Project name: 18_x11e6_x4e7_i14e7_i20e6

Chain sequence(s)	A: GPGPGAEKLRHLNEKRRFHNGPGPGLDKKQRFHNIRGRWTGPGPGNPAEKLRHLNEKRRFGPGPGSKISEYRHYCYSLYGGPGPGLLCHEQLSDSEEENDGPGPGQSTHVDIRTLEDLLMGPGPGTPTLHEYMLDLQPETGPGPGLQDIVLHLEPQNEIPGPGPGYRAHYNIVTFAAYTLQDIVLHLAAYLLMGTLGIVAAYLPARRAEPQAAYVYDFAFRDLAAYRFHNIAGHYAAYCYSLYGTTLAAYKTVLELTEVAAY
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                                          (00:04:17)
[INFO]       Main:     Simulation completed successfully.                                          (00:04:19)

• Minimal score value: -3.7675
• Maximal score value: 3.3915
• Average score: -0.3302
• Total score value: -86.5076

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	-0.7060
2	P	A	-1.2434
3	G	A	-1.0847
4	P	A	-1.0485
5	G	A	-1.5147
6	A	A	-1.7946
7	E	A	-3.0591
8	K	A	-3.1683
9	L	A	-2.3978
10	R	A	-3.2419
11	H	A	-2.2299
12	L	A	-0.9147
13	N	A	-2.2093
14	E	A	-2.7090
15	K	A	-3.6069
16	R	A	-3.6794
17	R	A	-3.0099
18	F	A	-0.8355
19	H	A	-1.4179
20	N	A	-1.8807
21	G	A	-1.1622
22	P	A	-0.9368
23	G	A	-0.9905
24	P	A	-0.8337
25	G	A	-0.8596
26	L	A	-1.1756
27	D	A	-1.5731
28	K	A	-2.3302
29	K	A	-2.9339
30	Q	A	-3.0442
31	R	A	-2.9478
32	F	A	-2.3092
33	H	A	-2.0685
34	N	A	-1.7987
35	I	A	-2.0113
36	R	A	-3.2525
37	G	A	-3.0532
38	R	A	-3.1562
39	W	A	-1.8014
40	T	A	-1.5230
41	G	A	-1.3964
42	P	A	-1.1313
43	G	A	-1.0232
44	P	A	-0.8904
45	G	A	-0.9820
46	N	A	-0.9391
47	P	A	-0.7700
48	A	A	0.0000
49	E	A	-1.6325
50	K	A	-2.2529
51	L	A	-1.7795
52	R	A	-1.7703
53	H	A	-1.4540
54	L	A	-1.0228
55	N	A	-1.2845
56	E	A	0.0000
57	K	A	-2.4253
58	R	A	-2.5043
59	R	A	-2.4278
60	F	A	-0.9375
61	G	A	-0.8443
62	P	A	-0.7236
63	G	A	-1.0906
64	P	A	-1.6354
65	G	A	-1.9167
66	S	A	-1.9152
67	K	A	-2.7042
68	I	A	-2.2558
69	S	A	-1.9264
70	E	A	-1.9739
71	Y	A	-1.2487
72	R	A	-1.5862
73	H	A	-0.8724
74	Y	A	-0.7112
75	C	A	-0.5755
76	Y	A	-0.7112
77	S	A	-0.3156
78	L	A	0.1574
79	Y	A	0.6260
80	G	A	0.1669
81	G	A	-0.5116
82	P	A	-0.8088
83	G	A	-0.8359
84	P	A	-0.0968
85	G	A	0.5075
86	L	A	1.2564
87	L	A	0.7492
88	C	A	-0.1315
89	H	A	-0.9371
90	E	A	-1.2966
91	Q	A	-1.1758
92	L	A	-0.6247
93	S	A	-0.5466
94	D	A	-1.2332
95	S	A	-1.2463
96	E	A	-2.3009
97	E	A	-2.8809
98	E	A	-3.7675
99	N	A	-3.4188
100	D	A	-3.6021
101	G	A	-2.4812
102	P	A	-1.3527
103	G	A	-1.4489
104	P	A	-1.4127
105	G	A	-2.3977
106	Q	A	-2.7111
107	S	A	-2.3847
108	T	A	-1.7180
109	H	A	-1.5322
110	V	A	-0.0163
