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 30380
_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 NOESY' . . . 30380 1
2 '2D 1H-1H TOCSY' . . . 30380 1
3 '2D 1H-13C HSQC' . . . 30380 1
4 '2D 1H-15N HSQC' . . . 30380 1
5 '2D 1H-1H COSY' . . . 30380 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 8.535 0.003 . . . . . . A 1 CYS H1 . 30380 1
2 . 1 1 1 1 CYS HA H 1 5.156 0.003 . . . . . . A 1 CYS HA . 30380 1
3 . 1 1 1 1 CYS HB2 H 1 3.029 0.003 . . . . . . A 1 CYS HB2 . 30380 1
4 . 1 1 1 1 CYS HB3 H 1 2.804 0.005 . . . . . . A 1 CYS HB3 . 30380 1
5 . 1 1 1 1 CYS CA C 13 56.588 0.000 . . . . . . A 1 CYS CA . 30380 1
6 . 1 1 1 1 CYS CB C 13 46.287 0.027 . . . . . . A 1 CYS CB . 30380 1
7 . 1 1 1 1 CYS N N 15 121.148 0.000 . . . . . . A 1 CYS N . 30380 1
8 . 1 1 2 2 THR H H 1 8.579 0.002 . . . . . . A 2 THR H . 30380 1
9 . 1 1 2 2 THR HA H 1 4.268 0.004 . . . . . . A 2 THR HA . 30380 1
10 . 1 1 2 2 THR HB H 1 4.410 0.003 . . . . . . A 2 THR HB . 30380 1
11 . 1 1 2 2 THR HG21 H 1 1.310 0.003 . . . . . . A 2 THR HG21 . 30380 1
12 . 1 1 2 2 THR HG22 H 1 1.310 0.003 . . . . . . A 2 THR HG22 . 30380 1
13 . 1 1 2 2 THR HG23 H 1 1.310 0.003 . . . . . . A 2 THR HG23 . 30380 1
14 . 1 1 2 2 THR CA C 13 61.827 0.000 . . . . . . A 2 THR CA . 30380 1
15 . 1 1 2 2 THR CB C 13 70.466 0.000 . . . . . . A 2 THR CB . 30380 1
16 . 1 1 2 2 THR CG2 C 13 22.169 0.000 . . . . . . A 2 THR CG2 . 30380 1
17 . 1 1 2 2 THR N N 15 114.450 0.000 . . . . . . A 2 THR N . 30380 1
18 . 1 1 3 3 ALA H H 1 8.393 0.002 . . . . . . A 3 ALA H . 30380 1
19 . 1 1 3 3 ALA HA H 1 4.446 0.004 . . . . . . A 3 ALA HA . 30380 1
20 . 1 1 3 3 ALA HB1 H 1 1.300 0.003 . . . . . . A 3 ALA HB1 . 30380 1
21 . 1 1 3 3 ALA HB2 H 1 1.300 0.003 . . . . . . A 3 ALA HB2 . 30380 1
22 . 1 1 3 3 ALA HB3 H 1 1.300 0.003 . . . . . . A 3 ALA HB3 . 30380 1
23 . 1 1 3 3 ALA CA C 13 51.514 0.000 . . . . . . A 3 ALA CA . 30380 1
24 . 1 1 3 3 ALA CB C 13 17.726 0.000 . . . . . . A 3 ALA CB . 30380 1
25 . 1 1 3 3 ALA N N 15 123.905 0.000 . . . . . . A 3 ALA N . 30380 1
26 . 1 1 4 4 SER H H 1 7.345 0.002 . . . . . . A 4 SER H . 30380 1
27 . 1 1 4 4 SER HA H 1 4.313 0.002 . . . . . . A 4 SER HA . 30380 1
