Solution NMR structure alpha-helix 3 of Cry10Aa protein
ID | Entity ID | Seq ID | Comp ID | Atom ID | Atom type | Val | Val err | Ambig. code |
---|---|---|---|---|---|---|---|---|
1 | 1 | 1 | ILE | HA | H | 4.072 | 0.001 | 1 |
2 | 1 | 1 | ILE | HB | H | 1.996 | 0.0 | 1 |
3 | 1 | 1 | ILE | HG12 | H | 1.614 | 0.0 | 2 |
4 | 1 | 1 | ILE | HG13 | H | 1.308 | 0.0 | 2 |
5 | 1 | 1 | ILE | HG21 | H | 1.013 | 0.001 | 1 |
6 | 1 | 1 | ILE | HG22 | H | 1.013 | 0.001 | 1 |
7 | 1 | 1 | ILE | HG23 | H | 1.013 | 0.001 | 1 |
8 | 1 | 1 | ILE | CA | C | 60.560 | 1 | |
9 | 1 | 1 | ILE | CB | C | 39.177 | 1 | |
10 | 1 | 1 | ILE | CG1 | C | 27.411 | 0.0 | 1 |
11 | 1 | 1 | ILE | CG2 | C | 16.739 | 1 | |
12 | 1 | 2 | ILE | H | H | 8.047 | 0.001 | 1 |
13 | 1 | 2 | ILE | HA | H | 4.210 | 0.001 | 1 |
14 | 1 | 2 | ILE | HB | H | 1.983 | 0.0 | 1 |
15 | 1 | 2 | ILE | HG12 | H | 1.277 | 0.0 | 2 |
16 | 1 | 2 | ILE | HG13 | H | 1.586 | 0.0 | 2 |
17 | 1 | 2 | ILE | HG21 | H | 1.014 | 0.002 | 1 |
18 | 1 | 2 | ILE | HG22 | H | 1.014 | 0.002 | 1 |
19 | 1 | 2 | ILE | HG23 | H | 1.014 | 0.002 | 1 |
20 | 1 | 2 | ILE | CA | C | 61.794 | 1 | |
21 | 1 | 2 | ILE | CB | C | 38.604 | 1 | |
22 | 1 | 2 | ILE | CG1 | C | 27.298 | 0.006 | 1 |
23 | 1 | 2 | ILE | CG2 | C | 17.830 | 1 | |
24 | 1 | 3 | ASN | H | H | 8.492 | 0.001 | 1 |
25 | 1 | 3 | ASN | HA | H | 4.630 | 0.0 | 1 |
26 | 1 | 3 | ASN | HB2 | H | 2.835 | 0.0 | 2 |
27 | 1 | 3 | ASN | HB3 | H | 2.960 | 0.0 | 2 |
28 | 1 | 3 | ASN | HD21 | H | 6.868 | 0.001 | 1 |
29 | 1 | 3 | ASN | HD22 | H | 7.625 | 0.002 | 1 |
30 | 1 | 3 | ASN | CA | C | 54.915 | 1 | |
31 | 1 | 3 | ASN | CB | C | 38.812 | 0.004 | 1 |
32 | 1 | 4 | VAL | H | H | 8.126 | 0.0 | 1 |
33 | 1 | 4 | VAL | HA | H | 3.957 | 0.001 | 1 |
34 | 1 | 4 | VAL | HB | H | 2.228 | 0.001 | 1 |
35 | 1 | 4 | VAL | HG11 | H | 0.996 | 0.001 | 2 |
36 | 1 | 4 | VAL | HG12 | H | 0.996 | 0.001 | 2 |
37 | 1 | 4 | VAL | HG13 | H | 0.996 | 0.001 | 2 |
38 | 1 | 4 | VAL | HG21 | H | 1.052 | 0.0 | 2 |
39 | 1 | 4 | VAL | HG22 | H | 1.052 | 0.0 | 2 |
40 | 1 | 4 | VAL | HG23 | H | 1.052 | 0.0 | 2 |
41 | 1 | 4 | VAL | CA | C | 63.514 | 1 | |
42 | 1 | 4 | VAL | CB | C | 31.958 | 1 | |
43 | 1 | 4 | VAL | CG1 | C | 21.249 | 2 | |
