STRUCTURE OF ALPHA-SYNUCLEIN FIBRILS DERIVED FROM HUMAN LEWY BODY DEMENTIA TISSUE
MDVFMKGLSK AKEGVVAAAE KTKQGVAEAA GKTKEGVLYV GSKTKEGVVH GVATVAEKTK EQVTNVGGAV VTGVTAVAQK TVEGAGSIAA ATGFVKKDQL GKNEEGAPQE GILEDMPVDP DNEAYEMPSE EGYQDYEPEA
ID | Entity ID | Seq ID | Comp ID | Atom ID | Atom type | Val | Val err | Ambig. code |
---|---|---|---|---|---|---|---|---|
226 | 1 | 76 | ALA | C | C | 174.682 | 0.065 | 1 |
227 | 1 | 76 | ALA | CA | C | 49.627 | 0.060 | 1 |
228 | 1 | 76 | ALA | CB | C | 20.316 | 0.063 | 1 |
229 | 1 | 76 | ALA | N | N | 131.095 | 0.247 | 1 |
230 | 1 | 77 | VAL | CB | C | 36.376 | 0.000 | 1 |
231 | 1 | 77 | VAL | CG1 | C | 24.498 | 0.012 | 1 |
232 | 1 | 78 | ALA | CA | C | 50.123 | 0.072 | 1 |
233 | 1 | 78 | ALA | N | N | 128.806 | 0.000 | 1 |
234 | 1 | 87 | SER | C | C | 174.484 | 0.100 | 1 |
235 | 1 | 87 | SER | CA | C | 55.385 | 0.088 | 1 |
236 | 1 | 87 | SER | CB | C | 66.738 | 0.138 | 1 |
237 | 1 | 94 | PHE | CG | C | 129.251 | 0.098 | 1 |
ID | Entity ID | Seq ID | Comp ID | Atom ID | Atom type | Val | Val err | Ambig. code |
---|---|---|---|---|---|---|---|---|
1 | 1 | 35 | GLU | C | C | 176.221 | 0.118 | 1 |
2 | 1 | 35 | GLU | CA | C | 53.370 | 0.098 | 1 |
3 | 1 | 35 | GLU | CB | C | 35.740 | 0.123 | 1 |
4 | 1 | 35 | GLU | CG | C | 35.544 | 0.044 | 1 |
5 | 1 | 35 | GLU | CD | C | 183.276 | 0.105 | 1 |
6 | 1 | 35 | GLU | N | N | 122.120 | 0.250 | 1 |
7 | 1 | 36 | GLY | C | C | 173.845 | 0.087 | 1 |
8 | 1 | 36 | GLY | CA | C | 48.331 | 0.082 | 1 |
9 | 1 | 36 | GLY | N | N | 117.538 | 0.144 | 1 |
10 | 1 | 37 | VAL | C | C | 172.500 | 0.083 | 1 |
11 | 1 | 37 | VAL | CA | C | 59.963 | 0.101 | 1 |
12 | 1 | 37 | VAL | CB | C | 35.796 | 0.114 | 1 |
13 | 1 | 37 | VAL | CG1 | C | 24.171 | 0.185 | 1 |
14 | 1 | 37 | VAL | CG2 | C | 22.258 | 0.111 | 1 |
15 | 1 | 37 | VAL | N | N | 118.582 | 0.200 | 1 |
16 | 1 | 38 | LEU | C | C | 173.820 | 0.127 | 1 |
17 | 1 | 38 | LEU | CA | C | 52.471 | 0.089 | 1 |
18 | 1 | 38 | LEU | CB | C | 47.255 | 0.071 | 1 |
19 | 1 | 38 | LEU | CG | C | 27.580 | 0.085 | 1 |
20 | 1 | 38 | LEU | CD1 | C | 25.316 | 0.133 | 1 |
21 | 1 | 38 | LEU | CD2 | C | 29.074 | 0.102 | 1 |
22 | 1 | 38 | LEU | N | N | 127.846 | 0.291 | 1 |
23 | 1 | 39 | TYR | C | C | 173.757 | 0.146 | 1 |
24 | 1 | 39 | TYR | CA | C | 56.343 | 0.144 | 1 |
25 | 1 | 39 | TYR | CB | C | 43.444 | 0.130 | 1 |
26 | 1 | 39 | TYR | CG | C | 127.911 | 0.126 | 1 |
27 | 1 | 39 | TYR | CD1 | C | 132.785 | 0.143 | 1 |
28 | 1 | 39 | TYR | CD2 | C | 132.370 | 0.071 | 1 |
