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 30562
_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' . . . 30562 1
2 '2D 1H-1H TOCSY' . . . 30562 1
3 '2D 1H-15N HSQC' . . . 30562 1
4 '2D 1H-13C HSQC' . . . 30562 1
5 '2D 1H-1H COSY' . . . 30562 1
6 '2D 1H-13C HSQC' . . . 30562 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 GLY H H 1 8.378 0.003 . . . . . . A 1 GLY H1 . 30562 1
2 . 1 1 1 1 GLY HA2 H 1 4.212 0.008 . . . . . . A 1 GLY HA2 . 30562 1
3 . 1 1 1 1 GLY HA3 H 1 3.833 0.011 . . . . . . A 1 GLY HA3 . 30562 1
4 . 1 1 1 1 GLY CA C 13 42.343 0.015 . . . . . . A 1 GLY CA . 30562 1
5 . 1 1 1 1 GLY N N 15 108.126 0.000 . . . . . . A 1 GLY N . 30562 1
6 . 1 1 2 2 PHE H H 1 7.979 0.003 . . . . . . A 2 PHE H . 30562 1
7 . 1 1 2 2 PHE HA H 1 4.642 0.003 . . . . . . A 2 PHE HA . 30562 1
8 . 1 1 2 2 PHE HB2 H 1 3.145 0.012 . . . . . . A 2 PHE HB2 . 30562 1
9 . 1 1 2 2 PHE HB3 H 1 3.145 0.012 . . . . . . A 2 PHE HB3 . 30562 1
10 . 1 1 2 2 PHE HD1 H 1 7.100 0.004 . . . . . . A 2 PHE HD1 . 30562 1
11 . 1 1 2 2 PHE HD2 H 1 7.100 0.004 . . . . . . A 2 PHE HD2 . 30562 1
12 . 1 1 2 2 PHE HE1 H 1 6.959 0.003 . . . . . . A 2 PHE HE1 . 30562 1
13 . 1 1 2 2 PHE HE2 H 1 6.959 0.003 . . . . . . A 2 PHE HE2 . 30562 1
14 . 1 1 2 2 PHE HZ H 1 7.208 0.000 . . . . . . A 2 PHE HZ . 30562 1
15 . 1 1 2 2 PHE CA C 13 55.386 0.000 . . . . . . A 2 PHE CA . 30562 1
16 . 1 1 2 2 PHE CB C 13 36.986 0.000 . . . . . . A 2 PHE CB . 30562 1
17 . 1 1 2 2 PHE N N 15 121.450 0.000 . . . . . . A 2 PHE N . 30562 1
18 . 1 1 3 3 CYS H H 1 8.143 0.003 . . . . . . A 3 CYS H . 30562 1
19 . 1 1 3 3 CYS HA H 1 5.226 0.019 . . . . . . A 3 CYS HA . 30562 1
20 . 1 1 3 3 CYS HB2 H 1 2.820 0.004 . . . . . . A 3 CYS HB2 . 30562 1
21 . 1 1 3 3 CYS HB3 H 1 2.897 0.003 . . . . . . A 3 CYS HB3 . 30562 1
22 . 1 1 3 3 CYS CA C 13 53.226 0.000 . . . . . . A 3 CYS CA . 30562 1
23 . 1 1 3 3 CYS CB C 13 44.043 0.000 . . . . . . A 3 CYS CB . 30562 1
24 . 1 1 3 3 CYS N N 15 122.328 0.000 . . . . . . A 3 CYS N . 30562 1
25 . 1 1 4 4 HIS H H 1 8.840 0.001 . . . . . . A 4 HIS H . 30562 1
26 . 1 1 4 4 HIS HA H 1 4.685 0.005 . . . . . . A 4 HIS HA . 30562 1
27 . 1 1 4 4 HIS HB2 H 1 3.337 0.005 . . . . . . A 4 HIS HB2 . 30562 1
28 . 1 1 4 4 HIS HB3 H 1 3.337 0.005 . . . . . . A 4 HIS HB3 . 30562 1
29 . 1 1 4 4 HIS CA C 13 52.118 0.000 . . . . . . A 4 HIS CA . 30562 1
30 . 1 1 4 4 HIS CB C 13 27.118 0.000 . . . . . . A 4 HIS CB . 30562 1
31 . 1 1 4 4 HIS N N 15 120.664 0.000 . . . . . . A 4 HIS N . 30562 1
32 . 1 1 5 5 ARG H H 1 8.574 0.001 . . . . . . A 5 ARG H . 30562 1
