Project name: 22_x4e7_i14e7_x11e6_i20e6

Chain sequence(s)	A: GPGPGLLCHEQLSDSEEENDGPGPGQSTHVDIRTLEDLLMGPGPGTPTLHEYMLDLQPETGPGPGLQDIVLHLEPQNEIPGPGPGRAHYNIVTFAAYTLQDIVLHLAAYLLMGTLGIVAAYLPARRAEPQAAYAEKLRHLNEKRRFHNGPGPGLDKKQRFHNIRGRWTGPGPGNPAEKLRHLNEKRRFGPGPGSKISEYRHYCYSLYGGPGPGVYDFAFRDLAAYRFHNIAGHYAAYCYSLYGTTLAAYKTVLELTEVAAY
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                                          (00:03:18)
[INFO]       Main:     Simulation completed successfully.                                          (00:03:20)

• Minimal score value: -4.6912
• Maximal score value: 3.793
• Average score: -0.3242
• Total score value: -84.6248

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	-0.6936
2	P	A	-0.7637
3	G	A	-0.9080
4	P	A	-0.4363
5	G	A	0.6376
6	L	A	2.1431
7	L	A	2.3107
8	C	A	0.9436
9	H	A	-1.4070
10	E	A	-2.4011
11	Q	A	-1.8343
12	L	A	-0.0909
13	S	A	-1.0769
14	D	A	-2.3894
15	S	A	-2.5067
16	E	A	-3.8803
17	E	A	-4.1385
18	E	A	-4.2779
19	N	A	-3.7719
20	D	A	-3.1687
21	G	A	-2.0692
22	P	A	-1.2144
23	G	A	-1.3144
24	P	A	-1.1176
25	G	A	-1.3843
26	Q	A	-1.7905
27	S	A	-1.0220
28	T	A	-0.6437
29	H	A	-0.3414
30	V	A	1.2925
31	D	A	0.3702
32	I	A	1.1724
33	R	A	-1.1473
34	T	A	-0.1501
35	L	A	1.0726
36	E	A	-0.9363
37	D	A	-1.1139
38	L	A	1.3498
39	L	A	1.8423
40	M	A	1.1835
41	G	A	0.2697
42	P	A	-0.3974
43	G	A	-0.7917
44	P	A	-0.8691
45	G	A	-0.8443
46	T	A	-0.3785
47	P	A	-0.2175
48	T	A	0.0463
49	L	A	0.6300
50	H	A	-0.7322
51	E	A	-0.8428
52	Y	A	0.9968
53	M	A	1.6594
54	L	A	1.5294
55	D	A	-0.1575
56	L	A	0.5523
57	Q	A	-1.2570
58	P	A	-1.4105
59	E	A	-2.3729
60	T	A	-1.3467
61	G	A	-1.2050
62	P	A	-0.8323
63	G	A	-0.7772
64	P	A	-0.6556
65	G	A	-0.4808
66	L	A	0.4466
67	Q	A	-0.7184
68	D	A	-0.3449
69	I	A	2.2203
70	V	A	2.7586
71	L	A	2.5114
72	H	A	0.7597
73	L	A	0.6417
74	E	A	-1.6521
75	P	A	-1.8967
76	Q	A	-2.4366
77	N	A	-2.5707
78	E	A	-1.9371
79	I	A	0.3770
80	P	A	-0.2633
81	G	A	-0.5840
82	P	A	-0.8393
83	G	A	-1.2704
84	P	A	-1.2648
85	G	A	-1.8198
86	R	A	-2.2923
87	A	A	-1.2788
88	H	A	-0.9999
89	Y	A	1.2026
90	N	A	1.0878
91	I	A	3.1399
92	V	A	3.3027
93	T	A	2.7408
94	F	A	3.7930
95	A	A	2.5985
96	A	A	2.0482
97	Y	A	2.3307
98	T	A	1.8720
99	L	A	2.4586
100	Q	A	0.9725
101	D	A	0.6467
102	I	A	2.9308
103	V	A	3.3381
104	L	A	2.6204
105	H	A	1.8615
106	L	A	3.2388
107	A	A	2.7551
108	A	A	2.6383
109	Y	A	3.3224
110	L	A	3.1534
111	L	A	3.0221
