Project name: bc632f9d12a43b

Chain sequence(s)	A: MSKVGGGGSGGSTVANIAPVFTGDCKTIPTPEECATFLYKVVNSGGWEKCWVEEVIPWDLGVPTPLVLHLVKNNALPNGKGLVPGCGGGYDVVAMANPERFMVGLDISENALKKARETFSTMPNSSCFSFVKEDVFTWRPEQPFDFIFDYVFFCAIDPKMRPAWGKAYELLKPDGELITLMYPITNHEGGPPFSVSESEYEKVLVPLGFKQLSLEDYSDLAVEPRKGKEKLARWKKMNN
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                                          (00:03:03)
[INFO]       Main:     Simulation completed successfully.                                          (00:03:04)

• Minimal score value: -2.9985
• Maximal score value: 2.0043
• Average score: -0.6788
• Total score value: -162.2226

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	M	A	0.7282
2	S	A	-0.0722
3	K	A	-0.8767
4	V	A	0.5864
5	G	A	-0.3450
6	G	A	-0.8532
7	G	A	-0.9543
8	G	A	-1.1754
9	S	A	-1.0027
10	G	A	-1.0686
11	G	A	-0.7074
12	S	A	-0.1149
13	T	A	0.3090
14	V	A	1.3390
15	A	A	0.3433
16	N	A	-0.6854
17	I	A	0.1492
18	A	A	0.2028
19	P	A	0.8486
20	V	A	2.0043
21	F	A	1.0606
22	T	A	0.0914
23	G	A	-1.0269
24	D	A	-1.9855
25	C	A	-0.9942
26	K	A	-1.1462
27	T	A	-0.8005
28	I	A	0.0000
29	P	A	-0.9271
30	T	A	-1.2981
31	P	A	0.0000
32	E	A	-2.0350
33	E	A	-1.9219
34	C	A	0.0000
35	A	A	0.0000
36	T	A	-0.9069
37	F	A	-0.0438
38	L	A	0.0000
39	Y	A	-0.2289
40	K	A	-1.5185
41	V	A	-1.0210
42	V	A	-0.7381
43	N	A	-1.6758
44	S	A	-1.2572
45	G	A	-1.0468
46	G	A	-0.7196
47	W	A	-0.0196
48	E	A	-0.9344
49	K	A	-1.0989
50	C	A	0.0000
51	W	A	0.0000
52	V	A	-0.2049
53	E	A	-1.8994
54	E	A	-2.1083
55	V	A	-0.6035
56	I	A	0.0000
57	P	A	-0.3181
58	W	A	0.1685
59	D	A	0.0000
60	L	A	0.0000
61	G	A	-0.5006
62	V	A	-0.2930
63	P	A	0.0000
64	T	A	0.0000
65	P	A	0.0839
66	L	A	0.0000
67	V	A	0.0000
68	L	A	-0.3296
69	H	A	-0.9980
70	L	A	0.0000
71	V	A	-1.3331
72	K	A	-2.5197
73	N	A	-2.6118
74	N	A	-2.4466
75	A	A	-1.4413
76	L	A	0.0000
77	P	A	-1.2111
78	N	A	-2.1380
79	G	A	-1.3711
80	K	A	-0.8816
81	G	A	0.0000
82	L	A	0.0000
83	V	A	0.0000
84	P	A	0.0000
85	G	A	-0.0475
86	C	A	0.2697
87	G	A	0.0000
88	G	A	0.0000
89	G	A	0.0000
90	Y	A	0.1974
91	D	A	-0.0025
92	V	A	0.0000
93	V	A	0.0000
94	A	A	0.0000
95	M	A	0.0000
96	A	A	0.0000
97	N	A	-1.0213
98	P	A	-1.1108
99	E	A	-2.2954
100	R	A	0.0000
101	F	A	-0.1086