111	D	A	-0.4974
112	I	A	0.7034
113	R	A	-1.1996
114	T	A	-1.0303
115	L	A	-0.7847
116	E	A	-2.2844
117	D	A	-1.4727
118	L	A	0.5220
119	L	A	1.6201
120	M	A	1.3623
121	G	A	0.2159
122	P	A	-0.5625
123	G	A	-0.8509
124	P	A	-0.8383
125	G	A	-0.8558
126	T	A	-0.4069
127	P	A	-0.1416
128	T	A	0.0228
129	L	A	0.6855
130	H	A	-0.7269
131	E	A	-0.8490
132	Y	A	1.0891
133	M	A	1.5552
134	L	A	1.6089
135	D	A	-0.1756
136	L	A	0.3333
137	Q	A	-1.3168
138	P	A	-1.5999
139	E	A	-2.1855
140	T	A	-1.4968
141	G	A	-1.2297
142	P	A	-0.8583
143	G	A	-0.7666
144	P	A	-0.6120
145	G	A	-0.5772
146	L	A	0.4176
147	Q	A	-0.6903
148	D	A	-0.3269
149	I	A	2.1957
150	V	A	2.7188
151	L	A	2.4776
152	H	A	0.7391
153	L	A	0.6083
154	E	A	-1.7511
155	P	A	-1.9678
156	Q	A	-2.3946
157	N	A	-2.6039
158	E	A	-1.8786
159	I	A	0.4237
160	P	A	-0.0757
161	G	A	-0.5454
162	P	A	-0.6345
163	G	A	-0.7477
164	P	A	-0.6151
165	G	A	-0.4063
166	Y	A	0.2599
167	R	A	-1.2273
168	A	A	-0.4153
169	H	A	-0.0980
170	Y	A	1.1201
171	N	A	0.4896
172	I	A	2.4170
173	V	A	2.4682
174	T	A	2.0936
175	F	A	3.3915
176	A	A	2.2999
177	A	A	1.8251
178	Y	A	2.2733
179	T	A	1.9889
180	L	A	2.7977
181	Q	A	1.2940
182	D	A	1.4363
183	I	A	3.2237
184	V	A	3.2868
185	L	A	2.8313
186	H	A	1.8198
187	L	A	3.1821
188	A	A	2.8295
189	A	A	2.6377
190	Y	A	3.3486
191	L	A	3.3868
192	L	A	3.1221
193	M	A	3.1628
194	G	A	2.2674
195	T	A	2.4841
196	L	A	3.0649
197	G	A	1.9273
198	I	A	2.7455
199	V	A	2.9527
200	A	A	1.8504
201	A	A	1.4599
202	Y	A	1.4107
203	L	A	1.0032
204	P	A	-0.3723
205	A	A	-0.8439
206	R	A	-1.6989
207	R	A	-2.3344
208	A	A	-1.6547
209	E	A	-1.9914
210	P	A	-1.3921
211	Q	A	-0.8097
212	A	A	-0.0880
213	A	A	0.0000
214	Y	A	1.6254
215	V	A	2.7351
216	Y	A	1.6998
217	D	A	0.7081
218	F	A	1.8436
219	A	A	0.9998
220	F	A	0.6647
221	R	A	-1.2882
222	D	A	-1.3876
223	L	A	0.0665
224	A	A	-0.6766
225	A	A	-0.7397
226	Y	A	-0.0278
227	R	A	-1.1150
228	F	A	-0.1138
229	H	A	-0.7501
230	N	A	-0.8726
231	I	A	0.6466
232	A	A	0.3909
233	G	A	-0.4048
234	H	A	0.1130
235	Y	A	1.5619
236	A	A	1.5521
237	A	A	1.4180
238	Y	A	2.3262
239	C	A	2.3149
240	Y	A	2.6062
241	S	A	2.0044
242	L	A	2.7189
243	Y	A	2.3432
244	G	A	1.0484
245	T	A	1.0924
246	T	A	1.0955
247	L	A	1.5657
248	A	A	0.8200
249	A	A	1.3000
250	Y	A	1.3832
251	K	A	-0.1952
252	T	A	0.1123
253	V	A	0.5183
254	L	A	0.1230
255	E	A	-1.0748
256	L	A	0.6180
257	T	A	0.1231
258	E	A	-0.6300
259	V	A	1.3932
260	A	A	0.9064
261	A	A	0.8124
262	Y	A	1.5007