Chain sequence(s) |
A: RPKHPIKHQGLPQEVLNENLLRFFVAPFPEVFGKEKVNELSKDIGSESTEDQAMEDIKQMEAESISSSEEIVPNSVEQKHIQKEDVPSERYLGYLEQLLRLKKYKVPQLEIVPNSAEERLHSMKEGIHAQQKEPMIGVNQELAYFYPELFRQFYQLDAYPSGAWYYVPLGTQYTDAPSFSDIPNPIGSENSEKTTMPLW
input PDB |
Selected Chain(s) | A |
Distance of aggregation | 10 Å |
FoldX usage | Yes |
Dynamic mode | No |
Automated mutations | No |
Downloads | Download all the data |
Simulation log |
[INFO] Logger: Verbosity set to: 2 - [INFO] (00:00:00) [WARNING] runJob: Working directory already exists (possibly overwriting previous results -ow to prevent this behavior) (00:00:00) [INFO] runJob: Starting aggrescan3d job on: input.pdb with A chain(s) selected (00:00:00) [INFO] runJob: Creating pdb object from: input.pdb (00:00:00) [INFO] FoldX: Starting FoldX energy minimalization (00:00:00) [INFO] Analysis: Starting Aggrescan3D on folded.pdb (00:03:49) [INFO] Main: Simulation completed successfully. (00:03:51) |
The table below lists A3D score for protein residues. Residues with A3D score > 0.0000 are marked by yellow rows.
residue index | residue name | chain | Aggrescan3D score | mutation |
---|---|---|---|---|
residue index | residue name | chain | Aggrescan3D score | |
1 | R | A | -2.5044 | |
2 | P | A | -2.2343 | |
3 | K | A | -2.5367 | |
4 | H | A | -2.0274 | |
5 | P | A | -0.8397 | |
6 | I | A | 0.0928 | |
7 | K | A | -1.8738 | |
8 | H | A | -1.6901 | |
9 | Q | A | -1.6702 | |
10 | G | A | -1.3297 | |
11 | L | A | 0.3322 | |
12 | P | A | -0.8111 | |
13 | Q | A | -1.7174 | |
14 | E | A | -2.3805 | |
15 | V | A | -0.6837 | |
16 | L | A | -0.3347 | |
17 | N | A | -1.5517 | |
18 | E | A | -1.6937 | |
19 | N | A | -0.2610 | |
20 | L | A | 1.4613 | |
21 | L | A | 1.6589 | |
22 | R | A | 0.4052 | |
23 | F | A | 2.8453 | |
24 | F | A | 3.4999 | |
25 | V | A | 2.9710 | |
26 | A | A | 2.0137 | |
27 | P | A | 1.4648 | |
28 | F | A | 2.5458 | |
29 | P | A | 0.5302 | |
30 | E | A | -0.3214 | |
31 | V | A | 1.5281 | |
32 | F | A | 1.1928 | |
33 | G | A | -1.0388 | |
34 | K | A | -2.6250 | |
35 | E | A | -2.9221 | |
36 | K | A | -2.8393 | |
37 | V | A | -0.6586 | |
38 | N | A | -2.2705 | |
39 | E | A | -2.4650 | |
40 | L | A | -0.2284 | |
41 | S | A | -1.0145 | |
42 | K | A | -2.4007 | |
43 | D | A | -2.0452 | |
44 | I | A | 0.4052 | |
45 | G | A | -0.9917 | |
46 | S | A | -1.5686 | |
47 | E | A | -2.1103 | |
48 | S | A | -1.8549 | |
49 | T | A | -1.9439 | |
50 | E | A | -3.0799 | |
51 | D | A | -3.2068 | |
52 | Q | A | -2.4199 | |
53 | A | A | -1.1552 | |
54 | M | A | -0.5385 | |
55 | E | A | -1.9566 | |
56 | D | A | -2.0110 | |
57 | I | A | -0.2853 | |
58 | K | A | -1.7595 | |
59 | Q | A | -1.5541 | |
60 | M | A | -0.5837 | |
61 | E | A | -1.9389 | |
62 | A | A | -1.5403 | |
63 | E | A | -1.8355 | |
64 | S | A | -0.1605 | |
65 | I | A | 1.3537 | |
66 | S | A | 0.4344 | |
67 | S | A | -0.6848 | |
68 | S | A | -1.5054 | |
69 | E | A | -2.2065 | |
70 | E | A | -1.4499 | |
71 | I | A | 1.3856 | |
72 | V | A | 1.7401 | |
73 | P | A | 0.5603 | |
74 | N | A | -0.6129 | |
75 | S | A | -0.6050 | |
76 | V | A | -0.3302 | |
77 | E | A | -2.2761 | |