102	M	A	0.0000
103	V	A	0.0000
104	G	A	0.0000
105	L	A	0.0000
106	D	A	-0.4949
107	I	A	0.2230
108	S	A	0.0000
109	E	A	-2.1166
110	N	A	-1.4903
111	A	A	0.0000
112	L	A	0.0000
113	K	A	-2.9235
114	K	A	-2.4130
115	A	A	0.0000
116	R	A	-2.7113
117	E	A	-2.9613
118	T	A	-1.6415
119	F	A	0.0000
120	S	A	-1.1965
121	T	A	-0.6346
122	M	A	0.2793
123	P	A	-0.1080
124	N	A	0.0000
125	S	A	-0.2817
126	S	A	-0.2174
127	C	A	-0.1640
128	F	A	0.0000
129	S	A	-0.0582
130	F	A	0.0000
131	V	A	-0.5481
132	K	A	-1.6547
133	E	A	-1.4816
134	D	A	-0.9571
135	V	A	0.0000
136	F	A	-0.4294
137	T	A	-0.6267
138	W	A	-1.2935
139	R	A	-2.4507
140	P	A	-1.8895
141	E	A	-2.5645
142	Q	A	-2.0828
143	P	A	-1.7706
144	F	A	0.0000
145	D	A	-1.3550
146	F	A	0.0000
147	I	A	0.0000
148	F	A	0.0000
149	D	A	0.0000
150	Y	A	0.2892
151	V	A	0.4963
152	F	A	0.3601
153	F	A	0.0000
154	C	A	0.0000
155	A	A	0.1906
156	I	A	0.0000
157	D	A	-1.2036
158	P	A	-1.1848
159	K	A	-1.8567
160	M	A	-0.7269
161	R	A	0.0000
162	P	A	-0.8934
163	A	A	-0.3882
164	W	A	0.0000
165	G	A	0.0000
166	K	A	-1.1865
167	A	A	0.0000
168	Y	A	-1.2779
169	E	A	-2.2912
170	L	A	0.0000
171	L	A	0.0000
172	K	A	-1.9917
173	P	A	-2.0703
174	D	A	-2.5563
175	G	A	0.0000
176	E	A	0.0000
177	L	A	0.0000
178	I	A	0.0000
179	T	A	0.0000
180	L	A	0.0000
181	M	A	0.0000
182	Y	A	0.0000
183	P	A	0.0000
184	I	A	-0.2231
185	T	A	-0.9377
186	N	A	-1.8194
187	H	A	-2.0591
188	E	A	-2.4883
189	G	A	-1.4642
190	G	A	-0.8497
191	P	A	0.0000
192	P	A	0.0000
193	F	A	-0.5457
194	S	A	-0.8392
195	V	A	0.0000
196	S	A	-0.7254
197	E	A	-1.0541
198	S	A	-1.3960
199	E	A	-1.6175
200	Y	A	0.0000
201	E	A	-1.9187
202	K	A	-2.0343
203	V	A	-0.9270
204	L	A	0.0000
205	V	A	0.0789
206	P	A	-0.1874
207	L	A	-0.3326
208	G	A	-0.5280
209	F	A	0.0000
210	K	A	-1.4233
211	Q	A	-0.4007
212	L	A	0.7115
213	S	A	0.4902
214	L	A	0.1823
215	E	A	-1.2142
216	D	A	-2.4547
217	Y	A	-1.6229
218	S	A	-2.2818
219	D	A	-2.3773
220	L	A	-1.0570
221	A	A	-1.6198
222	V	A	-1.4131
223	E	A	-2.5663
224	P	A	-1.6803
225	R	A	0.0000
226	K	A	-2.9985
227	G	A	-2.1172
228	K	A	-1.3262
229	E	A	0.0000
230	K	A	-1.3145
231	L	A	0.0000
232	A	A	0.0000
233	R	A	-0.1724
234	W	A	0.0000
235	K	A	-1.4873
236	K	A	-1.9308
237	M	A	-1.3735
238	N	A	-2.1601
239	N	A	-1.8260