29 | 1 | 39 | TYR | CE1 | C | 117.537 | 0.157 | 1 |
30 | 1 | 39 | TYR | CE2 | C | 117.214 | 0.146 | 1 |
31 | 1 | 39 | TYR | CZ | C | 157.305 | 0.164 | 1 |
32 | 1 | 39 | TYR | N | N | 131.561 | 0.463 | 1 |
33 | 1 | 40 | VAL | C | C | 173.541 | 0.073 | 1 |
34 | 1 | 40 | VAL | CA | C | 59.899 | 0.111 | 1 |
35 | 1 | 40 | VAL | CB | C | 34.440 | 0.105 | 1 |
36 | 1 | 40 | VAL | CG1 | C | 21.861 | 0.128 | 1 |
37 | 1 | 40 | VAL | CG2 | C | 19.979 | 0.133 | 1 |
38 | 1 | 40 | VAL | N | N | 127.073 | 0.196 | 1 |
39 | 1 | 41 | GLY | C | C | 170.305 | 0.117 | 1 |
40 | 1 | 41 | GLY | CA | C | 44.612 | 0.101 | 1 |
41 | 1 | 41 | GLY | N | N | 111.638 | 0.133 | 1 |
42 | 1 | 42 | SER | C | C | 175.523 | 0.100 | 1 |
43 | 1 | 42 | SER | CA | C | 56.398 | 0.099 | 1 |
44 | 1 | 42 | SER | CB | C | 68.652 | 0.105 | 1 |
45 | 1 | 42 | SER | N | N | 116.816 | 0.121 | 1 |
46 | 1 | 43 | LYS | C | C | 176.688 | 0.122 | 1 |
47 | 1 | 43 | LYS | CA | C | 56.559 | 0.096 | 1 |
48 | 1 | 43 | LYS | N | N | 123.835 | 0.230 | 1 |
49 | 1 | 49 | VAL | CA | C | 60.527 | 0.153 | 1 |
50 | 1 | 49 | VAL | CG1 | C | 22.247 | 0.203 | 1 |
51 | 1 | 49 | VAL | CG2 | C | 21.486 | 0.089 | 1 |
52 | 1 | 50 | HIS | C | C | 175.842 | 0.116 | 1 |
53 | 1 | 50 | HIS | CA | C | 51.588 | 0.122 | 1 |
54 | 1 | 50 | HIS | CB | C | 31.558 | 0.161 | 1 |
55 | 1 | 50 | HIS | CG | C | 129.299 | 0.132 | 1 |
56 | 1 | 50 | HIS | CD2 | C | 125.011 | 0.134 | 1 |
57 | 1 | 50 | HIS | CE1 | C | 140.236 | 0.109 | 1 |
58 | 1 | 62 | GLN | CA | C | 54.468 | 0.016 | 1 |
59 | 1 | 62 | GLN | CB | C | 27.133 | 0.357 | 1 |
60 | 1 | 62 | GLN | CG | C | 35.886 | 0.000 | 1 |
61 | 1 | 62 | GLN | CD | C | 177.561 | 0.099 | 1 |
62 | 1 | 62 | GLN | NE2 | N | 111.035 | 0.08 | 1 |
63 | 1 | 63 | VAL | C | C | 173.895 | 0.089 | 1 |
64 | 1 | 63 | VAL | CA | C | 61.143 | 0.098 | 1 |
65 | 1 | 63 | VAL | CB | C | 35.541 | 0.056 | 1 |
66 | 1 | 63 | VAL | CG1 | C | 21.035 | 0.009 | 1 |
67 | 1 | 63 | VAL | N | N | 124.716 | 0.159 | 1 |
68 | 1 | 64 | THR | C | C | 172.140 | 0.103 | 1 |
69 | 1 | 64 | THR | CA | C | 60.854 | 0.109 | 1 |
70 | 1 | 64 | THR | CB | C | 68.591 | 0.105 | 1 |
71 | 1 | 64 | THR | CG2 | C | 23.435 | 0.118 | 1 |
72 | 1 | 64 | THR | N | N | 124.871 | 0.170 | 1 |
73 | 1 | 65 | ASN | C | C | 173.034 | 0.231 | 1 |
74 | 1 | 65 | ASN | CA | C | 51.747 | 0.078 | 1 |
75 | 1 | 65 | ASN | CB | C | 41.874 | 0.095 | 1 |
76 | 1 | 65 | ASN | CG | C | 174.569 | 0.100 | 1 |
77 | 1 | 65 | ASN | N | N | 126.479 | 0.132 | 1 |
78 | 1 | 65 | ASN | ND2 | N | 113.773 | 0.220 | 1 |
