Project name: 1f0n_v2

Chain sequence(s)	A: SRPGLPVEYLQVPSPSMGRDIKVQFQSGGNNSPAVYLLDGLRAQDDESDWARHTPAFEWYYQSGLSIVMPVGGQSSFYSDWLKPACGKAGCQTYKWETFLTSELPQWLSANRAVKPTGSAAIGLSMAGSSAMILAAYHPQQFIYAGSLSALLDPSQGDGPAFLDKAMGDAGGYKAADMWGPSSDPAWERNDPTQQIPKLVANNTRLWVYCGNGTPNELGGATPAASALEAYLRSSNLKFQDAYNAAGGHNAVFNFPPNGTHSWEYWGAQLNAMKGDLQSSLGAG
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                                          (00:03:20)
[INFO]       Main:     Simulation completed successfully.                                          (00:03:21)

• Minimal score value: -3.568
• Maximal score value: 2.3759
• Average score: -0.6399
• Total score value: -181.7431

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
2	S	A	-1.4165
3	R	A	-2.2724
4	P	A	-1.4261
5	G	A	-1.0580
6	L	A	-0.6434
7	P	A	-0.1576
8	V	A	0.1329
9	E	A	-0.1775
10	Y	A	0.0456
11	L	A	0.0000
12	Q	A	-1.3407
13	V	A	0.0000
14	P	A	-1.2914
15	S	A	0.0000
16	P	A	-0.9394
17	S	A	-0.7004
18	M	A	0.0000
19	G	A	-1.3312
20	R	A	-1.8415
21	D	A	-2.1502
22	I	A	0.0000
23	K	A	-1.6040
24	V	A	0.0000
25	Q	A	0.0000
26	F	A	0.0000
27	Q	A	0.0000
28	S	A	-0.8125
29	G	A	-1.1464
30	G	A	-1.5936
31	N	A	-2.3535
32	N	A	-2.4994
33	S	A	0.0000
34	P	A	0.0000
35	A	A	0.0000
36	V	A	0.0000
37	Y	A	0.0000
38	L	A	0.0000
39	L	A	0.0000
40	D	A	0.0000
41	G	A	-0.7569
42	L	A	-1.1978
43	R	A	-2.6191
44	A	A	0.0000
45	Q	A	-3.0379
46	D	A	-3.5680
47	D	A	-3.2090
48	E	A	-2.5886
49	S	A	0.0000
50	D	A	-1.7321
51	W	A	0.0000
52	A	A	0.0000
53	R	A	-2.2139
54	H	A	-1.3194
55	T	A	0.0000
56	P	A	-1.1401
57	A	A	0.0000
58	F	A	0.0000
59	E	A	-1.2493
60	W	A	-0.5920
61	Y	A	0.0000
62	Y	A	-0.3159
63	Q	A	-1.1982
64	S	A	0.0000
65	G	A	-1.0332
66	L	A	0.0000
67	S	A	0.0000
68	I	A	0.0000
69	V	A	0.0000
70	M	A	0.0000
71	P	A	0.0000
72	V	A	0.0000
73	G	A	-2.0335
74	G	A	0.0000
75	Q	A	-1.5936
76	S	A	0.0000
77	S	A	0.0000
78	F	A	0.0000
79	Y	A	0.0000
80	S	A	0.0000
81	D	A	-0.6437
82	W	A	0.0000
83	L	A	-0.0031
84	K	A	-1.6651
85	P	A	-1.1222
86	A	A	0.0000
87	C	A	-0.7116
88	G	A	-1.1908
89	K	A	-1.9132
90	A	A	-0.8646
91	G	A	-0.5798
92	C	A	0.0301
93	Q	A	-0.7717
94	T	A	-0.7719
95	Y	A	0.0000
96	K	A	-0.8258
97	W	A	0.0000
98	E	A	0.0000
99	T	A	-0.4239
100	F	A	0.0000
101	L	A	0.0000
102	T	A	-0.4001
103	S	A	-0.6586
104	E	A	-0.8160
105	L	A	0.0000
106	P	A	0.0000
107	Q	A	-1.4949
108	W	A	-0.6224
109	L	A	0.0000
110	S	A	-1.3943
111	A	A	-0.7881
112	N	A	-1.0463
113	R	A	-1.5711
114	A	A	-1.7471
115	V	A	0.0000
116	K	A	-2.1946
117	P	A	-1.3553
118	T	A	-1.0117
119	G	A	-0.6383
120	S	A	0.0000
121	A	A	0.0000
122	A	A	0.0000
123	I	A	0.0000
