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 30795
_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 '2D CC CORD' . . . 30795 1
2 '2D NCA/NCO SPEC-CP' . . . 30795 1
3 '3D NCACX/NCOCX/CONCA' . . . 30795 1
4 '1D/2D 13C-19F REDOR' . . . 30795 1
5 '2D 13C-19F SPEC-CP' . . . 30795 1
6 '2D NHHC' . . . 30795 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 2 2 THR CA C 13 63.56 0.000 . . . . . . A 9 THR CA . 30795 1
2 . 1 . 1 2 2 THR CB C 13 69.18 0.000 . . . . . . A 9 THR CB . 30795 1
3 . 1 . 1 3 3 GLY C C 13 174.71 0.000 . . . . . . A 10 GLY C . 30795 1
4 . 1 . 1 3 3 GLY CA C 13 46.78 0.042 . . . . . . A 10 GLY CA . 30795 1
5 . 1 . 1 3 3 GLY N N 15 110.69 0.000 . . . . . . A 10 GLY N . 30795 1
6 . 1 . 1 4 4 THR C C 13 175.42 0.000 . . . . . . A 11 THR C . 30795 1
7 . 1 . 1 4 4 THR CA C 13 64.47 0.179 . . . . . . A 11 THR CA . 30795 1
8 . 1 . 1 4 4 THR CB C 13 68.42 0.016 . . . . . . A 11 THR CB . 30795 1
9 . 1 . 1 4 4 THR CG2 C 13 22.41 0.000 . . . . . . A 11 THR CG2 . 30795 1
10 . 1 . 1 6 6 ILE C C 13 177.16 0.093 . . . . . . A 13 ILE C . 30795 1
11 . 1 . 1 6 6 ILE CA C 13 64.17 0.112 . . . . . . A 13 ILE CA . 30795 1
12 . 1 . 1 6 6 ILE CB C 13 37.41 0.045 . . . . . . A 13 ILE CB . 30795 1
13 . 1 . 1 6 6 ILE CG1 C 13 29.05 0.014 . . . . . . A 13 ILE CG1 . 30795 1
14 . 1 . 1 6 6 ILE CG2 C 13 17.89 0.000 . . . . . . A 13 ILE CG2 . 30795 1
15 . 1 . 1 6 6 ILE CD1 C 13 12.93 0.001 . . . . . . A 13 ILE CD1 . 30795 1
16 . 1 . 1 6 6 ILE N N 15 119.92 0.000 . . . . . . A 13 ILE N . 30795 1
17 . 1 . 1 7 7 VAL C C 13 176.74 0.116 . . . . . . A 14 VAL C . 30795 1
18 . 1 . 1 7 7 VAL CA C 13 66.86 0.094 . . . . . . A 14 VAL CA . 30795 1
19 . 1 . 1 7 7 VAL CB C 13 31.26 0.083 . . . . . . A 14 VAL CB . 30795 1
20 . 1 . 1 7 7 VAL CG1 C 13 23.31 0.068 . . . . . . A 14 VAL CG1 . 30795 1
21 . 1 . 1 7 7 VAL CG2 C 13 20.84 0.098 . . . . . . A 14 VAL CG2 . 30795 1
22 . 1 . 1 7 7 VAL N N 15 119.51 0.204 . . . . . . A 14 VAL N . 30795 1
23 . 1 . 1 8 8 ASN C C 13 177.40 0.032 . . . . . . A 15 ASN C . 30795 1
24 . 1 . 1 8 8 ASN CA C 13 56.00 0.092 . . . . . . A 15 ASN CA . 30795 1
25 . 1 . 1 8 8 ASN CB C 13 37.43 0.007 . . . . . . A 15 ASN CB . 30795 1
26 . 1 . 1 8 8 ASN CG C 13 174.22 0.035 . . . . . . A 15 ASN CG . 30795 1
27 . 1 . 1 8 8 ASN N N 15 117.07 0.159 . . . . . . A 15 ASN N . 30795 1
28 . 1 . 1 8 8 ASN ND2 N 15 107.66 0.000 . . . . . . A 15 ASN ND2 . 30795 1
29 . 1 . 1 9 9 SER C C 13 175.25 0.115 . . . . . . A 16 SER C . 30795 1