79 | 1 | 66 | VAL | C | C | 177.102 | 0.112 | 1 |
80 | 1 | 66 | VAL | CA | C | 59.782 | 0.091 | 1 |
81 | 1 | 66 | VAL | CB | C | 34.549 | 0.104 | 1 |
82 | 1 | 66 | VAL | CG1 | C | 22.574 | 0.172 | 1 |
83 | 1 | 66 | VAL | CG2 | C | 20.934 | 0.118 | 1 |
84 | 1 | 66 | VAL | N | N | 124.982 | 0.247 | 1 |
85 | 1 | 67 | GLY | C | C | 171.885 | 0.131 | 1 |
86 | 1 | 67 | GLY | CA | C | 47.320 | 0.090 | 1 |
87 | 1 | 67 | GLY | N | N | 112.539 | 0.126 | 1 |
88 | 1 | 68 | GLY | C | C | 172.347 | 0.096 | 1 |
89 | 1 | 68 | GLY | CA | C | 44.250 | 0.087 | 1 |
90 | 1 | 68 | GLY | N | N | 100.687 | 0.166 | 1 |
91 | 1 | 69 | ALA | C | C | 175.256 | 0.131 | 1 |
92 | 1 | 69 | ALA | CA | C | 49.940 | 0.083 | 1 |
93 | 1 | 69 | ALA | CB | C | 22.178 | 0.081 | 1 |
94 | 1 | 69 | ALA | N | N | 121.718 | 0.152 | 1 |
95 | 1 | 70 | VAL | C | C | 175.783 | 0.112 | 1 |
96 | 1 | 70 | VAL | CA | C | 61.576 | 0.067 | 1 |
97 | 1 | 70 | VAL | CB | C | 32.760 | 0.075 | 1 |
98 | 1 | 70 | VAL | CG1 | C | 21.178 | 0.069 | 1 |
99 | 1 | 70 | VAL | CG2 | C | 19.756 | 0.067 | 1 |
100 | 1 | 70 | VAL | N | N | 124.444 | 0.137 | 1 |
101 | 1 | 71 | VAL | C | C | 174.040 | 0.085 | 1 |
102 | 1 | 71 | VAL | CA | C | 61.252 | 0.089 | 1 |
103 | 1 | 71 | VAL | CB | C | 34.742 | 0.099 | 1 |
104 | 1 | 71 | VAL | CG1 | C | 22.106 | 0.076 | 1 |
105 | 1 | 71 | VAL | CG2 | C | 19.753 | 0.068 | 1 |
106 | 1 | 71 | VAL | N | N | 131.001 | 0.112 | 1 |
107 | 1 | 72 | THR | C | C | 174.622 | 0.141 | 1 |
108 | 1 | 72 | THR | CA | C | 59.966 | 0.095 | 1 |
109 | 1 | 72 | THR | CB | C | 71.354 | 0.085 | 1 |
110 | 1 | 72 | THR | CG2 | C | 22.639 | 0.123 | 1 |
111 | 1 | 72 | THR | N | N | 124.675 | 0.086 | 1 |
112 | 1 | 73 | GLY | C | C | 172.252 | 0.070 | 1 |
113 | 1 | 73 | GLY | CA | C | 48.883 | 0.079 | 1 |
114 | 1 | 73 | GLY | N | N | 117.683 | 0.233 | 1 |
115 | 1 | 74 | VAL | C | C | 173.996 | 0.121 | 1 |
116 | 1 | 74 | VAL | CA | C | 59.306 | 0.106 | 1 |
117 | 1 | 74 | VAL | CB | C | 37.421 | 0.075 | 1 |
118 | 1 | 74 | VAL | CG1 | C | 23.346 | 0.070 | 1 |
119 | 1 | 74 | VAL | CG2 | C | 20.318 | 0.061 | 1 |
120 | 1 | 74 | VAL | N | N | 117.545 | 0.100 | 1 |
121 | 1 | 75 | THR | C | C | 171.904 | 0.150 | 1 |
122 | 1 | 75 | THR | CA | C | 61.440 | 0.089 | 1 |
123 | 1 | 75 | THR | CB | C | 68.801 | 0.086 | 1 |
124 | 1 | 75 | THR | CG2 | C | 22.950 | 0.113 | 1 |
125 | 1 | 75 | THR | N | N | 123.228 | 0.197 | 1 |
126 | 1 | 76 | ALA | C | C | 174.035 | 0.07 | 1 |
127 | 1 | 76 | ALA | CA | C | 49.854 | 0.17 | 1 |
