30383 1
15 . 1 1 2 2 THR CB C 13 70.329 0.000 . . . . . . A 2 THR CB . 30383 1
16 . 1 1 2 2 THR CG2 C 13 22.134 0.000 . . . . . . A 2 THR CG2 . 30383 1
17 . 1 1 2 2 THR N N 15 114.240 0.000 . . . . . . A 2 THR N . 30383 1
18 . 1 1 3 3 ALA H H 1 8.509 0.000 . . . . . . A 3 ALA H . 30383 1
19 . 1 1 3 3 ALA HA H 1 4.552 0.006 . . . . . . A 3 ALA HA . 30383 1
20 . 1 1 3 3 ALA HB1 H 1 1.378 0.006 . . . . . . A 3 ALA HB1 . 30383 1
21 . 1 1 3 3 ALA HB2 H 1 1.378 0.006 . . . . . . A 3 ALA HB2 . 30383 1
22 . 1 1 3 3 ALA HB3 H 1 1.378 0.006 . . . . . . A 3 ALA HB3 . 30383 1
23 . 1 1 3 3 ALA CA C 13 51.255 0.000 . . . . . . A 3 ALA CA . 30383 1
24 . 1 1 3 3 ALA CB C 13 17.537 0.000 . . . . . . A 3 ALA CB . 30383 1
25 . 1 1 3 3 ALA N N 15 124.341 0.000 . . . . . . A 3 ALA N . 30383 1
26 . 1 1 4 4 SER H H 1 7.415 0.001 . . . . . . A 4 SER H . 30383 1
27 . 1 1 4 4 SER HA H 1 4.382 0.004 . . . . . . A 4 SER HA . 30383 1
28 . 1 1 4 4 SER HB2 H 1 3.896 0.004 . . . . . . A 4 SER HB2 . 30383 1
29 . 1 1 4 4 SER HB3 H 1 3.747 0.003 . . . . . . A 4 SER HB3 . 30383 1
30 . 1 1 4 4 SER CA C 13 57.267 0.000 . . . . . . A 4 SER CA . 30383 1
31 . 1 1 4 4 SER CB C 13 65.323 0.001 . . . . . . A 4 SER CB . 30383 1
32 . 1 1 4 4 SER N N 15 113.679 0.000 . . . . . . A 4 SER N . 30383 1
33 . 1 1 5 5 ILE H H 1 8.243 0.002 . . . . . . A 5 ILE H . 30383 1
34 . 1 1 5 5 ILE HA H 1 4.306 0.005 . . . . . . A 5 ILE HA . 30383 1
35 . 1 1 5 5 ILE HB H 1 1.795 0.007 . . . . . . A 5 ILE HB . 30383 1
36 . 1 1 5 5 ILE HG12 H 1 1.434 0.013 . . . . . . A 5 ILE HG12 . 30383 1
37 . 1 1 5 5 ILE HG13 H 1 1.040 0.006 . . . . . . A 5 ILE HG13 . 30383 1
38 . 1 1 5 5 ILE HG21 H 1 0.828 0.006 . . . . . . A 5 ILE HG21 . 30383 1
39 . 1 1 5 5 ILE HG22 H 1 0.828 0.006 . . . . . . A 5 ILE HG22 . 30383 1
40 . 1 1 5 5 ILE HG23 H 1 0.828 0.006 . . . . . . A 5 ILE HG23 . 30383 1
41 . 1 1 5 5 ILE HD11 H 1 0.829 0.008 . . . . . . A 5 ILE HD11 . 30383 1
42 . 1 1 5 5 ILE HD12 H 1 0.829 0.008 . . . . . . A 5 ILE HD12 . 30383 1
43 . 1 1 5 5 ILE HD13 H 1 0.829 0.008 . . . . . . A 5 ILE HD13 . 30383 1
44 . 1 1 5 5 ILE CA C 13 57.705 0.000 . . . . . . A 5 ILE CA . 30383 1
45 . 1 1 5 5 ILE CB C 13 39.397 0.000 . . . . . . A 5 ILE CB . 30383 1
46 . 1 1 5 5 ILE CG1 C 13 26.866 0.025 . . . . . . A 5 ILE CG1 . 30383 1
47 . 1 1 5 5 ILE CG2 C 13 16.955 0.000 . . . . . . A 5 ILE CG2 . 30383 1
48 . 1 1 5 5 ILE CD1 C 13 12.680 0.000 . . . . . . A 5 ILE CD1 . 30383 1
49 . 1 1 5 5 ILE N N 15 119.338 0.000 . . . . . . A 5 ILE N . 30383 1