44 | 1 | 4 | VAL | CG2 | C | 21.627 | 2 | |
45 | 1 | 5 | LEU | H | H | 7.828 | 0.001 | 1 |
46 | 1 | 5 | LEU | HA | H | 4.181 | 0.001 | 1 |
47 | 1 | 5 | LEU | HB2 | H | 1.699 | 0.0 | 2 |
48 | 1 | 5 | LEU | HB3 | H | 1.873 | 0.0 | 2 |
49 | 1 | 5 | LEU | HG | H | 1.569 | 0.0 | 1 |
50 | 1 | 5 | LEU | HD11 | H | 0.943 | 0.0 | 1 |
51 | 1 | 5 | LEU | HD12 | H | 0.943 | 0.0 | 1 |
52 | 1 | 5 | LEU | HD13 | H | 0.943 | 0.0 | 1 |
53 | 1 | 5 | LEU | HD21 | H | 0.943 | 0.0 | 1 |
54 | 1 | 5 | LEU | HD22 | H | 0.943 | 0.0 | 1 |
55 | 1 | 5 | LEU | HD23 | H | 0.943 | 0.0 | 1 |
56 | 1 | 5 | LEU | CA | C | 56.340 | 1 | |
57 | 1 | 5 | LEU | CB | C | 41.319 | 0.003 | 1 |
58 | 1 | 5 | LEU | CG | C | 27.080 | 1 | |
59 | 1 | 5 | LEU | CD1 | C | 25.113 | 1 | |
60 | 1 | 5 | LEU | CD2 | C | 25.113 | 1 | |
61 | 1 | 6 | THR | H | H | 7.976 | 0.0 | 1 |
62 | 1 | 6 | THR | HA | H | 4.050 | 0.002 | 1 |
63 | 1 | 6 | THR | HB | H | 4.261 | 0.0 | 1 |
64 | 1 | 6 | THR | HG21 | H | 1.282 | 0.002 | 1 |
65 | 1 | 6 | THR | HG22 | H | 1.282 | 0.002 | 1 |
66 | 1 | 6 | THR | HG23 | H | 1.282 | 0.002 | 1 |
67 | 1 | 6 | THR | CA | C | 65.563 | 1 | |
68 | 1 | 6 | THR | CB | C | 68.788 | 1 | |
69 | 1 | 6 | THR | CG2 | C | 22.018 | 1 | |
70 | 1 | 7 | SER | H | H | 8.004 | 0.001 | 1 |
71 | 1 | 7 | SER | HA | H | 4.422 | 0.001 | 1 |
72 | 1 | 7 | SER | HB2 | H | 3.972 | 0.001 | 1 |
73 | 1 | 7 | SER | HB3 | H | 3.972 | 0.0 | 1 |
74 | 1 | 7 | SER | CA | C | 61.166 | 1 | |
75 | 1 | 7 | SER | CB | C | 64.795 | 1 | |
76 | 1 | 8 | ILE | H | H | 7.526 | 0.0 | 1 |
77 | 1 | 8 | ILE | HA | H | 4.258 | 0.0 | 1 |
78 | 1 | 8 | ILE | HB | H | 2.050 | 0.0 | 1 |
79 | 1 | 8 | ILE | HG12 | H | 1.315 | 0.001 | 1 |
80 | 1 | 8 | ILE | HG13 | H | 1.315 | 0.001 | 1 |
81 | 1 | 8 | ILE | HG21 | H | 0.940 | 0.0 | 1 |
82 | 1 | 8 | ILE | HG22 | H | 0.940 | 0.0 | 1 |
83 | 1 | 8 | ILE | HG23 | H | 0.940 | 0.0 | 1 |
84 | 1 | 8 | ILE | CA | C | 62.628 | 1 | |
85 | 1 | 8 | ILE | CB | C | 39.183 | 1 | |
86 | 1 | 8 | ILE | CG1 | C | 27.215 | 1 | |
87 | 1 | 8 | ILE | CG2 | C | 17.740 | 1 | |
88 | 1 | 9 | VAL | H | H | 7.838 | 0.0 | 1 |
89 | 1 | 9 | VAL | HA | H | 3.706 | 0.001 | 1 |
90 | 1 | 9 | VAL | HB | H | 2.232 | 0.001 | 1 |