128 | 1 | 76 | ALA | CB | C | 20.223 | 0.08 | 1 |
129 | 1 | 76 | ALA | N | N | 131.319 | 0.00 | 1 |
130 | 1 | 77 | VAL | C | C | 172.336 | 0.078 | 1 |
131 | 1 | 77 | VAL | CA | C | 60.508 | 0.130 | 1 |
132 | 1 | 77 | VAL | CB | C | 36.740 | 0.091 | 1 |
133 | 1 | 77 | VAL | CG1 | C | 20.914 | 0.642 | 1 |
134 | 1 | 77 | VAL | CG2 | C | 25.084 | 0.555 | 1 |
135 | 1 | 77 | VAL | N | N | 122.393 | 0.193 | 1 |
136 | 1 | 78 | ALA | C | C | 175.735 | 0.129 | 1 |
137 | 1 | 78 | ALA | CA | C | 50.523 | 0.101 | 1 |
138 | 1 | 78 | ALA | CB | C | 23.065 | 0.122 | 1 |
139 | 1 | 78 | ALA | N | N | 130.236 | 0.121 | 1 |
140 | 1 | 79 | GLN | C | C | 174.048 | 0.086 | 1 |
141 | 1 | 79 | GLN | CA | C | 54.450 | 0.117 | 1 |
142 | 1 | 79 | GLN | CB | C | 37.584 | 0.123 | 1 |
143 | 1 | 79 | GLN | CG | C | 34.469 | 0.090 | 1 |
144 | 1 | 79 | GLN | CD | C | 179.410 | 0.110 | 1 |
145 | 1 | 79 | GLN | N | N | 122.515 | 0.171 | 1 |
146 | 1 | 79 | GLN | NE2 | N | 112.308 | 0.285 | 1 |
147 | 1 | 80 | LYS | C | C | 174.004 | 0.094 | 1 |
148 | 1 | 80 | LYS | CA | C | 54.668 | 0.135 | 1 |
149 | 1 | 80 | LYS | CB | C | 35.459 | 0.120 | 1 |
150 | 1 | 80 | LYS | CG | C | 25.853 | 0.133 | 1 |
151 | 1 | 80 | LYS | CD | C | 26.572 | 0.186 | 1 |
152 | 1 | 80 | LYS | CE | C | 42.597 | 0.175 | 1 |
153 | 1 | 80 | LYS | N | N | 126.460 | 0.137 | 1 |
154 | 1 | 81 | THR | C | C | 173.072 | 0.092 | 1 |
155 | 1 | 81 | THR | CA | C | 61.791 | 0.102 | 1 |
156 | 1 | 81 | THR | CB | C | 69.897 | 0.143 | 1 |
157 | 1 | 81 | THR | CG2 | C | 21.004 | 0.058 | 1 |
158 | 1 | 81 | THR | N | N | 124.608 | 0.072 | 1 |
159 | 1 | 82 | VAL | C | C | 175.221 | 0.074 | 1 |
160 | 1 | 82 | VAL | CA | C | 59.983 | 0.069 | 1 |
161 | 1 | 82 | VAL | CB | C | 35.106 | 0.053 | 1 |
162 | 1 | 82 | VAL | N | N | 126.637 | 0.000 | 1 |
163 | 1 | 83 | GLU | CA | C | 54.977 | 0.096 | 1 |
164 | 1 | 83 | GLU | CB | C | 34.204 | 0.066 | 1 |
165 | 1 | 83 | GLU | CD | C | 183.825 | 0.103 | 1 |
166 | 1 | 83 | GLU | N | N | 118.327 | 0.097 | 1 |
167 | 1 | 84 | GLY | C | C | 174.918 | 0.08 | 1 |
168 | 1 | 85 | ALA | C | C | 174.772 | 0.144 | 1 |
169 | 1 | 85 | ALA | CA | C | 49.801 | 0.117 | 1 |
170 | 1 | 85 | ALA | CB | C | 22.205 | 0.101 | 1 |
171 | 1 | 85 | ALA | N | N | 124.632 | 0.185 | 1 |
172 | 1 | 86 | GLY | C | C | 171.498 | 0.063 | 1 |
173 | 1 | 86 | GLY | CA | C | 44.246 | 0.099 | 1 |
174 | 1 | 86 | GLY | N | N | 109.949 | 0.150 | 1 |
175 | 1 | 87 | SER | C | C | 174.484 | 0.100 | 1 |
176 | 1 | 87 | SER | CA | C | 56.289 | 0.257 | 1 |