112	M	A	3.3257
113	G	A	2.4576
114	T	A	2.7770
115	L	A	3.5893
116	G	A	2.5342
117	I	A	3.6090
118	V	A	3.7108
119	A	A	2.3617
120	A	A	2.0094
121	Y	A	2.1387
122	L	A	1.0423
123	P	A	-0.6635
124	A	A	-1.2150
125	R	A	-2.8832
126	R	A	-3.2614
127	A	A	-2.6471
128	E	A	-3.2116
129	P	A	-2.1583
130	Q	A	-2.4175
131	A	A	-1.5799
132	A	A	-1.1469
133	Y	A	-0.7781
134	A	A	-1.4045
135	E	A	-2.8855
136	K	A	-2.4824
137	L	A	-1.9789
138	R	A	-3.9359
139	H	A	-4.0727
140	L	A	-3.1465
141	N	A	-3.9923
142	E	A	-4.4997
143	K	A	-4.3010
144	R	A	-4.6912
145	R	A	-4.0757
146	F	A	-1.6646
147	H	A	-2.7059
148	N	A	-2.8142
149	G	A	-1.7128
150	P	A	-1.0138
151	G	A	-0.9832
152	P	A	-0.6588
153	G	A	-0.6836
154	L	A	-0.8451
155	D	A	-3.0410
156	K	A	-3.7296
157	K	A	-3.9314
158	Q	A	-3.6650
159	R	A	-3.5175
160	F	A	-2.1722
161	H	A	-3.2485
162	N	A	-3.1026
163	I	A	-1.9374
164	R	A	-2.7334
165	G	A	-2.3346
166	R	A	-2.4097
167	W	A	-0.5994
168	T	A	-0.7701
169	G	A	-0.9482
170	P	A	-0.6757
171	G	A	-1.0107
172	P	A	-1.1287
173	G	A	-1.4140
174	N	A	-2.2836
175	P	A	-1.9227
176	A	A	-2.0328
177	E	A	-3.1217
178	K	A	-2.7252
179	L	A	-1.1038
180	R	A	-3.1567
181	H	A	-2.9947
182	L	A	-1.6717
183	N	A	-3.0965
184	E	A	-3.9156
185	K	A	-3.8109
186	R	A	-3.7680
187	R	A	-3.0717
188	F	A	-0.5552
189	G	A	-0.9861
190	P	A	-0.9256
191	G	A	-1.2195
192	P	A	-0.9520
193	G	A	-1.0571
194	S	A	-1.1155
195	K	A	-1.4834
196	I	A	0.2953
197	S	A	-0.8685
198	E	A	-1.6822
199	Y	A	0.3134
200	R	A	-0.8042
201	H	A	-0.3668
202	Y	A	1.2979
203	C	A	1.3998
204	Y	A	1.9264
205	S	A	1.3577
206	L	A	2.5051
207	Y	A	2.1770
208	G	A	0.6036
209	G	A	0.2324
210	P	A	-0.2459
211	G	A	-0.5052
212	P	A	-0.1479
213	G	A	0.1449
214	V	A	1.8401
215	Y	A	1.3400
216	D	A	-0.2301
217	F	A	1.3458
218	A	A	1.0395
219	F	A	1.3766
220	R	A	-1.2270
221	D	A	-1.1391
222	L	A	0.2317
223	A	A	0.0359
224	A	A	-0.1359
225	Y	A	0.3660
226	R	A	-0.7533
227	F	A	0.9330
228	H	A	-0.2563
229	N	A	-0.6894
230	I	A	0.7953
231	A	A	0.6022
232	G	A	-0.2939
233	H	A	0.2646
234	Y	A	1.5724
235	A	A	1.2665
236	A	A	1.5455
237	Y	A	2.3471
238	C	A	2.2471
239	Y	A	2.4336
240	S	A	1.9299
241	L	A	2.3444
242	Y	A	2.6188
243	G	A	1.6768
244	T	A	1.1253
245	T	A	1.5158
246	L	A	2.0912
247	A	A	1.0916
248	A	A	1.0638
249	Y	A	1.7148
250	K	A	-0.1178
251	T	A	0.4177
252	V	A	2.0390
253	L	A	0.6782
254	E	A	-0.6436
255	L	A	1.4293
256	T	A	0.5386
257	E	A	-0.3839
258	V	A	1.6649
259	A	A	0.9763
260	A	A	0.8513
261	Y	A	1.4929