91 | 1 | 9 | VAL | HG11 | H | 1.020 | 0.001 | 2 |
92 | 1 | 9 | VAL | HG12 | H | 1.020 | 0.001 | 2 |
93 | 1 | 9 | VAL | HG13 | H | 1.020 | 0.001 | 2 |
94 | 1 | 9 | VAL | HG21 | H | 1.099 | 0.0 | 2 |
95 | 1 | 9 | VAL | HG22 | H | 1.099 | 0.0 | 2 |
96 | 1 | 9 | VAL | HG23 | H | 1.099 | 0.0 | 2 |
97 | 1 | 9 | VAL | CA | C | 66.282 | 1 | |
98 | 1 | 9 | VAL | CB | C | 31.828 | 1 | |
99 | 1 | 9 | VAL | CG1 | C | 21.833 | 2 | |
100 | 1 | 9 | VAL | CG2 | C | 22.611 | 2 | |
101 | 1 | 10 | THR | H | H | 8.055 | 0.001 | 1 |
102 | 1 | 10 | THR | HA | H | 4.451 | 0.001 | 1 |
103 | 1 | 10 | THR | HB | H | 4.089 | 0.001 | 1 |
104 | 1 | 10 | THR | HG21 | H | 1.251 | 0.001 | 1 |
105 | 1 | 10 | THR | HG22 | H | 1.251 | 0.001 | 1 |
106 | 1 | 10 | THR | HG23 | H | 1.251 | 0.001 | 1 |
107 | 1 | 10 | THR | CA | C | 66.028 | 1 | |
108 | 1 | 10 | THR | CB | C | 68.905 | 1 | |
109 | 1 | 10 | THR | CG2 | C | 21.800 | 1 | |
110 | 1 | 11 | PRO | HA | H | 4.453 | 0.001 | 1 |
111 | 1 | 11 | PRO | HB2 | H | 1.799 | 0.002 | 2 |
112 | 1 | 11 | PRO | HB3 | H | 2.445 | 0.0 | 2 |
113 | 1 | 11 | PRO | HG2 | H | 2.042 | 0.001 | 2 |
114 | 1 | 11 | PRO | HG3 | H | 2.232 | 0.0 | 2 |
115 | 1 | 11 | PRO | HD2 | H | 3.499 | 0.001 | 2 |
116 | 1 | 11 | PRO | HD3 | H | 3.754 | 0.003 | 2 |
117 | 1 | 11 | PRO | CA | C | 66.887 | 1 | |
118 | 1 | 11 | PRO | CB | C | 31.251 | 1 | |
119 | 1 | 11 | PRO | CG | C | 28.033 | 1 | |
120 | 1 | 11 | PRO | CD | C | 49.945 | 0.011 | 1 |
121 | 1 | 12 | ILE | H | H | 7.209 | 0.005 | 1 |
122 | 1 | 12 | ILE | HA | H | 3.673 | 0.001 | 1 |
123 | 1 | 12 | ILE | HB | H | 2.082 | 0.0 | 1 |
124 | 1 | 12 | ILE | HG12 | H | 1.303 | 0.0 | 1 |
125 | 1 | 12 | ILE | HG13 | H | 1.303 | 0.0 | 1 |
126 | 1 | 12 | ILE | HG21 | H | 0.895 | 0.007 | 1 |
127 | 1 | 12 | ILE | HG22 | H | 0.895 | 0.007 | 1 |
128 | 1 | 12 | ILE | HG23 | H | 0.895 | 0.007 | 1 |
129 | 1 | 12 | ILE | CA | C | 65.710 | 1 | |
130 | 1 | 12 | ILE | CB | C | 39.119 | 1 | |
131 | 1 | 12 | ILE | CG1 | C | 27.170 | 1 | |
132 | 1 | 12 | ILE | CG2 | C | 17.333 | 1 | |
133 | 1 | 13 | LYS | H | H | 8.646 | 0.001 | 1 |
134 | 1 | 13 | LYS | HA | H | 3.882 | 0.001 | 1 |
135 | 1 | 13 | LYS | HB2 | H | 1.919 | 0.0 | 2 |
136 | 1 | 13 | LYS | HB3 | H | 2.001 | 0.0 | 2 |
