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 30731
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name .
_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 '3D NCACX' . . . 30731 1
2 '3D NCOCX' . . . 30731 1
3 '3D CANCX' . . . 30731 1
4 '3D CONCX' . . . 30731 1
5 '2D 13C-13C' . . . 30731 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_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 16 16 LYS C C 13 174.019 0.000 . 1 . . . . 1 16 LYS C . 30731 1
2 . 1 . 1 16 16 LYS CA C 13 54.258 0.058 . 1 . . . . 1 16 LYS CA . 30731 1
3 . 1 . 1 16 16 LYS CB C 13 34.714 0.000 . 1 . . . . 1 16 LYS CB . 30731 1
4 . 1 . 1 16 16 LYS N N 15 123.543 0.000 . 1 . . . . 1 16 LYS N . 30731 1
5 . 1 . 1 17 17 LEU C C 13 175.031 0.043 . 1 . . . . 1 17 LEU C . 30731 1
6 . 1 . 1 17 17 LEU CA C 13 54.772 0.186 . 1 . . . . 1 17 LEU CA . 30731 1
7 . 1 . 1 17 17 LEU CB C 13 44.557 0.204 . 1 . . . . 1 17 LEU CB . 30731 1
8 . 1 . 1 17 17 LEU CG C 13 29.964 0.159 . 1 . . . . 1 17 LEU CG . 30731 1
9 . 1 . 1 17 17 LEU N N 15 126.535 0.213 . 1 . . . . 1 17 LEU N . 30731 1
10 . 1 . 1 18 18 VAL C C 13 173.027 0.176 . 1 . . . . 1 18 VAL C . 30731 1
11 . 1 . 1 18 18 VAL CA C 13 60.170 0.180 . 1 . . . . 1 18 VAL CA . 30731 1
12 . 1 . 1 18 18 VAL CB C 13 35.067 0.239 . 1 . . . . 1 18 VAL CB . 30731 1
13 . 1 . 1 18 18 VAL CG1 C 13 20.830 0.217 . 2 . . . . 1 18 VAL CG1 . 30731 1
14 . 1 . 1 18 18 VAL N N 15 121.017 0.187 . 1 . . . . 1 18 VAL N . 30731 1
15 . 1 . 1 19 19 PHE C C 13 173.201 0.134 . 1 . . . . 1 19 PHE C . 30731 1
16 . 1 . 1 19 19 PHE CA C 13 55.665 0.175 . 1 . . . . 1 19 PHE CA . 30731 1
17 . 1 . 1 19 19 PHE CB C 13 40.848 0.194 . 1 . . . . 1 19 PHE CB . 30731 1
18 . 1 . 1 19 19 PHE N N 15 125.695 0.216 . 1 . . . . 1 19 PHE N . 30731 1
19 . 1 . 1 20 20 PHE C C 13 172.383 0.074 . 1 . . . . 1 20 PHE C . 30731 1
20 . 1 . 1 20 20 PHE CA C 13 56.032 0.148 . 1 . . . . 1 20 PHE CA . 30731 1
21 . 1 . 1 20 20 PHE CB C 13 43.334 0.056 . 1 . . . . 1 20 PHE CB . 30731 1
22 . 1 . 1 20 20 PHE N N 15 127.004 0.013 . 1 . . . . 1 20 PHE N . 30731 1
23 . 1 . 1 21 21 ALA C C 13 174.957 0.106 . 1 . . . . 1 21 ALA C . 30731 1
24 . 1 . 1 21 21 ALA CA C 13 49.654 0.092 . 1 . . . . 1 21 ALA CA . 30731 1
25 . 1 . 1 21 21 ALA CB C 13 23.025 0.081 . 1 . . . . 1 21 ALA CB . 30731 1
26 . 1 . 1 21 21 ALA N N 15 128.943 0.177 . 1 . . . . 1 21 ALA N . 30731 1
27 . 1 . 1 22 22 GLU C C 13 175.451 0.181 . 1 . . . . 1 22 GLU C . 30731 1
28 . 1 . 1 22 22 GLU CA C 13 53.034 0.116 . 1 . . . . 1 22 GLU CA . 30731 1
29 . 1 . 1 22 22 GLU CB C 13 33.639 0.189 . 1 . . . . 1 22 GLU CB . 30731 1