30 . 1 . 1 9 9 SER CA C 13 62.86 0.154 . . . . . . A 16 SER CA . 30795 1
31 . 1 . 1 9 9 SER CB C 13 63.00 0.045 . . . . . . A 16 SER CB . 30795 1
32 . 1 . 1 9 9 SER N N 15 116.35 0.101 . . . . . . A 16 SER N . 30795 1
33 . 1 . 1 10 10 VAL C C 13 177.42 0.128 . . . . . . A 17 VAL C . 30795 1
34 . 1 . 1 10 10 VAL CA C 13 66.66 0.102 . . . . . . A 17 VAL CA . 30795 1
35 . 1 . 1 10 10 VAL CB C 13 31.22 0.034 . . . . . . A 17 VAL CB . 30795 1
36 . 1 . 1 10 10 VAL CG1 C 13 23.37 0.033 . . . . . . A 17 VAL CG1 . 30795 1
37 . 1 . 1 10 10 VAL CG2 C 13 21.38 0.017 . . . . . . A 17 VAL CG2 . 30795 1
38 . 1 . 1 10 10 VAL N N 15 121.06 0.123 . . . . . . A 17 VAL N . 30795 1
39 . 1 . 1 11 11 LEU C C 13 178.68 0.047 . . . . . . A 18 LEU C . 30795 1
40 . 1 . 1 11 11 LEU CA C 13 57.59 0.114 . . . . . . A 18 LEU CA . 30795 1
41 . 1 . 1 11 11 LEU CB C 13 40.98 0.095 . . . . . . A 18 LEU CB . 30795 1
42 . 1 . 1 11 11 LEU CG C 13 26.80 0.000 . . . . . . A 18 LEU CG . 30795 1
43 . 1 . 1 11 11 LEU CD1 C 13 25.43 0.000 . . . . . . A 18 LEU CD1 . 30795 1
44 . 1 . 1 11 11 LEU CD2 C 13 20.27 0.079 . . . . . . A 18 LEU CD2 . 30795 1
45 . 1 . 1 11 11 LEU N N 15 118.65 0.158 . . . . . . A 18 LEU N . 30795 1
46 . 1 . 1 12 12 LEU C C 13 178.03 0.008 . . . . . . A 19 LEU C . 30795 1
47 . 1 . 1 12 12 LEU CA C 13 58.13 0.071 . . . . . . A 19 LEU CA . 30795 1
48 . 1 . 1 12 12 LEU CB C 13 41.89 0.020 . . . . . . A 19 LEU CB . 30795 1
49 . 1 . 1 12 12 LEU CG C 13 26.86 0.000 . . . . . . A 19 LEU CG . 30795 1
50 . 1 . 1 12 12 LEU N N 15 120.47 0.098 . . . . . . A 19 LEU N . 30795 1
51 . 1 . 1 13 13 PHE C C 13 176.50 0.071 . . . . . . A 20 PHE C . 30795 1
52 . 1 . 1 13 13 PHE CA C 13 61.47 0.067 . . . . . . A 20 PHE CA . 30795 1
53 . 1 . 1 13 13 PHE CB C 13 39.40 0.019 . . . . . . A 20 PHE CB . 30795 1
54 . 1 . 1 13 13 PHE CG C 13 138.40 0.000 . . . . . . A 20 PHE CG . 30795 1
55 . 1 . 1 13 13 PHE N N 15 118.84 0.127 . . . . . . A 20 PHE N . 30795 1
56 . 1 . 1 14 14 LEU C C 13 178.57 0.036 . . . . . . A 21 LEU C . 30795 1
57 . 1 . 1 14 14 LEU CA C 13 57.46 0.053 . . . . . . A 21 LEU CA . 30795 1
58 . 1 . 1 14 14 LEU CB C 13 42.76 0.027 . . . . . . A 21 LEU CB . 30795 1
59 . 1 . 1 14 14 LEU CG C 13 26.88 0.000 . . . . . . A 21 LEU CG . 30795 1
60 . 1 . 1 14 14 LEU CD1 C 13 25.62 0.000 . . . . . . A 21 LEU CD1 . 30795 1
61 . 1 . 1 14 14 LEU CD2 C 13 22.22 0.049 . . . . . . A 21 LEU CD2 . 30795 1
62 . 1 . 1 14 14 LEU N N 15 118.77 0.216 . . . . . . A 21 LEU N . 30795 1
63 . 1 . 1 15 15 ALA C C 13 178.50 0.141 . . . . . . A 22 ALA C . 30795 1
