Project name: 23_x4e7_x11e6_i20e6_i14e7

Chain sequence(s)	A: GPGPGLLCHEQLSDSEEENDGPGPGQSTHVDIRTLEDLLMGPGPGTPTLHEYMLDLQPETGPGPGLQDIVLHLEPQNEIPGPGPGAEKLRHLNEKRRFHNGPGPGLDKKQRFHNIRGRWTGPGPGNPAEKLRHLNEKRRFGPGPGSKISEYRHYCYSLYGGPGPGVYDFAFRDLAAYRFHNIAGHYAAYCYSLYGTTLAAYKTVLELTEVAAYYRAHYNIVTFAAYTLQDIVLHLAAYLLMGTLGIVAAYLPARRAEPQAAY
Selected Chain(s)	A
Distance of aggregation	10 Å
FoldX usage	Yes
Dynamic mode	No
Automated mutations	No

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                                          (00:04:10)
[INFO]       Main:     Simulation completed successfully.                                          (00:04:12)

• Minimal score value: -4.2758
• Maximal score value: 3.4295
• Average score: -0.3432
• Total score value: -89.9176

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
1	G	A	-0.7314
2	P	A	-0.8375
3	G	A	-0.7745
4	P	A	-0.2317
5	G	A	0.5226
6	L	A	2.0337
7	L	A	1.9844
8	C	A	0.6955
9	H	A	-1.0295
10	E	A	-2.0448
11	Q	A	-1.7743
12	L	A	-0.3395
13	S	A	-1.0940
14	D	A	-2.3749
15	S	A	-2.4675
16	E	A	-3.9040
17	E	A	-4.1570
18	E	A	-4.2758
19	N	A	-3.7848
20	D	A	-3.1538
21	G	A	-2.1111
22	P	A	-1.2442
23	G	A	-1.3397
24	P	A	-1.2077
25	G	A	-1.4029
26	Q	A	-1.8178
27	S	A	-1.0822
28	T	A	-0.8876
29	H	A	-0.7301
30	V	A	0.4518
31	D	A	-0.8237
32	I	A	0.4141
33	R	A	-1.5642
34	T	A	-1.1577
35	L	A	-0.4663
36	E	A	-2.0203
37	D	A	-1.6920
38	L	A	0.2387
39	L	A	0.9427
40	M	A	1.0041
41	G	A	0.2159
42	P	A	-0.2527
43	G	A	-0.6221
44	P	A	-0.8232
45	G	A	-1.0519
46	T	A	-1.1046
47	P	A	-0.6904
48	T	A	-0.7691
49	L	A	-0.5888
50	H	A	-1.0233
51	E	A	-0.5131
52	Y	A	0.3738
53	M	A	0.1457
54	L	A	-0.2888
55	D	A	-1.3054
56	L	A	-0.2333
57	Q	A	-1.3039
58	P	A	-0.5660
59	E	A	-0.5361
60	T	A	-0.2860
61	G	A	-0.0975
62	P	A	0.0000
63	G	A	-0.7951
64	P	A	-1.0173
65	G	A	-1.5325
66	L	A	0.0000
67	Q	A	-1.9918
68	D	A	-2.0246
69	I	A	0.0000
70	V	A	-1.0008
71	L	A	0.0000
72	H	A	-0.8684
73	L	A	0.0000
74	E	A	-2.5925
75	P	A	-2.8893
76	Q	A	-3.0881
77	N	A	-2.4177
78	E	A	-1.9663
79	I	A	0.0000
80	P	A	-0.9650
81	G	A	-0.7980
82	P	A	0.0000
83	G	A	-0.7666
84	P	A	-1.0126
85	G	A	-1.6081
86	A	A	0.0000
87	E	A	-3.1932
88	K	A	-3.2226
89	L	A	0.0000
90	R	A	-2.2246
91	H	A	0.0000
92	L	A	-0.5493
93	N	A	0.0000
94	E	A	-3.1477
95	K	A	0.0000
96	R	A	-4.1764
97	R	A	-3.5909
98	F	A	-1.6558
99	H	A	-1.5265
100	N	A	-1.5804
101	G	A	0.0000
102	P	A	0.0000
103	G	A	-0.7343
104	P	A	-0.9174
105	G	A	-1.4980
106	L	A	0.0000
107	D	A	-2.5220