137 | 1 | 13 | LYS | HG2 | H | 1.439 | 0.0 | 2 |
138 | 1 | 13 | LYS | HG3 | H | 1.642 | 0.0 | 2 |
139 | 1 | 13 | LYS | HD2 | H | 1.750 | 0.0 | 2 |
140 | 1 | 13 | LYS | HD3 | H | 1.863 | 0.001 | 2 |
141 | 1 | 13 | LYS | HE2 | H | 2.986 | 0.0 | 1 |
142 | 1 | 13 | LYS | HE3 | H | 2.986 | 0.0 | 1 |
143 | 1 | 13 | LYS | CA | C | 60.263 | 1 | |
144 | 1 | 13 | LYS | CB | C | 32.177 | 0.018 | 1 |
145 | 1 | 13 | LYS | CG | C | 25.663 | 1 | |
146 | 1 | 13 | LYS | CD | C | 27.041 | 0.009 | 1 |
147 | 1 | 13 | LYS | CE | C | 42.115 | 1 | |
148 | 1 | 14 | ASN | H | H | 8.470 | 0.0 | 1 |
149 | 1 | 14 | ASN | HA | H | 4.475 | 0.0 | 1 |
150 | 1 | 14 | ASN | HB2 | H | 2.829 | 0.002 | 2 |
151 | 1 | 14 | ASN | HB3 | H | 2.999 | 0.002 | 2 |
152 | 1 | 14 | ASN | HD21 | H | 7.576 | 0.0 | 1 |
153 | 1 | 14 | ASN | HD22 | H | 6.819 | 0.0 | 1 |
154 | 1 | 14 | ASN | CA | C | 55.760 | 1 | |
155 | 1 | 14 | ASN | CB | C | 38.210 | 0.003 | 1 |
156 | 1 | 15 | GLN | H | H | 7.913 | 0.001 | 1 |
157 | 1 | 15 | GLN | HA | H | 4.199 | 0.001 | 1 |
158 | 1 | 15 | GLN | HB2 | H | 2.200 | 0.001 | 2 |
159 | 1 | 15 | GLN | HB3 | H | 2.275 | 0.0 | 2 |
160 | 1 | 15 | GLN | HG2 | H | 2.723 | 0.001 | 2 |
161 | 1 | 15 | GLN | HG3 | H | 2.215 | 0.0 | 2 |
162 | 1 | 15 | GLN | CA | C | 57.657 | 1 | |
163 | 1 | 15 | GLN | CB | C | 27.947 | 1 | |
164 | 1 | 15 | GLN | CG | C | 32.929 | 0.012 | 1 |
165 | 1 | 16 | LEU | H | H | 8.410 | 0.001 | 1 |
166 | 1 | 16 | LEU | HA | H | 4.160 | 0.001 | 1 |
167 | 1 | 16 | LEU | HB2 | H | 1.757 | 0.0 | 2 |
168 | 1 | 16 | LEU | HB3 | H | 1.861 | 0.0 | 2 |
169 | 1 | 16 | LEU | HD11 | H | 0.921 | 0.0 | 1 |
170 | 1 | 16 | LEU | HD12 | H | 0.921 | 0.0 | 1 |
171 | 1 | 16 | LEU | HD13 | H | 0.921 | 0.0 | 1 |
172 | 1 | 16 | LEU | HD21 | H | 0.921 | 0.0 | 1 |
173 | 1 | 16 | LEU | HD22 | H | 0.921 | 0.0 | 1 |
174 | 1 | 16 | LEU | HD23 | H | 0.921 | 0.0 | 1 |
175 | 1 | 16 | LEU | CA | C | 56.287 | 1 | |
176 | 1 | 16 | LEU | CB | C | 41.550 | 0.001 | 1 |
177 | 1 | 16 | LEU | CD1 | C | 25.309 | 1 | |
178 | 1 | 16 | LEU | CD2 | C | 25.309 | 1 | |
179 | 1 | 17 | ASP | H | H | 8.302 | 0.0 | 1 |
180 | 1 | 17 | ASP | HA | H | 4.497 | 0.0 | 1 |
181 | 1 | 17 | ASP | HB2 | H | 2.853 | 0.0 | 2 |