64 . 1 . 1 15 15 ALA CA C 13 55.92 0.059 . . . . . . A 22 ALA CA . 30795 1
65 . 1 . 1 15 15 ALA CB C 13 18.57 0.022 . . . . . . A 22 ALA CB . 30795 1
66 . 1 . 1 15 15 ALA N N 15 123.47 0.112 . . . . . . A 22 ALA N . 30795 1
67 . 1 . 1 16 16 PHE C C 13 176.30 0.180 . . . . . . A 23 PHE C . 30795 1
68 . 1 . 1 16 16 PHE CA C 13 61.43 0.076 . . . . . . A 23 PHE CA . 30795 1
69 . 1 . 1 16 16 PHE CB C 13 39.35 0.024 . . . . . . A 23 PHE CB . 30795 1
70 . 1 . 1 16 16 PHE CG C 13 139.24 0.133 . . . . . . A 23 PHE CG . 30795 1
71 . 1 . 1 16 16 PHE N N 15 118.92 0.139 . . . . . . A 23 PHE N . 30795 1
72 . 1 . 1 17 17 VAL C C 13 177.69 0.051 . . . . . . A 24 VAL C . 30795 1
73 . 1 . 1 17 17 VAL CA C 13 67.38 0.086 . . . . . . A 24 VAL CA . 30795 1
74 . 1 . 1 17 17 VAL CB C 13 31.68 0.059 . . . . . . A 24 VAL CB . 30795 1
75 . 1 . 1 17 17 VAL CG1 C 13 22.96 0.112 . . . . . . A 24 VAL CG1 . 30795 1
76 . 1 . 1 17 17 VAL CG2 C 13 20.79 0.047 . . . . . . A 24 VAL CG2 . 30795 1
77 . 1 . 1 17 17 VAL N N 15 118.31 0.186 . . . . . . A 24 VAL N . 30795 1
78 . 1 . 1 18 18 VAL C C 13 176.81 0.080 . . . . . . A 25 VAL C . 30795 1
79 . 1 . 1 18 18 VAL CA C 13 67.63 0.048 . . . . . . A 25 VAL CA . 30795 1
80 . 1 . 1 18 18 VAL CB C 13 31.11 0.087 . . . . . . A 25 VAL CB . 30795 1
81 . 1 . 1 18 18 VAL CG1 C 13 23.10 0.031 . . . . . . A 25 VAL CG1 . 30795 1
82 . 1 . 1 18 18 VAL CG2 C 13 21.57 0.024 . . . . . . A 25 VAL CG2 . 30795 1
83 . 1 . 1 18 18 VAL N N 15 118.92 0.117 . . . . . . A 25 VAL N . 30795 1
84 . 1 . 1 19 19 PHE C C 13 177.69 0.102 . . . . . . A 26 PHE C . 30795 1
85 . 1 . 1 19 19 PHE CA C 13 62.24 0.089 . . . . . . A 26 PHE CA . 30795 1
86 . 1 . 1 19 19 PHE CB C 13 39.05 0.054 . . . . . . A 26 PHE CB . 30795 1
87 . 1 . 1 19 19 PHE CG C 13 139.04 0.000 . . . . . . A 26 PHE CG . 30795 1
88 . 1 . 1 19 19 PHE N N 15 119.68 0.063 . . . . . . A 26 PHE N . 30795 1
89 . 1 . 1 20 20 LEU C C 13 177.88 0.106 . . . . . . A 27 LEU C . 30795 1
90 . 1 . 1 20 20 LEU CA C 13 57.62 0.059 . . . . . . A 27 LEU CA . 30795 1
91 . 1 . 1 20 20 LEU CB C 13 41.79 0.009 . . . . . . A 27 LEU CB . 30795 1
92 . 1 . 1 20 20 LEU CG C 13 27.54 0.000 . . . . . . A 27 LEU CG . 30795 1
93 . 1 . 1 20 20 LEU CD1 C 13 25.81 0.000 . . . . . . A 27 LEU CD1 . 30795 1
94 . 1 . 1 20 20 LEU CD2 C 13 20.60 0.039 . . . . . . A 27 LEU CD2 . 30795 1
95 . 1 . 1 20 20 LEU N N 15 120.78 0.122 . . . . . . A 27 LEU N . 30795 1
96 . 1 . 1 21 21 LEU C C 13 178.63 0.064 . . . . . . A 28 LEU C . 30795 1