177 | 1 | 87 | SER | CB | C | 67.225 | 0.116 | 1 |
178 | 1 | 87 | SER | N | N | 119.420 | 0.270 | 1 |
179 | 1 | 88 | ILE | C | C | 172.950 | 0.136 | 1 |
180 | 1 | 88 | ILE | CA | C | 59.940 | 0.091 | 1 |
181 | 1 | 88 | ILE | CB | C | 44.401 | 0.117 | 1 |
182 | 1 | 88 | ILE | CG1 | C | 27.737 | 0.109 | 1 |
183 | 1 | 88 | ILE | CG2 | C | 17.606 | 0.101 | 1 |
184 | 1 | 88 | ILE | CD1 | C | 16.865 | 0.093 | 1 |
185 | 1 | 88 | ILE | N | N | 121.856 | 0.000 | 1 |
186 | 1 | 89 | ALA | C | C | 174.597 | 0.109 | 1 |
187 | 1 | 89 | ALA | CA | C | 50.146 | 0.103 | 1 |
188 | 1 | 89 | ALA | CB | C | 21.388 | 0.141 | 1 |
189 | 1 | 89 | ALA | N | N | 129.087 | 0.096 | 1 |
190 | 1 | 90 | ALA | C | C | 174.187 | 0.062 | 1 |
191 | 1 | 90 | ALA | CA | C | 49.589 | 0.115 | 1 |
192 | 1 | 90 | ALA | CB | C | 22.352 | 0.092 | 1 |
193 | 1 | 90 | ALA | N | N | 126.169 | 0.151 | 1 |
194 | 1 | 91 | ALA | C | C | 175.327 | 0.075 | 1 |
195 | 1 | 91 | ALA | CA | C | 50.418 | 0.123 | 1 |
196 | 1 | 91 | ALA | CB | C | 23.268 | 0.188 | 1 |
197 | 1 | 91 | ALA | N | N | 123.372 | 0.216 | 1 |
198 | 1 | 92 | THR | C | C | 173.349 | 0.090 | 1 |
199 | 1 | 92 | THR | CA | C | 61.244 | 0.089 | 1 |
200 | 1 | 92 | THR | CB | C | 70.756 | 0.126 | 1 |
201 | 1 | 92 | THR | CG2 | C | 20.763 | 0.093 | 1 |
202 | 1 | 92 | THR | N | N | 116.977 | 0.126 | 1 |
203 | 1 | 93 | GLY | C | C | 170.283 | 0.143 | 1 |
204 | 1 | 93 | GLY | CA | C | 44.975 | 0.125 | 1 |
205 | 1 | 93 | GLY | N | N | 113.870 | 0.36 | 1 |
206 | 1 | 94 | PHE | C | C | 172.815 | 0.091 | 1 |
207 | 1 | 94 | PHE | CA | C | 56.806 | 0.128 | 1 |
208 | 1 | 94 | PHE | CB | C | 43.436 | 0.117 | 1 |
209 | 1 | 94 | PHE | CG | C | 137.272 | 0.194 | 1 |
210 | 1 | 94 | PHE | CD1 | C | 131.274 | 0.115 | 1 |
211 | 1 | 94 | PHE | CD2 | C | 131.309 | 0.124 | 1 |
212 | 1 | 94 | PHE | CE1 | C | 129.399 | 0.05 | 1 |
213 | 1 | 94 | PHE | N | N | 129.175 | 0.159 | 1 |
214 | 1 | 95 | VAL | C | C | 172.856 | 0.118 | 1 |
215 | 1 | 95 | VAL | CA | C | 60.622 | 0.125 | 1 |
216 | 1 | 95 | VAL | CB | C | 35.465 | 0.120 | 1 |
217 | 1 | 95 | VAL | CG1 | C | 20.704 | 0.082 | 1 |
218 | 1 | 95 | VAL | CG2 | C | 21.099 | 0.127 | 1 |
219 | 1 | 95 | VAL | N | N | 128.475 | 0.207 | 1 |
220 | 1 | 96 | LYS | C | C | 175.031 | 0.076 | 1 |
221 | 1 | 96 | LYS | CA | C | 54.458 | 0.120 | 1 |
222 | 1 | 96 | LYS | CG | C | 25.678 | 0.105 | 1 |
223 | 1 | 96 | LYS | CD | C | 30.712 | 0.033 | 1 |
224 | 1 | 96 | LYS | CE | C | 41.987 | 0.094 | 1 |
225 | 1 | 96 | LYS | N | N | 128.973 | 0.177 | 1 |