182 | 1 | 17 | ASP | HB3 | H | 2.949 | 0.0 | 2 |
183 | 1 | 17 | ASP | CA | C | 55.850 | 1 | |
184 | 1 | 17 | ASP | CB | C | 39.045 | 0.004 | 1 |
185 | 1 | 18 | LYS | H | H | 7.654 | 0.0 | 1 |
186 | 1 | 18 | LYS | HA | H | 4.049 | 0.0 | 1 |
187 | 1 | 18 | LYS | HB2 | H | 1.815 | 0.001 | 1 |
188 | 1 | 18 | LYS | HB3 | H | 1.815 | 0.001 | 1 |
189 | 1 | 18 | LYS | HG2 | H | 1.250 | 0.0 | 2 |
190 | 1 | 18 | LYS | HG3 | H | 1.445 | 0.0 | 2 |
191 | 1 | 18 | LYS | HD2 | H | 1.651 | 0.0 | 1 |
192 | 1 | 18 | LYS | HD3 | H | 1.651 | 0.0 | 1 |
193 | 1 | 18 | LYS | HE2 | H | 2.926 | 0.0 | 1 |
194 | 1 | 18 | LYS | HE3 | H | 2.926 | 0.0 | 1 |
195 | 1 | 18 | LYS | CA | C | 58.402 | 1 | |
196 | 1 | 18 | LYS | CB | C | 32.494 | 1 | |
197 | 1 | 18 | LYS | CG | C | 24.931 | 1 | |
198 | 1 | 18 | LYS | CD | C | 29.427 | 1 | |
199 | 1 | 18 | LYS | CE | C | 42.293 | 1 | |
200 | 1 | 19 | TYR | H | H | 7.819 | 0.0 | 1 |
201 | 1 | 19 | TYR | HA | H | 4.441 | 0.002 | 1 |
202 | 1 | 19 | TYR | HB2 | H | 3.002 | 0.0 | 2 |
203 | 1 | 19 | TYR | HB3 | H | 3.220 | 0.001 | 2 |
204 | 1 | 19 | TYR | HD1 | H | 7.191 | 0.003 | 1 |
205 | 1 | 19 | TYR | HD2 | H | 7.191 | 0.003 | 1 |
206 | 1 | 19 | TYR | HE1 | H | 6.836 | 0.0 | 1 |
207 | 1 | 19 | TYR | HE2 | H | 6.836 | 0.0 | 1 |
208 | 1 | 19 | TYR | CA | C | 59.487 | 1 | |
209 | 1 | 19 | TYR | CB | C | 39.092 | 0.004 | 1 |
210 | 1 | 19 | TYR | CD1 | C | 133.192 | 1 | |
211 | 1 | 19 | TYR | CD2 | C | 133.192 | 1 | |
212 | 1 | 19 | TYR | CE1 | C | 118.157 | 1 | |
213 | 1 | 19 | TYR | CE2 | C | 118.157 | 1 | |
214 | 1 | 20 | GLN | H | H | 8.047 | 0.001 | 1 |
215 | 1 | 20 | GLN | HA | H | 4.181 | 0.001 | 1 |
216 | 1 | 20 | GLN | HB2 | H | 2.046 | 0.001 | 2 |
217 | 1 | 20 | GLN | HB3 | H | 2.143 | 0.0 | 2 |
218 | 1 | 20 | GLN | HG2 | H | 2.388 | 0.002 | 2 |
219 | 1 | 20 | GLN | HG3 | H | 2.497 | 0.002 | 2 |
220 | 1 | 20 | GLN | HE21 | H | 7.271 | 0.0 | 1 |
221 | 1 | 20 | GLN | HE22 | H | 6.755 | 0.001 | 1 |
222 | 1 | 20 | GLN | CA | C | 57.950 | 1 | |
223 | 1 | 20 | GLN | CB | C | 29.630 | 1 | |
224 | 1 | 20 | GLN | CG | C | 34.230 | 1 | |
225 | 1 | 21 | NH2 | HN1 | H | 6.963 | 0.0 | 1 |
226 | 1 | 21 | NH2 | HN2 | H | 7.021 | 0.001 | 1 |