97 . 1 . 1 21 21 LEU CA C 13 57.47 0.082 . . . . . . A 28 LEU CA . 30795 1
98 . 1 . 1 21 21 LEU CB C 13 41.15 0.075 . . . . . . A 28 LEU CB . 30795 1
99 . 1 . 1 21 21 LEU CG C 13 25.48 0.000 . . . . . . A 28 LEU CG . 30795 1
100 . 1 . 1 21 21 LEU CD1 C 13 25.42 0.000 . . . . . . A 28 LEU CD1 . 30795 1
101 . 1 . 1 21 21 LEU CD2 C 13 20.79 0.026 . . . . . . A 28 LEU CD2 . 30795 1
102 . 1 . 1 21 21 LEU N N 15 118.36 0.148 . . . . . . A 28 LEU N . 30795 1
103 . 1 . 1 22 22 VAL C C 13 176.98 0.051 . . . . . . A 29 VAL C . 30795 1
104 . 1 . 1 22 22 VAL CA C 13 66.29 0.072 . . . . . . A 29 VAL CA . 30795 1
105 . 1 . 1 22 22 VAL CB C 13 30.70 0.027 . . . . . . A 29 VAL CB . 30795 1
106 . 1 . 1 22 22 VAL CG1 C 13 24.21 0.032 . . . . . . A 29 VAL CG1 . 30795 1
107 . 1 . 1 22 22 VAL CG2 C 13 21.46 0.046 . . . . . . A 29 VAL CG2 . 30795 1
108 . 1 . 1 22 22 VAL N N 15 119.37 0.180 . . . . . . A 29 VAL N . 30795 1
109 . 1 . 1 23 23 THR C C 13 175.51 0.079 . . . . . . A 30 THR C . 30795 1
110 . 1 . 1 23 23 THR CA C 13 68.87 0.040 . . . . . . A 30 THR CA . 30795 1
111 . 1 . 1 23 23 THR CB C 13 66.39 0.041 . . . . . . A 30 THR CB . 30795 1
112 . 1 . 1 23 23 THR CG2 C 13 20.18 0.023 . . . . . . A 30 THR CG2 . 30795 1
113 . 1 . 1 23 23 THR N N 15 119.19 0.111 . . . . . . A 30 THR N . 30795 1
114 . 1 . 1 24 24 LEU C C 13 178.06 0.091 . . . . . . A 31 LEU C . 30795 1
115 . 1 . 1 24 24 LEU CA C 13 58.49 0.056 . . . . . . A 31 LEU CA . 30795 1
116 . 1 . 1 24 24 LEU CB C 13 41.43 0.051 . . . . . . A 31 LEU CB . 30795 1
117 . 1 . 1 24 24 LEU CG C 13 27.29 0.043 . . . . . . A 31 LEU CG . 30795 1
118 . 1 . 1 24 24 LEU CD1 C 13 27.25 0.008 . . . . . . A 31 LEU CD1 . 30795 1
119 . 1 . 1 24 24 LEU CD2 C 13 24.38 0.004 . . . . . . A 31 LEU CD2 . 30795 1
120 . 1 . 1 24 24 LEU N N 15 121.69 0.099 . . . . . . A 31 LEU N . 30795 1
121 . 1 . 1 25 25 ALA C C 13 178.98 0.035 . . . . . . A 32 ALA C . 30795 1
122 . 1 . 1 25 25 ALA CA C 13 55.33 0.056 . . . . . . A 32 ALA CA . 30795 1
123 . 1 . 1 25 25 ALA CB C 13 18.55 0.048 . . . . . . A 32 ALA CB . 30795 1
124 . 1 . 1 25 25 ALA N N 15 123.62 0.107 . . . . . . A 32 ALA N . 30795 1
125 . 1 . 1 26 26 ILE C C 13 176.97 0.058 . . . . . . A 33 ILE C . 30795 1
126 . 1 . 1 26 26 ILE CA C 13 65.67 0.064 . . . . . . A 33 ILE CA . 30795 1
127 . 1 . 1 26 26 ILE CB C 13 38.08 0.011 . . . . . . A 33 ILE CB . 30795 1
128 . 1 . 1 26 26 ILE CG1 C 13 31.00 0.000 . . . . . . A 33 ILE CG1 . 30795 1