108	K	A	-3.2010
109	K	A	0.0000
110	Q	A	-2.1032
111	R	A	0.0000
112	F	A	-0.8236
113	H	A	0.0000
114	N	A	-1.6041
115	I	A	0.0000
116	R	A	-4.2530
117	G	A	-3.8500
118	R	A	-3.3836
119	W	A	0.0000
120	T	A	-0.5344
121	G	A	0.0000
122	P	A	0.0000
123	G	A	-0.4974
124	P	A	-0.7926
125	G	A	-1.1263
126	N	A	0.0000
127	P	A	-1.1032
128	A	A	-1.8600
129	E	A	-2.0366
130	K	A	-2.7523
131	L	A	0.0000
132	R	A	-1.9316
133	H	A	0.0000
134	L	A	-0.2653
135	N	A	0.0000
136	E	A	-2.5521
137	K	A	-2.7934
138	R	A	-2.8815
139	R	A	-0.8146
140	F	A	0.9132
141	G	A	0.0000
142	P	A	-0.1401
143	G	A	0.0000
144	P	A	-0.7731
145	G	A	-0.5800
146	S	A	0.0000
147	K	A	-1.3760
148	I	A	-0.8421
149	S	A	-1.3925
150	E	A	-2.5597
151	Y	A	-1.9275
152	R	A	-2.3937
153	H	A	-0.3451
154	Y	A	0.9833
155	C	A	0.0000
156	Y	A	1.0710
157	S	A	0.4596
158	L	A	0.9127
159	Y	A	0.6914
160	G	A	0.1688
161	G	A	0.1923
162	P	A	-0.0873
163	G	A	-0.6720
164	P	A	-0.4824
165	G	A	-0.4585
166	V	A	0.3058
167	Y	A	0.4380
168	D	A	-0.9720
169	F	A	0.0266
170	A	A	-0.1868
171	F	A	0.5464
172	R	A	-1.1824
173	D	A	-1.1908
174	L	A	0.0971
175	A	A	-0.1513
176	A	A	-0.2911
177	Y	A	-0.0198
178	R	A	-0.3081
179	F	A	-0.2385
180	H	A	-0.9437
181	N	A	-1.1264
182	I	A	-0.0662
183	A	A	-0.3136
184	G	A	-0.8639
185	H	A	-0.3289
186	Y	A	1.0433
187	A	A	0.8950
188	A	A	1.2595
189	Y	A	2.2706
190	C	A	2.5696
191	Y	A	2.5320
192	S	A	1.9434
193	L	A	2.3150
194	Y	A	1.8686
195	G	A	0.5968
196	T	A	0.7321
197	T	A	0.5844
198	L	A	1.3220
199	A	A	0.8063
200	A	A	1.0836
201	Y	A	1.7149
202	K	A	-0.0858
203	T	A	0.6724
204	V	A	1.8803
205	L	A	0.8261
206	E	A	-0.8189
207	L	A	1.1802
208	T	A	0.1759
209	E	A	-1.1708
210	V	A	0.1157
211	A	A	-0.1847
212	A	A	-0.7216
213	Y	A	0.0861
214	Y	A	-0.3934
215	R	A	-1.4361
216	A	A	-0.7024
217	H	A	-0.9302
218	Y	A	0.0533
219	N	A	0.0746
220	I	A	2.0128
221	V	A	2.5766
222	T	A	1.4171
223	F	A	1.1808
224	A	A	1.4468
225	A	A	1.1640
226	Y	A	1.0368
227	T	A	1.2626
228	L	A	2.1242
229	Q	A	0.8831
230	D	A	1.2766
231	I	A	2.9936
232	V	A	3.2388
233	L	A	2.3573
234	H	A	1.8824
235	L	A	3.0651
236	A	A	2.7246
237	A	A	2.5446
238	Y	A	3.3268
239	L	A	3.4295
240	L	A	3.4141
241	M	A	3.2254
242	G	A	2.4589
243	T	A	2.7016
244	L	A	3.3954
245	G	A	2.3278
246	I	A	3.3606
247	V	A	3.0721
248	A	A	2.0562
249	A	A	2.0081
250	Y	A	2.0617
251	L	A	1.0404
252	P	A	-0.4232
253	A	A	-1.0596
254	R	A	-2.6357
255	R	A	-3.0099
256	A	A	-2.4611
257	E	A	-3.1210
258	P	A	-1.9286
259	Q	A	-1.5725
260	A	A	-0.5618
261	A	A	0.4274
262	Y	A	1.2008