28 . 1 1 4 4 SER HB2 H 1 3.797 0.001 . . . . . . A 4 SER HB2 . 30380 1
29 . 1 1 4 4 SER HB3 H 1 3.680 0.005 . . . . . . A 4 SER HB3 . 30380 1
30 . 1 1 4 4 SER CA C 13 59.139 0.000 . . . . . . A 4 SER CA . 30380 1
31 . 1 1 4 4 SER CB C 13 65.420 0.000 . . . . . . A 4 SER CB . 30380 1
32 . 1 1 4 4 SER N N 15 113.603 0.000 . . . . . . A 4 SER N . 30380 1
33 . 1 1 5 5 ILE H H 1 8.148 0.003 . . . . . . A 5 ILE H . 30380 1
34 . 1 1 5 5 ILE HA H 1 4.206 0.003 . . . . . . A 5 ILE HA . 30380 1
35 . 1 1 5 5 ILE HB H 1 1.711 0.005 . . . . . . A 5 ILE HB . 30380 1
36 . 1 1 5 5 ILE HG12 H 1 1.365 0.004 . . . . . . A 5 ILE HG12 . 30380 1
37 . 1 1 5 5 ILE HG13 H 1 0.965 0.003 . . . . . . A 5 ILE HG13 . 30380 1
38 . 1 1 5 5 ILE HD11 H 1 0.755 0.001 . . . . . . A 5 ILE HD11 . 30380 1
39 . 1 1 5 5 ILE HD12 H 1 0.755 0.001 . . . . . . A 5 ILE HD12 . 30380 1
40 . 1 1 5 5 ILE HD13 H 1 0.755 0.001 . . . . . . A 5 ILE HD13 . 30380 1
41 . 1 1 5 5 ILE CA C 13 57.740 0.000 . . . . . . A 5 ILE CA . 30380 1
42 . 1 1 5 5 ILE CB C 13 39.540 0.000 . . . . . . A 5 ILE CB . 30380 1
43 . 1 1 5 5 ILE CG1 C 13 26.883 0.000 . . . . . . A 5 ILE CG1 . 30380 1
44 . 1 1 5 5 ILE CD1 C 13 16.903 0.000 . . . . . . A 5 ILE CD1 . 30380 1
45 . 1 1 5 5 ILE N N 15 119.455 0.000 . . . . . . A 5 ILE N . 30380 1
46 . 1 1 6 6 PRO HA H 1 5.012 0.003 . . . . . . A 6 PRO HA . 30380 1
47 . 1 1 6 6 PRO HB2 H 1 2.375 0.004 . . . . . . A 6 PRO HB2 . 30380 1
48 . 1 1 6 6 PRO HB3 H 1 1.944 0.003 . . . . . . A 6 PRO HB3 . 30380 1
49 . 1 1 6 6 PRO HG2 H 1 1.870 0.004 . . . . . . A 6 PRO HG2 . 30380 1
50 . 1 1 6 6 PRO HG3 H 1 1.762 0.006 . . . . . . A 6 PRO HG3 . 30380 1
51 . 1 1 6 6 PRO HD2 H 1 3.535 0.003 . . . . . . A 6 PRO HD2 . 30380 1
52 . 1 1 6 6 PRO HD3 H 1 3.437 0.004 . . . . . . A 6 PRO HD3 . 30380 1
53 . 1 1 6 6 PRO CA C 13 62.183 0.000 . . . . . . A 6 PRO CA . 30380 1
54 . 1 1 6 6 PRO CB C 13 33.053 0.014 . . . . . . A 6 PRO CB . 30380 1
55 . 1 1 6 6 PRO CG C 13 24.702 0.014 . . . . . . A 6 PRO CG . 30380 1
56 . 1 1 6 6 PRO CD C 13 49.951 0.000 . . . . . . A 6 PRO CD . 30380 1
57 . 1 1 7 7 PRO HA H 1 4.180 0.003 . . . . . . A 7 PRO HA . 30380 1
58 . 1 1 7 7 PRO HB2 H 1 2.357 0.004 . . . . . . A 7 PRO HB2 . 30380 1
59 . 1 1 7 7 PRO HB3 H 1 1.780 0.002 . . . . . . A 7 PRO HB3 . 30380 1