33 . 1 1 5 5 ARG HA H 1 4.301 0.011 . . . . . . A 5 ARG HA . 30562 1
34 . 1 1 5 5 ARG HB2 H 1 1.711 0.006 . . . . . . A 5 ARG HB2 . 30562 1
35 . 1 1 5 5 ARG HB3 H 1 1.897 0.003 . . . . . . A 5 ARG HB3 . 30562 1
36 . 1 1 5 5 ARG HG2 H 1 1.544 0.005 . . . . . . A 5 ARG HG2 . 30562 1
37 . 1 1 5 5 ARG HG3 H 1 1.647 0.006 . . . . . . A 5 ARG HG3 . 30562 1
38 . 1 1 5 5 ARG HD2 H 1 3.172 0.003 . . . . . . A 5 ARG HD2 . 30562 1
39 . 1 1 5 5 ARG HD3 H 1 3.172 0.003 . . . . . . A 5 ARG HD3 . 30562 1
40 . 1 1 5 5 ARG HE H 1 7.175 0.003 . . . . . . A 5 ARG HE . 30562 1
41 . 1 1 5 5 ARG CA C 13 54.050 0.000 . . . . . . A 5 ARG CA . 30562 1
42 . 1 1 5 5 ARG CB C 13 27.417 0.021 . . . . . . A 5 ARG CB . 30562 1
43 . 1 1 5 5 ARG CG C 13 24.730 0.010 . . . . . . A 5 ARG CG . 30562 1
44 . 1 1 5 5 ARG CD C 13 40.636 0.000 . . . . . . A 5 ARG CD . 30562 1
45 . 1 1 5 5 ARG N N 15 123.683 0.000 . . . . . . A 5 ARG N . 30562 1
46 . 1 1 5 5 ARG NE N 15 124.717 0.000 . . . . . . A 5 ARG NE . 30562 1
47 . 1 1 6 6 SER H H 1 7.565 0.003 . . . . . . A 6 SER H . 30562 1
48 . 1 1 6 6 SER HA H 1 4.362 0.006 . . . . . . A 6 SER HA . 30562 1
49 . 1 1 6 6 SER HB2 H 1 3.756 0.002 . . . . . . A 6 SER HB2 . 30562 1
50 . 1 1 6 6 SER HB3 H 1 3.875 0.003 . . . . . . A 6 SER HB3 . 30562 1
51 . 1 1 6 6 SER CA C 13 55.265 0.000 . . . . . . A 6 SER CA . 30562 1
52 . 1 1 6 6 SER CB C 13 61.514 0.024 . . . . . . A 6 SER CB . 30562 1
53 . 1 1 6 6 SER N N 15 115.194 0.000 . . . . . . A 6 SER N . 30562 1
54 . 1 1 7 7 TYR H H 1 8.277 0.002 . . . . . . A 7 TYR H . 30562 1
55 . 1 1 7 7 TYR HA H 1 4.448 0.014 . . . . . . A 7 TYR HA . 30562 1
56 . 1 1 7 7 TYR HB2 H 1 2.940 0.002 . . . . . . A 7 TYR HB2 . 30562 1
57 . 1 1 7 7 TYR HB3 H 1 2.995 0.003 . . . . . . A 7 TYR HB3 . 30562 1
58 . 1 1 7 7 TYR HD1 H 1 7.178 0.001 . . . . . . A 7 TYR HD1 . 30562 1
59 . 1 1 7 7 TYR HD2 H 1 7.178 0.001 . . . . . . A 7 TYR HD2 . 30562 1
60 . 1 1 7 7 TYR HE1 H 1 6.904 0.002 . . . . . . A 7 TYR HE1 . 30562 1
61 . 1 1 7 7 TYR HE2 H 1 6.904 0.002 . . . . . . A 7 TYR HE2 . 30562 1
62 . 1 1 7 7 TYR CA C 13 53.776 0.000 . . . . . . A 7 TYR CA . 30562 1
63 . 1 1 7 7 TYR CB C 13 37.289 0.054 . . . . . . A 7 TYR CB . 30562 1
64 . 1 1 7 7 TYR N N 15 119.853 0.000 . . . . . . A 7 TYR N . 30562 1
65 . 1 1 8 8 PRO HA H 1 4.108 0.001 . . . . . . A 8 PRO HA . 30562 1
66 . 1 1 8 8 PRO HB2 H 1 1.874 0.006 . . . . . . A 8 PRO HB2 . 30562 1
67 . 1 1 8 8 PRO HB3 H 1 1.921 0.002 . . . . . . A 8 PRO HB3 . 30562 1
68 . 1 1 8 8 PRO HG2 H 1 1.717 0.004 . . . . . . A 8 PRO HG2 . 30562 1