50 . 1 1 6 6 PRO HA H 1 5.109 0.006 . . . . . . A 6 PRO HA . 30383 1
51 . 1 1 6 6 PRO HB2 H 1 2.446 0.006 . . . . . . A 6 PRO HB2 . 30383 1
52 . 1 1 6 6 PRO HB3 H 1 2.027 0.005 . . . . . . A 6 PRO HB3 . 30383 1
53 . 1 1 6 6 PRO HG2 H 1 1.952 0.006 . . . . . . A 6 PRO HG2 . 30383 1
54 . 1 1 6 6 PRO HG3 H 1 1.830 0.007 . . . . . . A 6 PRO HG3 . 30383 1
55 . 1 1 6 6 PRO HD2 H 1 3.613 0.004 . . . . . . A 6 PRO HD2 . 30383 1
56 . 1 1 6 6 PRO HD3 H 1 3.512 0.004 . . . . . . A 6 PRO HD3 . 30383 1
57 . 1 1 6 6 PRO CA C 13 62.298 0.000 . . . . . . A 6 PRO CA . 30383 1
58 . 1 1 6 6 PRO CB C 13 33.049 0.009 . . . . . . A 6 PRO CB . 30383 1
59 . 1 1 6 6 PRO CG C 13 24.710 0.005 . . . . . . A 6 PRO CG . 30383 1
60 . 1 1 6 6 PRO CD C 13 49.912 0.002 . . . . . . A 6 PRO CD . 30383 1
61 . 1 1 7 7 PRO HA H 1 4.213 0.006 . . . . . . A 7 PRO HA . 30383 1
62 . 1 1 7 7 PRO HB2 H 1 2.461 0.004 . . . . . . A 7 PRO HB2 . 30383 1
63 . 1 1 7 7 PRO HB3 H 1 1.830 0.005 . . . . . . A 7 PRO HB3 . 30383 1
64 . 1 1 7 7 PRO HG2 H 1 2.115 0.005 . . . . . . A 7 PRO HG2 . 30383 1
65 . 1 1 7 7 PRO HG3 H 1 2.115 0.005 . . . . . . A 7 PRO HG3 . 30383 1
66 . 1 1 7 7 PRO HD2 H 1 3.826 0.005 . . . . . . A 7 PRO HD2 . 30383 1
67 . 1 1 7 7 PRO HD3 H 1 3.675 0.004 . . . . . . A 7 PRO HD3 . 30383 1
68 . 1 1 7 7 PRO CA C 13 63.400 0.000 . . . . . . A 7 PRO CA . 30383 1
69 . 1 1 7 7 PRO CB C 13 32.765 0.050 . . . . . . A 7 PRO CB . 30383 1
70 . 1 1 7 7 PRO CG C 13 27.238 0.000 . . . . . . A 7 PRO CG . 30383 1
71 . 1 1 7 7 PRO CD C 13 50.725 0.002 . . . . . . A 7 PRO CD . 30383 1
72 . 1 1 8 8 ILE H H 1 7.899 0.001 . . . . . . A 8 ILE H . 30383 1
73 . 1 1 8 8 ILE HA H 1 4.259 0.008 . . . . . . A 8 ILE HA . 30383 1
74 . 1 1 8 8 ILE HB H 1 1.911 0.009 . . . . . . A 8 ILE HB . 30383 1
75 . 1 1 8 8 ILE HG12 H 1 1.445 0.006 . . . . . . A 8 ILE HG12 . 30383 1
76 . 1 1 8 8 ILE HG13 H 1 1.114 0.008 . . . . . . A 8 ILE HG13 . 30383 1
77 . 1 1 8 8 ILE HG21 H 1 0.691 0.008 . . . . . . A 8 ILE HG21 . 30383 1
78 . 1 1 8 8 ILE HG22 H 1 0.691 0.008 . . . . . . A 8 ILE HG22 . 30383 1
79 . 1 1 8 8 ILE HG23 H 1 0.691 0.008 . . . . . . A 8 ILE HG23 . 30383 1
80 . 1 1 8 8 ILE HD11 H 1 0.800 0.005 . . . . . . A 8 ILE HD11 . 30383 1
81 . 1 1 8 8 ILE HD12 H 1 0.800 0.005 . . . . . . A 8 ILE HD12 . 30383 1
82 . 1 1 8 8 ILE HD13 H 1 0.800 0.005 . . . . . . A 8 ILE HD13 . 30383 1
83 . 1 1 8 8 ILE CA C 13 60.119 0.000 . . . . . . A 8 ILE CA . 30383 1
84 . 1 1 8 8 ILE CB C 13 37.639 0.000 . . . . . . A 8 ILE CB . 30383 1
85 . 1 1 8 8 ILE CG1 C 13 26.812 0.032 . . . . . . A 8 ILE CG1 . 30383 1