60 . 1 1 7 7 PRO HG2 H 1 2.035 0.002 . . . . . . A 7 PRO HG2 . 30380 1
61 . 1 1 7 7 PRO HG3 H 1 2.035 0.002 . . . . . . A 7 PRO HG3 . 30380 1
62 . 1 1 7 7 PRO HD2 H 1 3.731 0.005 . . . . . . A 7 PRO HD2 . 30380 1
63 . 1 1 7 7 PRO HD3 H 1 3.616 0.003 . . . . . . A 7 PRO HD3 . 30380 1
64 . 1 1 7 7 PRO CA C 13 63.335 0.000 . . . . . . A 7 PRO CA . 30380 1
65 . 1 1 7 7 PRO CB C 13 32.422 0.014 . . . . . . A 7 PRO CB . 30380 1
66 . 1 1 7 7 PRO CG C 13 27.212 0.000 . . . . . . A 7 PRO CG . 30380 1
67 . 1 1 7 7 PRO CD C 13 50.623 0.014 . . . . . . A 7 PRO CD . 30380 1
68 . 1 1 8 8 ILE H H 1 7.836 0.002 . . . . . . A 8 ILE H . 30380 1
69 . 1 1 8 8 ILE HA H 1 4.192 0.003 . . . . . . A 8 ILE HA . 30380 1
70 . 1 1 8 8 ILE HB H 1 1.848 0.003 . . . . . . A 8 ILE HB . 30380 1
71 . 1 1 8 8 ILE HG12 H 1 1.344 0.008 . . . . . . A 8 ILE HG12 . 30380 1
72 . 1 1 8 8 ILE HG13 H 1 1.041 0.002 . . . . . . A 8 ILE HG13 . 30380 1
73 . 1 1 8 8 ILE HD11 H 1 0.685 0.003 . . . . . . A 8 ILE HD11 . 30380 1
74 . 1 1 8 8 ILE HD12 H 1 0.685 0.003 . . . . . . A 8 ILE HD12 . 30380 1
75 . 1 1 8 8 ILE HD13 H 1 0.685 0.003 . . . . . . A 8 ILE HD13 . 30380 1
76 . 1 1 8 8 ILE CA C 13 60.428 0.000 . . . . . . A 8 ILE CA . 30380 1
77 . 1 1 8 8 ILE CB C 13 37.921 0.000 . . . . . . A 8 ILE CB . 30380 1
78 . 1 1 8 8 ILE CG1 C 13 26.754 0.019 . . . . . . A 8 ILE CG1 . 30380 1
79 . 1 1 8 8 ILE CD1 C 13 17.150 0.000 . . . . . . A 8 ILE CD1 . 30380 1
80 . 1 1 8 8 ILE N N 15 125.291 0.000 . . . . . . A 8 ILE N . 30380 1
81 . 1 1 9 9 CYS H H 1 8.771 0.001 . . . . . . A 9 CYS H . 30380 1
82 . 1 1 9 9 CYS HA H 1 4.936 0.003 . . . . . . A 9 CYS HA . 30380 1
83 . 1 1 9 9 CYS HB2 H 1 2.876 0.002 . . . . . . A 9 CYS HB2 . 30380 1
84 . 1 1 9 9 CYS HB3 H 1 2.876 0.002 . . . . . . A 9 CYS HB3 . 30380 1
85 . 1 1 9 9 CYS CA C 13 54.997 0.000 . . . . . . A 9 CYS CA . 30380 1
86 . 1 1 9 9 CYS CB C 13 45.985 0.000 . . . . . . A 9 CYS CB . 30380 1
87 . 1 1 9 9 CYS N N 15 126.122 0.000 . . . . . . A 9 CYS N . 30380 1
88 . 1 1 10 10 HIS H H 1 8.666 0.003 . . . . . . A 10 HIS H . 30380 1
89 . 1 1 10 10 HIS HA H 1 4.745 0.004 . . . . . . A 10 HIS HA . 30380 1
90 . 1 1 10 10 HIS HB2 H 1 3.148 0.004 . . . . . . A 10 HIS HB2 . 30380 1