129 . 1 . 1 26 26 ILE CG2 C 13 19.08 0.004 . . . . . . A 33 ILE CG2 . 30795 1
130 . 1 . 1 26 26 ILE CD1 C 13 14.28 0.055 . . . . . . A 33 ILE CD1 . 30795 1
131 . 1 . 1 26 26 ILE N N 15 117.29 0.097 . . . . . . A 33 ILE N . 30795 1
132 . 1 . 1 27 27 LEU C C 13 178.54 0.067 . . . . . . A 34 LEU C . 30795 1
133 . 1 . 1 27 27 LEU CA C 13 57.98 0.055 . . . . . . A 34 LEU CA . 30795 1
134 . 1 . 1 27 27 LEU CB C 13 40.79 0.044 . . . . . . A 34 LEU CB . 30795 1
135 . 1 . 1 27 27 LEU CG C 13 27.65 0.050 . . . . . . A 34 LEU CG . 30795 1
136 . 1 . 1 27 27 LEU CD1 C 13 27.60 0.033 . . . . . . A 34 LEU CD1 . 30795 1
137 . 1 . 1 27 27 LEU CD2 C 13 23.59 0.017 . . . . . . A 34 LEU CD2 . 30795 1
138 . 1 . 1 27 27 LEU N N 15 116.90 0.047 . . . . . . A 34 LEU N . 30795 1
139 . 1 . 1 28 28 THR C C 13 175.60 0.065 . . . . . . A 35 THR C . 30795 1
140 . 1 . 1 28 28 THR CA C 13 62.97 0.077 . . . . . . A 35 THR CA . 30795 1
141 . 1 . 1 28 28 THR CB C 13 69.50 0.089 . . . . . . A 35 THR CB . 30795 1
142 . 1 . 1 28 28 THR CG2 C 13 21.89 0.052 . . . . . . A 35 THR CG2 . 30795 1
143 . 1 . 1 28 28 THR N N 15 102.20 0.081 . . . . . . A 35 THR N . 30795 1
144 . 1 . 1 29 29 ALA C C 13 179.00 0.062 . . . . . . A 36 ALA C . 30795 1
145 . 1 . 1 29 29 ALA CA C 13 53.62 0.069 . . . . . . A 36 ALA CA . 30795 1
146 . 1 . 1 29 29 ALA CB C 13 19.68 0.035 . . . . . . A 36 ALA CB . 30795 1
147 . 1 . 1 29 29 ALA N N 15 123.08 0.078 . . . . . . A 36 ALA N . 30795 1
148 . 1 . 1 30 30 LEU C C 13 172.99 0.042 . . . . . . A 37 LEU C . 30795 1
149 . 1 . 1 30 30 LEU CA C 13 53.29 0.062 . . . . . . A 37 LEU CA . 30795 1
150 . 1 . 1 30 30 LEU CB C 13 38.57 0.070 . . . . . . A 37 LEU CB . 30795 1
151 . 1 . 1 30 30 LEU CG C 13 26.44 0.014 . . . . . . A 37 LEU CG . 30795 1
152 . 1 . 1 30 30 LEU CD1 C 13 25.20 0.046 . . . . . . A 37 LEU CD1 . 30795 1
153 . 1 . 1 30 30 LEU CD2 C 13 21.94 0.016 . . . . . . A 37 LEU CD2 . 30795 1
154 . 1 . 1 30 30 LEU N N 15 119.38 0.114 . . . . . . A 37 LEU N . 30795 1
155 . 1 . 1 31 31 ARG C C 13 180.93 0.000 . . . . . . A 38 ARG C . 30795 1
156 . 1 . 1 31 31 ARG CA C 13 53.87 0.058 . . . . . . A 38 ARG CA . 30795 1
157 . 1 . 1 31 31 ARG CB C 13 29.89 0.021 . . . . . . A 38 ARG CB . 30795 1
158 . 1 . 1 31 31 ARG CG C 13 25.55 0.000 . . . . . . A 38 ARG CG . 30795 1
159 . 1 . 1 31 31 ARG CD C 13 41.70 0.009 . . . . . . A 38 ARG CD . 30795 1
160 . 1 . 1 31 31 ARG CZ C 13 159.43 0.023 . . . . . . A 38 ARG CZ . 30795 1
161 . 1 . 1 31 31 ARG N N 15 124.43 0.215 . . . . . . A 38 ARG N . 30795 1
stop_
save_