Project name: T12502080011

Status: done

Started: 2026-08-18 04:38:27
Chain sequence(s) A: MIVGGYTCGANTVPYQVSLNSGYHFCGGSLINSQWVVSAAHCYKSGIQVRLGEDNINVVEGNEQFISASKSIVHPSYNSNTLNNDIMLIKLKSAASLNSRVASISLPTSCASAGTQCLISGWGNTKSSGTSYPDVLKCLKAPILSDSSCKSAYPGQITSNMFCAGYLEGGKDSCQGDSGGPVVCSGKLQGIVSWGSGCAQKNKPGVYTKVCNYVSWIKQTIASNLE
input PDB
Selected Chain(s) A
Distance of aggregation 10 Å
FoldX usage Yes
pH calculations No
alphaCutter usage No
Dynamic mode No
Automated mutations No
Downloads Download all the data
Simulation log 
[INFO]       Logger:   Verbosity set to: 2 - [INFO]                                                (00:00:03)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:03)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with A chain(s) selected             (00:00:03)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:03)
[INFO]       FoldX:    Starting FoldX energy minimization                                          (00:00:04)
[INFO]       Analysis: Starting Aggrescan4D on folded.pdb                                          (00:04:28)
[INFO]       Main:     Simulation completed successfully.                                          (00:04:31)
Show buried residues
Minimal score value
-3.5662
Maximal score value
1.3005
Average score
-0.4989
Total score value
-112.7624
Download the table (csv)

The table below lists A4D score for protein residues. Residues with A4D score > 0.0000 are marked by yellow rows.

residue index residue name chain Aggrescan4D score mutation
1 M A 0.0000
2 I A 0.0000
3 V A -0.7754
4 G A -1.0699
5 G A -0.4674
6 Y A 0.6014
7 T A 0.3547
8 C A 0.0000
9 G A -0.1911
10 A A -0.4469
11 N A -0.8700
12 T A -0.5093
13 V A 0.0000
14 P A -0.5506
15 Y A 0.0000
16 Q A 0.0000
17 V A 0.0000
18 S A 0.0000
19 L A 0.0000
20 N A 0.0000
21 S A -0.3490
22 G A 0.0145
23 Y A 0.8992
24 H A 0.3147
25 F A 0.1089
26 C A 0.0000
27 G A 0.0000
28 G A 0.0000
29 S A 0.0000
30 L A 0.0000
31 I A -0.1129
32 N A -0.3589
33 S A -0.2177
34 Q A -0.6653
35 W A 0.0000
36 V A 0.0000
37 V A 0.0000
38 S A 0.0000
39 A A 0.0000
40 A A 0.0000
41 H A -0.2077
42 C A 0.0000
43 Y A 0.2928
44 K A -1.1969
45 S A -1.1023
46 G A -1.1341
47 I A 0.0000
48 Q A -0.6381
49 V A 0.0000
50 R A -0.1414
51 L A 0.0000
52 G A -0.9572
53 E A 0.0000
54 D A -0.6369
55 N A -0.3492
56 I A -0.1021
57 N A -0.3782
58 V A 1.3005
59 V A 1.2566
60 E A -0.8901
61 G A -0.8644
62 N A -1.4039
63 E A -0.6862
64 Q A -0.1671
65 F A 0.6985
66 I A -0.1161
67 S A -0.7837
68 A A -1.1525
69 S A -1.5413
70 K A -1.5219
71 S A -0.4602
72 I A 0.3574
73 V A 0.4955
74 H A -0.0608
75 P A -0.2928
76 S A -0.4902
77 Y A -0.5867
78 N A -1.3129
79 S A -1.2104
80 N A -1.5574
81 T A -1.0929
82 L A -0.7136
83 N A -0.8551
84 N A -0.6087
85 D A 0.0000
86 I A 0.0000
87 M A 0.0000
88 L A 0.0000
89 I A 0.0000
90 K A 0.0000
91 L A 0.0000
92 K A -2.1097
93 S A -1.1092
94 A A -0.4935
95 A A 0.0000
96 S A -0.0649
97 L A 0.3034
98 N A -1.0162
99 S A -0.9327
100 R A -1.2193
101 V A 0.0000
102 A A -0.3257
103 S A -0.1640
104 I A 0.0000
105 S A -0.3763
106 L A -0.2334
107 P A 0.0000
108 T A -0.0204
109 S A -0.0313
110 C A 0.2696
111 A A -0.1563
112 S A -0.4757
113 A A -0.6323
114 G A -0.7442
115 T A -0.8619
116 Q A -1.7269
117 C A 0.0000
118 L A -0.7738
119 I A 0.0000
120 S A 0.0000
121 G A 0.0000
122 W A 0.0000
123 G A 0.0000
124 N A 0.0000
125 T A -0.7043
126 K A -1.6510
127 S A -1.4803
128 S A -1.0680
129 G A -1.0458
130 T A -0.6341
131 S A -0.1853
132 Y A 0.5797
133 P A -0.1588
134 D A -0.9862
135 V A -0.2500
136 L A 0.0000
137 K A -0.1318
138 C A 0.0000
139 L A 0.0000
140 K A -1.9762
141 A A 0.0000
142 P A -0.9539
143 I A 0.0000
144 L A -0.6040
145 S A -1.2490
146 D A -2.3213
147 S A -1.6339
148 S A -1.2920
149 C A 0.0000
150 K A -2.4521
151 S A -1.7196
152 A A 0.0000
153 Y A 0.0000
154 P A -1.3299
155 G A -1.4165
156 Q A -1.6738
157 I A -1.2729
158 T A -0.8891
159 S A -0.6958
160 N A -0.6164
161 M A 0.0000
162 F A 0.0000
163 C A 0.0000
164 A A 0.0000
165 G A 0.0000
166 Y A -1.0091
167 L A -1.6970
168 E A -2.9188
169 G A -2.6298
170 G A -1.9561
171 K A -1.9193
172 D A 0.0000
173 S A 0.0000
174 C A -0.8761
175 Q A -1.2000
176 G A 0.0000
177 D A 0.0000
178 S A -0.2844
179 G A 0.0000
180 G A 0.0000
181 P A 0.0000
182 V A 0.0000
183 V A 0.0000
184 C A 0.0000
185 S A -0.8038
186 G A -0.8363
187 K A -0.8398
188 L A 0.0000
189 Q A 0.0000
190 G A 0.0000
191 I A 0.0000
192 V A 0.0000
193 S A 0.0000
194 W A -0.1662
195 G A -0.6723
196 S A -0.9880
197 G A -1.2186
198 C A -1.4606
199 A A -2.0983
200 Q A -2.7610
201 K A -3.5662
202 N A -2.7583
203 K A -2.1905
204 P A 0.0000
205 G A 0.0000
206 V A 0.0000
207 Y A 0.0000
208 T A 0.0000
209 K A -0.4816
210 V A 0.0000
211 C A -0.1887
212 N A -0.7082
213 Y A 0.0000
214 V A -0.4362
215 S A -0.8922
216 W A -0.8046
217 I A 0.0000
218 K A -1.9736
219 Q A -1.8900
220 T A 0.0000
221 I A -0.6461
222 A A -0.5853
223 S A -0.5956
224 N A -0.3251
225 L A 0.5618
226 E A -1.1368
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