91 . 1 1 10 10 HIS HB3 H 1 2.994 0.006 . . . . . . A 10 HIS HB3 . 30380 1
92 . 1 1 10 10 HIS HD2 H 1 7.082 0.002 . . . . . . A 10 HIS HD2 . 30380 1
93 . 1 1 10 10 HIS HE1 H 1 8.450 0.000 . . . . . . A 10 HIS HE1 . 30380 1
94 . 1 1 10 10 HIS CA C 13 66.352 0.000 . . . . . . A 10 HIS CA . 30380 1
95 . 1 1 10 10 HIS CB C 13 29.077 0.000 . . . . . . A 10 HIS CB . 30380 1
96 . 1 1 10 10 HIS N N 15 120.810 0.000 . . . . . . A 10 HIS N . 30380 1
97 . 1 1 11 11 DPN H H 1 8.458 0.003 . . . . . . A 11 DPN H . 30380 1
98 . 1 1 11 11 DPN N N 15 125.044 0.000 . . . . . . A 11 DPN N . 30380 1
99 . 1 1 11 11 DPN CA C 13 57.466 0.000 . . . . . . A 11 DPN CA . 30380 1
100 . 1 1 11 11 DPN CB C 13 38.772 0.000 . . . . . . A 11 DPN CB . 30380 1
101 . 1 1 11 11 DPN HA H 1 4.316 0.004 . . . . . . A 11 DPN HA . 30380 1
102 . 1 1 11 11 DPN HB2 H 1 2.998 0.002 . . . . . . A 11 DPN HB2 . 30380 1
103 . 1 1 11 11 DPN HB3 H 1 2.881 0.005 . . . . . . A 11 DPN HB3 . 30380 1
104 . 1 1 11 11 DPN HD2 H 1 7.118 0.002 . . . . . . A 11 DPN HD2 . 30380 1
105 . 1 1 11 11 DPN HE2 H 1 7.252 0.002 . . . . . . A 11 DPN HE2 . 30380 1
106 . 1 1 12 12 ARG H H 1 7.838 0.003 . . . . . . A 12 ARG H . 30380 1
107 . 1 1 12 12 ARG HA H 1 3.954 0.004 . . . . . . A 12 ARG HA . 30380 1
108 . 1 1 12 12 ARG HB2 H 1 1.264 0.007 . . . . . . A 12 ARG HB2 . 30380 1
109 . 1 1 12 12 ARG HB3 H 1 0.795 0.006 . . . . . . A 12 ARG HB3 . 30380 1
110 . 1 1 12 12 ARG HG2 H 1 0.602 0.007 . . . . . . A 12 ARG HG2 . 30380 1
111 . 1 1 12 12 ARG HG3 H 1 0.457 0.002 . . . . . . A 12 ARG HG3 . 30380 1
112 . 1 1 12 12 ARG HD2 H 1 2.702 0.003 . . . . . . A 12 ARG HD2 . 30380 1
113 . 1 1 12 12 ARG HD3 H 1 2.702 0.003 . . . . . . A 12 ARG HD3 . 30380 1
114 . 1 1 12 12 ARG HE H 1 6.820 0.002 . . . . . . A 12 ARG HE . 30380 1
115 . 1 1 12 12 ARG CA C 13 55.464 0.000 . . . . . . A 12 ARG CA . 30380 1
116 . 1 1 12 12 ARG CB C 13 29.804 0.014 . . . . . . A 12 ARG CB . 30380 1
117 . 1 1 12 12 ARG CG C 13 26.211 0.014 . . . . . . A 12 ARG CG . 30380 1
118 . 1 1 12 12 ARG CD C 13 42.995 0.000 . . . . . . A 12 ARG CD . 30380 1
119 . 1 1 12 12 ARG N N 15 122.057 0.000 . . . . . . A 12 ARG N . 30380 1
120 . 1 1 12 12 ARG NE N 15 119.932 0.000 . . . . . . A 12 ARG NE . 30380 1