30 . 1 . 1 22 22 GLU CG C 13 35.812 0.023 . 1 . . . . 1 22 GLU CG . 30731 1
31 . 1 . 1 22 22 GLU CD C 13 181.720 0.307 . 1 . . . . 1 22 GLU CD . 30731 1
32 . 1 . 1 22 22 GLU N N 15 119.856 0.158 . 1 . . . . 1 22 GLU N . 30731 1
33 . 1 . 1 23 23 ASP C C 13 174.400 0.111 . 1 . . . . 1 23 ASP C . 30731 1
34 . 1 . 1 23 23 ASP CA C 13 54.034 0.065 . 1 . . . . 1 23 ASP CA . 30731 1
35 . 1 . 1 23 23 ASP CB C 13 37.410 0.207 . 1 . . . . 1 23 ASP CB . 30731 1
36 . 1 . 1 23 23 ASP CG C 13 181.537 0.058 . 1 . . . . 1 23 ASP CG . 30731 1
37 . 1 . 1 23 23 ASP N N 15 123.937 0.101 . 1 . . . . 1 23 ASP N . 30731 1
38 . 1 . 1 24 24 VAL C C 13 175.293 0.193 . 1 . . . . 1 24 VAL C . 30731 1
39 . 1 . 1 24 24 VAL CA C 13 59.783 0.128 . 1 . . . . 1 24 VAL CA . 30731 1
40 . 1 . 1 24 24 VAL CB C 13 34.828 0.143 . 1 . . . . 1 24 VAL CB . 30731 1
41 . 1 . 1 24 24 VAL CG1 C 13 20.828 0.247 . 2 . . . . 1 24 VAL CG1 . 30731 1
42 . 1 . 1 24 24 VAL CG2 C 13 20.197 0.000 . 2 . . . . 1 24 VAL CG2 . 30731 1
43 . 1 . 1 24 24 VAL N N 15 121.732 0.283 . 1 . . . . 1 24 VAL N . 30731 1
44 . 1 . 1 25 25 GLY C C 13 174.266 0.015 . 1 . . . . 1 25 GLY C . 30731 1
45 . 1 . 1 25 25 GLY CA C 13 47.298 0.165 . 1 . . . . 1 25 GLY CA . 30731 1
46 . 1 . 1 25 25 GLY N N 15 115.637 0.223 . 1 . . . . 1 25 GLY N . 30731 1
47 . 1 . 1 27 27 ASN C C 13 174.153 0.000 . 1 . . . . 1 27 ASN C . 30731 1
48 . 1 . 1 27 27 ASN CA C 13 55.389 0.046 . 1 . . . . 1 27 ASN CA . 30731 1
49 . 1 . 1 28 28 LYS C C 13 174.387 0.267 . 1 . . . . 1 28 LYS C . 30731 1
50 . 1 . 1 28 28 LYS CA C 13 55.425 0.143 . 1 . . . . 1 28 LYS CA . 30731 1
51 . 1 . 1 28 28 LYS CB C 13 35.340 0.149 . 1 . . . . 1 28 LYS CB . 30731 1
52 . 1 . 1 28 28 LYS CG C 13 26.301 0.051 . 1 . . . . 1 28 LYS CG . 30731 1
53 . 1 . 1 28 28 LYS CD C 13 29.373 0.023 . 1 . . . . 1 28 LYS CD . 30731 1
54 . 1 . 1 28 28 LYS CE C 13 41.905 0.000 . 1 . . . . 1 28 LYS CE . 30731 1
55 . 1 . 1 28 28 LYS N N 15 125.061 0.116 . 1 . . . . 1 28 LYS N . 30731 1
56 . 1 . 1 29 29 GLY C C 13 171.968 0.175 . 1 . . . . 1 29 GLY C . 30731 1
57 . 1 . 1 29 29 GLY CA C 13 43.175 0.161 . 1 . . . . 1 29 GLY CA . 30731 1
58 . 1 . 1 29 29 GLY N N 15 108.258 0.246 . 1 . . . . 1 29 GLY N . 30731 1
59 . 1 . 1 30 30 ALA C C 13 175.066 0.209 . 1 . . . . 1 30 ALA C . 30731 1
60 . 1 . 1 30 30 ALA CA C 13 49.758 0.088 . 1 . . . . 1 30 ALA CA . 30731 1
61 . 1 . 1 30 30 ALA CB C 13 21.539 0.136 . 1 . . . . 1 30 ALA CB . 30731 1
62 . 1 . 1 30 30 ALA N N 15 127.420 0.270 . 1 . . . . 1 30 ALA N . 30731 1
63 . 1 . 1 31 31 ILE C C 13 174.224 0.158 . 1 . . . . 1 31 ILE C . 30731 1
64 . 1 . 1 31 31 ILE CA C 13 60.841 0.090 . 1 . . . . 1 31 ILE CA . 30731 1