124	G	A	0.0000
125	L	A	0.0000
126	S	A	-0.1593
127	M	A	0.0000
128	A	A	0.0000
129	G	A	0.0000
130	S	A	-0.0231
131	S	A	0.0000
132	A	A	0.0000
133	M	A	0.0000
134	I	A	0.0000
135	L	A	0.0000
136	A	A	0.0000
137	A	A	0.0000
138	Y	A	-0.1562
139	H	A	-0.5373
140	P	A	-0.9810
141	Q	A	-1.3891
142	Q	A	-0.9854
143	F	A	0.0000
144	I	A	-0.3845
145	Y	A	0.0000
146	A	A	0.0000
147	G	A	0.0000
148	S	A	0.0000
149	L	A	0.0000
150	S	A	0.0000
151	A	A	0.0000
152	L	A	0.1683
153	L	A	0.0000
154	D	A	-1.4654
155	P	A	0.0000
156	S	A	-1.7988
157	Q	A	-2.2875
158	G	A	-1.9453
159	D	A	-2.2668
160	G	A	0.0000
161	P	A	0.0000
162	A	A	-1.1692
163	F	A	-0.7543
164	L	A	-0.9915
165	D	A	-1.8948
166	K	A	-2.4337
167	A	A	-1.8302
168	M	A	0.0000
169	G	A	-2.3260
170	D	A	-2.9292
171	A	A	0.0000
172	G	A	-1.7607
173	G	A	-1.9951
174	Y	A	0.0000
175	K	A	-2.1622
176	A	A	0.0000
177	A	A	-0.9275
178	D	A	-1.1105
179	M	A	0.0000
180	W	A	0.0000
181	G	A	0.0000
182	P	A	-0.7852
183	S	A	-1.2181
184	S	A	-0.8615
185	D	A	-1.1621
186	P	A	-1.1535
187	A	A	-0.8621
188	W	A	0.0000
189	E	A	-2.1442
190	R	A	-1.4949
191	N	A	0.0000
192	D	A	0.0000
193	P	A	0.0000
194	T	A	-1.3388
195	Q	A	-1.7868
196	Q	A	0.0000
197	I	A	0.0000
198	P	A	-1.1003
199	K	A	-1.4899
200	L	A	0.0000
201	V	A	-1.2811
202	A	A	-0.9169
203	N	A	-1.4462
204	N	A	-1.5935
205	T	A	0.0000
206	R	A	-1.1962
207	L	A	0.0000
208	W	A	0.0000
209	V	A	0.0000
210	Y	A	0.0000
211	C	A	0.0000
212	G	A	0.0000
213	N	A	-0.4066
214	G	A	0.0000
215	T	A	-0.7228
216	P	A	-1.3042
217	N	A	-2.2023
218	E	A	-2.2807
219	L	A	-0.9904
220	G	A	-0.8991
221	G	A	-0.5553
222	A	A	-0.5749
223	T	A	-0.2189
224	P	A	-0.2132
225	A	A	0.0090
226	A	A	0.0000
227	S	A	-0.0254
228	A	A	0.3099
229	L	A	0.5022
230	E	A	0.0000
231	A	A	0.0888
232	Y	A	0.5759
233	L	A	0.0000
234	R	A	-0.4319
235	S	A	-0.5647
236	S	A	-0.9015
237	N	A	0.0000
238	L	A	-0.3483
239	K	A	-2.2727
240	F	A	0.0000
241	Q	A	-1.1287
242	D	A	-2.6391
243	A	A	-1.8200
244	Y	A	0.0000
245	N	A	-2.3962
246	A	A	-1.2778
247	A	A	-0.9275
248	G	A	-1.1276
249	G	A	-1.7427
250	H	A	-1.6924
251	N	A	-1.1770
252	A	A	-0.0793
253	V	A	1.2864
254	F	A	2.3759
255	N	A	1.0349
256	F	A	0.8184
257	P	A	0.0589
258	P	A	-0.5761
259	N	A	-0.7616
260	G	A	0.0000
261	T	A	0.0000
262	H	A	-0.0803
263	S	A	0.0903
264	W	A	0.1300
265	E	A	-0.0934
266	Y	A	0.0000
267	W	A	0.0000
268	G	A	0.0000
269	A	A	-0.1081
270	Q	A	0.0000
271	L	A	0.0000
272	N	A	-0.7323
273	A	A	-0.6908
274	M	A	0.0000
275	K	A	-1.3545
276	G	A	-1.5971
277	D	A	-1.9509
278	L	A	0.0000
279	Q	A	-1.3379
280	S	A	-1.1942
281	S	A	-0.8594
282	L	A	-0.5524
283	G	A	-0.8313
284	A	A	-0.9856
285	G	A	-0.8972