121 . 1 1 13 13 TRP H H 1 7.911 0.003 . . . . . . A 13 TRP H . 30380 1
122 . 1 1 13 13 TRP HA H 1 4.640 0.006 . . . . . . A 13 TRP HA . 30380 1
123 . 1 1 13 13 TRP HB2 H 1 3.347 0.003 . . . . . . A 13 TRP HB2 . 30380 1
124 . 1 1 13 13 TRP HB3 H 1 3.256 0.004 . . . . . . A 13 TRP HB3 . 30380 1
125 . 1 1 13 13 TRP HD1 H 1 7.209 0.003 . . . . . . A 13 TRP HD1 . 30380 1
126 . 1 1 13 13 TRP HE1 H 1 10.079 0.002 . . . . . . A 13 TRP HE1 . 30380 1
127 . 1 1 13 13 TRP HE3 H 1 7.641 0.002 . . . . . . A 13 TRP HE3 . 30380 1
128 . 1 1 13 13 TRP HZ2 H 1 7.413 0.005 . . . . . . A 13 TRP HZ2 . 30380 1
129 . 1 1 13 13 TRP HZ3 H 1 7.086 0.001 . . . . . . A 13 TRP HZ3 . 30380 1
130 . 1 1 13 13 TRP HH2 H 1 7.165 0.001 . . . . . . A 13 TRP HH2 . 30380 1
131 . 1 1 13 13 TRP CA C 13 57.219 0.000 . . . . . . A 13 TRP CA . 30380 1
132 . 1 1 13 13 TRP CB C 13 29.982 0.000 . . . . . . A 13 TRP CB . 30380 1
133 . 1 1 13 13 TRP N N 15 119.870 0.000 . . . . . . A 13 TRP N . 30380 1
134 . 1 1 13 13 TRP NE1 N 15 129.110 0.000 . . . . . . A 13 TRP NE1 . 30380 1
135 . 1 1 14 14 ARG H H 1 8.171 0.006 . . . . . . A 14 ARG H . 30380 1
136 . 1 1 14 14 ARG HA H 1 4.175 0.003 . . . . . . A 14 ARG HA . 30380 1
137 . 1 1 14 14 ARG HB2 H 1 1.753 0.005 . . . . . . A 14 ARG HB2 . 30380 1
138 . 1 1 14 14 ARG HB3 H 1 1.646 0.005 . . . . . . A 14 ARG HB3 . 30380 1
139 . 1 1 14 14 ARG HG2 H 1 1.491 0.004 . . . . . . A 14 ARG HG2 . 30380 1
140 . 1 1 14 14 ARG HG3 H 1 1.491 0.004 . . . . . . A 14 ARG HG3 . 30380 1
141 . 1 1 14 14 ARG HD2 H 1 3.046 0.006 . . . . . . A 14 ARG HD2 . 30380 1
142 . 1 1 14 14 ARG HD3 H 1 3.046 0.006 . . . . . . A 14 ARG HD3 . 30380 1
143 . 1 1 14 14 ARG HE H 1 7.034 0.004 . . . . . . A 14 ARG HE . 30380 1
144 . 1 1 14 14 ARG CA C 13 56.232 0.000 . . . . . . A 14 ARG CA . 30380 1
145 . 1 1 14 14 ARG CB C 13 29.626 0.000 . . . . . . A 14 ARG CB . 30380 1
146 . 1 1 14 14 ARG CG C 13 26.910 0.000 . . . . . . A 14 ARG CG . 30380 1
147 . 1 1 14 14 ARG CD C 13 43.462 0.000 . . . . . . A 14 ARG CD . 30380 1
148 . 1 1 14 14 ARG N N 15 119.870 0.000 . . . . . . A 14 ARG N . 30380 1
149 . 1 1 14 14 ARG NE N 15 119.762 0.000 . . . . . . A 14 ARG NE . 30380 1
stop_
save_