69 . 1 1 8 8 PRO HG3 H 1 1.868 0.006 . . . . . . A 8 PRO HG3 . 30562 1
70 . 1 1 8 8 PRO HD2 H 1 3.428 0.013 . . . . . . A 8 PRO HD2 . 30562 1
71 . 1 1 8 8 PRO HD3 H 1 3.461 0.009 . . . . . . A 8 PRO HD3 . 30562 1
72 . 1 1 8 8 PRO CA C 13 58.606 0.000 . . . . . . A 8 PRO CA . 30562 1
73 . 1 1 8 8 PRO CB C 13 29.894 0.000 . . . . . . A 8 PRO CB . 30562 1
74 . 1 1 8 8 PRO CG C 13 22.139 0.015 . . . . . . A 8 PRO CG . 30562 1
75 . 1 1 8 8 PRO CD C 13 47.483 0.005 . . . . . . A 8 PRO CD . 30562 1
76 . 1 1 9 9 PRO HA H 1 4.525 0.003 . . . . . . A 9 PRO HA . 30562 1
77 . 1 1 9 9 PRO HB2 H 1 1.937 0.005 . . . . . . A 9 PRO HB2 . 30562 1
78 . 1 1 9 9 PRO HB3 H 1 2.177 0.005 . . . . . . A 9 PRO HB3 . 30562 1
79 . 1 1 9 9 PRO HG2 H 1 2.076 0.011 . . . . . . A 9 PRO HG2 . 30562 1
80 . 1 1 9 9 PRO HG3 H 1 2.186 0.016 . . . . . . A 9 PRO HG3 . 30562 1
81 . 1 1 9 9 PRO HD2 H 1 3.600 0.010 . . . . . . A 9 PRO HD2 . 30562 1
82 . 1 1 9 9 PRO HD3 H 1 3.630 0.004 . . . . . . A 9 PRO HD3 . 30562 1
83 . 1 1 9 9 PRO CA C 13 60.953 0.000 . . . . . . A 9 PRO CA . 30562 1
84 . 1 1 9 9 PRO CB C 13 29.257 0.071 . . . . . . A 9 PRO CB . 30562 1
85 . 1 1 9 9 PRO CG C 13 25.005 0.007 . . . . . . A 9 PRO CG . 30562 1
86 . 1 1 9 9 PRO CD C 13 47.888 0.006 . . . . . . A 9 PRO CD . 30562 1
87 . 1 1 10 10 GLU H H 1 8.026 0.002 . . . . . . A 10 GLU H . 30562 1
88 . 1 1 10 10 GLU HA H 1 4.346 0.004 . . . . . . A 10 GLU HA . 30562 1
89 . 1 1 10 10 GLU HB2 H 1 1.789 0.004 . . . . . . A 10 GLU HB2 . 30562 1
90 . 1 1 10 10 GLU HB3 H 1 1.789 0.003 . . . . . . A 10 GLU HB3 . 30562 1
91 . 1 1 10 10 GLU HG2 H 1 1.903 0.009 . . . . . . A 10 GLU HG2 . 30562 1
92 . 1 1 10 10 GLU HG3 H 1 2.123 0.006 . . . . . . A 10 GLU HG3 . 30562 1
93 . 1 1 10 10 GLU CA C 13 52.754 0.000 . . . . . . A 10 GLU CA . 30562 1
94 . 1 1 10 10 GLU CB C 13 28.105 0.000 . . . . . . A 10 GLU CB . 30562 1
95 . 1 1 10 10 GLU CG C 13 31.459 0.030 . . . . . . A 10 GLU CG . 30562 1
96 . 1 1 10 10 GLU N N 15 121.665 0.000 . . . . . . A 10 GLU N . 30562 1
97 . 1 1 11 11 CYS H H 1 8.510 0.002 . . . . . . A 11 CYS H . 30562 1
98 . 1 1 11 11 CYS HA H 1 5.262 0.008 . . . . . . A 11 CYS HA . 30562 1
99 . 1 1 11 11 CYS HB2 H 1 2.950 0.009 . . . . . . A 11 CYS HB2 . 30562 1
100 . 1 1 11 11 CYS HB3 H 1 2.950 0.009 . . . . . . A 11 CYS HB3 . 30562 1
101 . 1 1 11 11 CYS CA C 13 53.334 0.000 . . . . . . A 11 CYS CA . 30562 1
102 . 1 1 11 11 CYS CB C 13 44.185 0.000 . . . . . . A 11 CYS CB . 30562 1
103 . 1 1 11 11 CYS N N 15 121.596 0.000 . . . . . . A 11 CYS N . 30562 1
104 . 1 1 12 12 TRP H H 1 8.937 0.004 . . . . . . A 12 TRP H . 30562 1