78 | Q | A | -2.2640 | |
79 | K | A | -2.6855 | |
80 | H | A | -2.2800 | |
81 | I | A | -1.1032 | |
82 | Q | A | -2.6304 | |
83 | K | A | -3.1843 | |
84 | E | A | -3.0896 | |
85 | D | A | -2.6427 | |
86 | V | A | -0.3125 | |
87 | P | A | -0.3912 | |
88 | S | A | -0.7886 | |
89 | E | A | -1.6214 | |
90 | R | A | -1.7306 | |
91 | Y | A | 0.6004 | |
92 | L | A | 0.4893 | |
93 | G | A | -0.3626 | |
94 | Y | A | 0.7924 | |
95 | L | A | 0.6299 | |
96 | E | A | -0.8449 | |
97 | Q | A | -0.7592 | |
98 | L | A | -0.0443 | |
99 | L | A | -0.8279 | |
100 | R | A | -1.8643 | |
101 | L | A | -0.6591 | |
102 | K | A | -1.9889 | |
103 | K | A | -1.9147 | |
104 | Y | A | -0.3117 | |
105 | K | A | -0.9585 | |
106 | V | A | 0.2699 | |
107 | P | A | -0.2345 | |
108 | Q | A | -0.1162 | |
109 | L | A | 1.2539 | |
110 | E | A | 0.3693 | |
111 | I | A | 1.8738 | |
112 | V | A | 1.7403 | |
113 | P | A | 0.1013 | |
114 | N | A | -1.3081 | |
115 | S | A | -1.8825 | |
116 | A | A | -1.9728 | |
117 | E | A | -3.2753 | |
118 | E | A | -3.5165 | |
119 | R | A | -2.3620 | |
120 | L | A | -0.7963 | |
121 | H | A | -2.0098 | |
122 | S | A | -1.5065 | |
123 | M | A | -0.4591 | |
124 | K | A | -1.8140 | |
125 | E | A | -2.2443 | |
126 | G | A | -0.8524 | |
127 | I | A | 0.4058 | |
128 | H | A | -0.8110 | |
129 | A | A | -1.1937 | |
130 | Q | A | -2.6258 | |
131 | Q | A | -3.2406 | |
132 | K | A | -3.4638 | |
133 | E | A | -2.7499 | |
134 | P | A | -0.7489 | |
135 | M | A | 1.5420 | |
136 | I | A | 2.3823 | |
137 | G | A | 0.9628 | |
138 | V | A | 1.3152 | |
139 | N | A | -0.5453 | |
140 | Q | A | -1.2256 | |
141 | E | A | -1.2216 | |
142 | L | A | 0.3257 | |
143 | A | A | 0.4615 | |
144 | Y | A | 1.0885 | |
145 | F | A | 1.8023 | |
146 | Y | A | 1.1462 | |
147 | P | A | -0.0240 | |
148 | E | A | -1.0275 | |
149 | L | A | 0.2139 | |
150 | F | A | 0.3023 | |
151 | R | A | -1.6720 | |
152 | Q | A | -1.1623 | |
153 | F | A | 1.0670 | |
154 | Y | A | 0.8335 | |
155 | Q | A | -0.6238 | |
156 | L | A | 0.6857 | |
157 | D | A | -0.9501 | |
158 | A | A | 0.1605 | |
159 | Y | A | 0.8784 | |
160 | P | A | 0.0344 | |
161 | S | A | -0.0214 | |
162 | G | A | 0.1122 | |
163 | A | A | 1.1803 | |
164 | W | A | 2.3613 | |
165 | Y | A | 2.9993 | |
166 | Y | A | 3.3617 | |
167 | V | A | 3.2632 | |
168 | P | A | 1.8268 | |
169 | L | A | 1.7624 | |
170 | G | A | 0.1669 | |
171 | T | A | -0.3164 | |
172 | Q | A | -0.5154 | |
173 | Y | A | 0.2590 | |
174 | T | A | -0.5760 | |
175 | D | A | -1.5905 | |
176 | A | A | -0.5506 | |
177 | P | A | -0.3724 | |
178 | S | A | 0.0335 | |
179 | F | A | 1.4922 | |
180 | S | A | 0.1276 | |
181 | D | A | -0.5366 | |
182 | I | A | 0.9274 | |
183 | P | A | 0.0131 | |
184 | N | A | -0.8145 | |
185 | P | A | 0.1077 | |
186 | I | A | 1.2181 | |
187 | G | A | -0.1537 | |
188 | S | A | -1.2850 | |
189 | E | A | -2.9565 | |
190 | N | A | -3.0020 | |
191 | S | A | -2.7722 | |
192 | E | A | -3.3461 | |
193 | K | A | -2.8756 | |
194 | T | A | -1.1351 | |
195 | T | A | -0.0722 | |
196 | M | A | 1.3205 | |
197 | P | A | 1.3012 | |
198 | L | A | 2.2080 | |
199 | W | A | 1.9629 |