65 . 1 . 1 31 31 ILE CB C 13 40.036 0.116 . 1 . . . . 1 31 ILE CB . 30731 1
66 . 1 . 1 31 31 ILE CG1 C 13 27.970 0.067 . 1 . . . . 1 31 ILE CG1 . 30731 1
67 . 1 . 1 31 31 ILE CG2 C 13 19.002 0.170 . 1 . . . . 1 31 ILE CG2 . 30731 1
68 . 1 . 1 31 31 ILE CD1 C 13 13.505 0.085 . 1 . . . . 1 31 ILE CD1 . 30731 1
69 . 1 . 1 31 31 ILE N N 15 124.934 0.140 . 1 . . . . 1 31 ILE N . 30731 1
70 . 1 . 1 32 32 ILE C C 13 176.151 0.115 . 1 . . . . 1 32 ILE C . 30731 1
71 . 1 . 1 32 32 ILE CA C 13 57.337 0.101 . 1 . . . . 1 32 ILE CA . 30731 1
72 . 1 . 1 32 32 ILE CB C 13 42.325 0.125 . 1 . . . . 1 32 ILE CB . 30731 1
73 . 1 . 1 32 32 ILE CG1 C 13 26.604 0.123 . 1 . . . . 1 32 ILE CG1 . 30731 1
74 . 1 . 1 32 32 ILE CG2 C 13 17.038 0.085 . 1 . . . . 1 32 ILE CG2 . 30731 1
75 . 1 . 1 32 32 ILE CD1 C 13 13.733 0.049 . 1 . . . . 1 32 ILE CD1 . 30731 1
76 . 1 . 1 32 32 ILE N N 15 124.850 0.154 . 1 . . . . 1 32 ILE N . 30731 1
77 . 1 . 1 33 33 GLY C C 13 172.159 0.190 . 1 . . . . 1 33 GLY C . 30731 1
78 . 1 . 1 33 33 GLY CA C 13 48.690 0.086 . 1 . . . . 1 33 GLY CA . 30731 1
79 . 1 . 1 33 33 GLY N N 15 115.150 0.109 . 1 . . . . 1 33 GLY N . 30731 1
80 . 1 . 1 34 34 LEU C C 13 174.070 0.123 . 1 . . . . 1 34 LEU C . 30731 1
81 . 1 . 1 34 34 LEU CA C 13 53.280 0.164 . 1 . . . . 1 34 LEU CA . 30731 1
82 . 1 . 1 34 34 LEU CB C 13 45.796 0.124 . 1 . . . . 1 34 LEU CB . 30731 1
83 . 1 . 1 34 34 LEU CG C 13 27.869 0.046 . 1 . . . . 1 34 LEU CG . 30731 1
84 . 1 . 1 34 34 LEU CD1 C 13 25.139 0.081 . 2 . . . . 1 34 LEU CD1 . 30731 1
85 . 1 . 1 34 34 LEU N N 15 114.733 0.162 . 1 . . . . 1 34 LEU N . 30731 1
86 . 1 . 1 35 35 MET C C 13 173.860 0.125 . 1 . . . . 1 35 MET C . 30731 1
87 . 1 . 1 35 35 MET CA C 13 53.971 0.146 . 1 . . . . 1 35 MET CA . 30731 1
88 . 1 . 1 35 35 MET CB C 13 36.763 0.138 . 1 . . . . 1 35 MET CB . 30731 1
89 . 1 . 1 35 35 MET CG C 13 31.653 0.123 . 1 . . . . 1 35 MET CG . 30731 1
90 . 1 . 1 35 35 MET N N 15 121.592 0.302 . 1 . . . . 1 35 MET N . 30731 1
91 . 1 . 1 36 36 VAL C C 13 173.826 0.093 . 1 . . . . 1 36 VAL C . 30731 1
92 . 1 . 1 36 36 VAL CA C 13 59.367 0.184 . 1 . . . . 1 36 VAL CA . 30731 1
93 . 1 . 1 36 36 VAL CB C 13 36.022 0.100 . 1 . . . . 1 36 VAL CB . 30731 1
94 . 1 . 1 36 36 VAL CG1 C 13 20.586 0.169 . 2 . . . . 1 36 VAL CG1 . 30731 1
95 . 1 . 1 36 36 VAL N N 15 123.350 0.276 . 1 . . . . 1 36 VAL N . 30731 1
96 . 1 . 1 37 37 GLY C C 13 171.750 0.084 . 1 . . . . 1 37 GLY C . 30731 1
97 . 1 . 1 37 37 GLY CA C 13 44.350 0.113 . 1 . . . . 1 37 GLY CA . 30731 1
98 . 1 . 1 37 37 GLY N N 15 111.739 0.185 . 1 . . . . 1 37 GLY N . 30731 1
stop_
save_