105 . 1 1 12 12 TRP HA H 1 5.034 0.003 . . . . . . A 12 TRP HA . 30562 1
106 . 1 1 12 12 TRP HB2 H 1 3.499 0.002 . . . . . . A 12 TRP HB2 . 30562 1
107 . 1 1 12 12 TRP HB3 H 1 3.499 0.002 . . . . . . A 12 TRP HB3 . 30562 1
108 . 1 1 12 12 TRP HD1 H 1 7.343 0.001 . . . . . . A 12 TRP HD1 . 30562 1
109 . 1 1 12 12 TRP HE1 H 1 10.183 0.004 . . . . . . A 12 TRP HE1 . 30562 1
110 . 1 1 12 12 TRP HE3 H 1 7.841 0.005 . . . . . . A 12 TRP HE3 . 30562 1
111 . 1 1 12 12 TRP HZ2 H 1 7.433 0.000 . . . . . . A 12 TRP HZ2 . 30562 1
112 . 1 1 12 12 TRP HZ3 H 1 6.957 0.001 . . . . . . A 12 TRP HZ3 . 30562 1
113 . 1 1 12 12 TRP HH2 H 1 7.107 0.002 . . . . . . A 12 TRP HH2 . 30562 1
114 . 1 1 12 12 TRP CA C 13 53.648 0.000 . . . . . . A 12 TRP CA . 30562 1
115 . 1 1 12 12 TRP CB C 13 27.407 0.000 . . . . . . A 12 TRP CB . 30562 1
116 . 1 1 12 12 TRP N N 15 124.764 0.000 . . . . . . A 12 TRP N . 30562 1
117 . 1 1 12 12 TRP NE1 N 15 129.139 0.000 . . . . . . A 12 TRP NE1 . 30562 1
118 . 1 1 13 13 PRO HA H 1 4.444 0.003 . . . . . . A 13 PRO HA . 30562 1
119 . 1 1 13 13 PRO HB2 H 1 2.038 0.008 . . . . . . A 13 PRO HB2 . 30562 1
120 . 1 1 13 13 PRO HB3 H 1 2.459 0.006 . . . . . . A 13 PRO HB3 . 30562 1
121 . 1 1 13 13 PRO HG2 H 1 2.096 0.007 . . . . . . A 13 PRO HG2 . 30562 1
122 . 1 1 13 13 PRO HG3 H 1 2.199 0.005 . . . . . . A 13 PRO HG3 . 30562 1
123 . 1 1 13 13 PRO HD2 H 1 4.021 0.008 . . . . . . A 13 PRO HD2 . 30562 1
124 . 1 1 13 13 PRO HD3 H 1 4.023 0.008 . . . . . . A 13 PRO HD3 . 30562 1
125 . 1 1 13 13 PRO CA C 13 62.532 0.000 . . . . . . A 13 PRO CA . 30562 1
126 . 1 1 13 13 PRO CB C 13 29.111 0.064 . . . . . . A 13 PRO CB . 30562 1
127 . 1 1 13 13 PRO CG C 13 25.005 0.007 . . . . . . A 13 PRO CG . 30562 1
128 . 1 1 13 13 PRO CD C 13 48.729 0.000 . . . . . . A 13 PRO CD . 30562 1
129 . 1 1 14 14 ASN H H 1 7.995 0.003 . . . . . . A 14 ASN H . 30562 1
130 . 1 1 14 14 ASN HA H 1 4.607 0.005 . . . . . . A 14 ASN HA . 30562 1
131 . 1 1 14 14 ASN HB2 H 1 2.946 0.012 . . . . . . A 14 ASN HB2 . 30562 1
132 . 1 1 14 14 ASN HB3 H 1 3.200 0.018 . . . . . . A 14 ASN HB3 . 30562 1
133 . 1 1 14 14 ASN HD21 H 1 7.475 0.005 . . . . . . A 14 ASN HD21 . 30562 1
134 . 1 1 14 14 ASN HD22 H 1 6.662 0.006 . . . . . . A 14 ASN HD22 . 30562 1
135 . 1 1 14 14 ASN CA C 13 50.470 0.000 . . . . . . A 14 ASN CA . 30562 1
136 . 1 1 14 14 ASN CB C 13 34.701 0.012 . . . . . . A 14 ASN CB . 30562 1
137 . 1 1 14 14 ASN N N 15 114.090 0.000 . . . . . . A 14 ASN N . 30562 1
138 . 1 1 14 14 ASN ND2 N 15 109.715 0.022 . . . . . . A 14 ASN ND2 . 30562 1
stop_
save_