86 . 1 1 8 8 ILE CG2 C 13 17.261 0.000 . . . . . . A 8 ILE CG2 . 30383 1
87 . 1 1 8 8 ILE CD1 C 13 11.793 0.000 . . . . . . A 8 ILE CD1 . 30383 1
88 . 1 1 8 8 ILE N N 15 122.724 0.000 . . . . . . A 8 ILE N . 30383 1
89 . 1 1 9 9 CYS H H 1 8.927 0.000 . . . . . . A 9 CYS H . 30383 1
90 . 1 1 9 9 CYS HA H 1 5.255 0.005 . . . . . . A 9 CYS HA . 30383 1
91 . 1 1 9 9 CYS HB2 H 1 3.288 0.009 . . . . . . A 9 CYS HB2 . 30383 1
92 . 1 1 9 9 CYS HB3 H 1 2.828 0.002 . . . . . . A 9 CYS HB3 . 30383 1
93 . 1 1 9 9 CYS CA C 13 51.749 0.000 . . . . . . A 9 CYS CA . 30383 1
94 . 1 1 9 9 CYS CB C 13 44.087 0.013 . . . . . . A 9 CYS CB . 30383 1
95 . 1 1 9 9 CYS N N 15 127.656 0.000 . . . . . . A 9 CYS N . 30383 1
96 . 1 1 10 10 E9V N N 15 3.098 0.000 . . . . . . A 10 E9V N . 30383 1
97 . 1 1 10 10 E9V CA C 13 56.719 0.000 . . . . . . A 10 E9V CA . 30383 1
98 . 1 1 10 10 E9V CB C 13 26.724 0.003 . . . . . . A 10 E9V CB . 30383 1
99 . 1 1 10 10 E9V HA H 1 5.438 0.009 . . . . . . A 10 E9V HA . 30383 1
100 . 1 1 10 10 E9V HB2 H 1 3.283 0.001 . . . . . . A 10 E9V HB2 . 30383 1
101 . 1 1 10 10 E9V HB3 H 1 3.201 0.003 . . . . . . A 10 E9V HB3 . 30383 1
102 . 1 1 10 10 E9V HD2 H 1 7.131 0.002 . . . . . . A 10 E9V HD2 . 30383 1
103 . 1 1 10 10 E9V HE1 H 1 8.196 0.002 . . . . . . A 10 E9V HE1 . 30383 1
104 . 1 1 11 11 DPN H H 1 8.847 0.001 . . . . . . A 11 DPN H . 30383 1
105 . 1 1 11 11 DPN N N 15 130.670 0.000 . . . . . . A 11 DPN N . 30383 1
106 . 1 1 11 11 DPN CA C 13 54.476 0.000 . . . . . . A 11 DPN CA . 30383 1
107 . 1 1 11 11 DPN CB C 13 38.819 0.006 . . . . . . A 11 DPN CB . 30383 1
108 . 1 1 11 11 DPN HA H 1 4.798 0.022 . . . . . . A 11 DPN HA . 30383 1
109 . 1 1 11 11 DPN HB2 H 1 3.168 0.006 . . . . . . A 11 DPN HB2 . 30383 1
110 . 1 1 11 11 DPN HB3 H 1 2.828 0.008 . . . . . . A 11 DPN HB3 . 30383 1
111 . 1 1 11 11 DPN HD1 H 1 7.206 0.001 . . . . . . A 11 DPN HD1 . 30383 1
112 . 1 1 11 11 DPN HE1 H 1 7.288 0.001 . . . . . . A 11 DPN HE1 . 30383 1
113 . 1 1 12 12 MMO N N 15 2.056 0.000 . . . . . . A 12 MMO N . 30383 1
114 . 1 1 12 12 MMO CA C 13 59.769 0.000 . . . . . . A 12 MMO CA . 30383 1
115 . 1 1 12 12 MMO CB C 13 26.001 0.010 . . . . . . A 12 MMO CB . 30383 1
116 . 1 1 12 12 MMO CD C 13 42.906 0.002 . . . . . . A 12 MMO CD . 30383 1
117 . 1 1 12 12 MMO CG C 13 26.619 0.003 . . . . . . A 12 MMO CG . 30383 1
118 . 1 1 12 12 MMO HA H 1 4.901 0.008 . . . . . . A 12 MMO HA . 30383 1
119 . 1 1 12 12 MMO HCB1 H 1 1.719 0.007 . . . . . . A 12 MMO HCB1 . 30383 1
120 . 1 1 12 12 MMO HCB2 H 1 1.019 0.008 . . . . . . A 12 MMO HCB2 . 30383 1
121 . 1 1 12 12 MMO HCD1 H 1 2.873 0.017 . . . . . . A 12 MMO HCD1 . 30383 1
122 . 1 1 12 12 MMO HCD2 H 1 2.860 0.003 . . . . . . A 12 MMO HCD2 . 30383 1
123 . 1 1 12 12 MMO HCG1 H 1 0.728 0.006 . . . . . . A 12 MMO HCG1 . 30383 1
124 . 1 1 12 12 MMO HCG2 H 1 0.253 0.004 . . . . . . A 12 MMO HCG2 . 30383 1
125 . 1 1 12 12 MMO HE H 1 6.977 0.001 . . . . . . A 12 MMO HE . 30383 1
126 . 1 1 13 13 TRP H H 1 7.585 0.001 . . . . . . A 13 TRP H . 30383 1
127 . 1 1 13 13 TRP HA H 1 4.969 0.006 . . . . . . A 13 TRP HA . 30383 1
128 . 1 1 13 13 TRP HB2 H 1 3.575 0.005 . . . . . . A 13 TRP HB2 . 30383 1
129 . 1 1 13 13 TRP HB3 H 1 3.401 0.003 . . . . . . A 13 TRP HB3 . 30383 1
130 . 1 1 13 13 TRP HD1 H 1 7.317 0.002 . . . . . . A 13 TRP HD1 . 30383 1
131 . 1 1 13 13 TRP HE1 H 1 10.102 0.001 . . . . . . A 13 TRP HE1 . 30383 1
132 . 1 1 13 13 TRP HE3 H 1 7.746 0.002 . . . . . . A 13 TRP HE3 . 30383 1
133 . 1 1 13 13 TRP HZ2 H 1 7.481 0.001 . . . . . . A 13 TRP HZ2 . 30383 1
134 . 1 1 13 13 TRP HZ3 H 1 7.099 0.000 . . . . . . A 13 TRP HZ3 . 30383 1
135 . 1 1 13 13 TRP HH2 H 1 7.223 0.002 . . . . . . A 13 TRP HH2 . 30383 1
136 . 1 1 13 13 TRP CA C 13 55.244 0.000 . . . . . . A 13 TRP CA . 30383 1
137 . 1 1 13 13 TRP CB C 13 30.202 0.001 . . . . . . A 13 TRP CB . 30383 1
138 . 1 1 13 13 TRP N N 15 121.046 0.000 . . . . . . A 13 TRP N . 30383 1
139 . 1 1 13 13 TRP NE1 N 15 128.273 0.000 . . . . . . A 13 TRP NE1 . 30383 1
140 . 1 1 14 14 ARG H H 1 8.249 0.001 . . . . . . A 14 ARG H . 30383 1
141 . 1 1 14 14 ARG HA H 1 4.129 0.005 . . . . . . A 14 ARG HA . 30383 1
142 . 1 1 14 14 ARG HB2 H 1 1.810 0.006 . . . . . . A 14 ARG HB2 . 30383 1
143 . 1 1 14 14 ARG HB3 H 1 1.810 0.006 . . . . . . A 14 ARG HB3 . 30383 1
144 . 1 1 14 14 ARG HG2 H 1 1.787 0.013 . . . . . . A 14 ARG HG2 . 30383 1
145 . 1 1 14 14 ARG HG3 H 1 1.725 0.007 . . . . . . A 14 ARG HG3 . 30383 1
146 . 1 1 14 14 ARG HD2 H 1 3.216 0.004 . . . . . . A 14 ARG HD2 . 30383 1
147 . 1 1 14 14 ARG HD3 H 1 3.216 0.004 . . . . . . A 14 ARG HD3 . 30383 1
148 . 1 1 14 14 ARG HE H 1 7.167 0.001 . . . . . . A 14 ARG HE . 30383 1
149 . 1 1 14 14 ARG CA C 13 57.065 0.000 . . . . . . A 14 ARG CA . 30383 1
150 . 1 1 14 14 ARG CB C 13 30.302 0.000 . . . . . . A 14 ARG CB . 30383 1
151 . 1 1 14 14 ARG CG C 13 26.934 0.024 . . . . . . A 14 ARG CG . 30383 1
152 . 1 1 14 14 ARG CD C 13 43.311 0.000 . . . . . . A 14 ARG CD . 30383 1
153 . 1 1 14 14 ARG N N 15 119.338 0.000 . . . . . . A 14 ARG N . 30383 1
stop_
save_