Project name: b88f01a635c563c

Chain sequence(s)	A: MNSILLVFAGILAVCLPASATQCNVNPVQIPKDWITMHRSCRNSMRQQIQMEVGASLQYLAMGAHFSKDVVNRPGFAQLFFDAASEEREHAMKLIEYLLMRGELTNDVSSLLQVRPPTRSSWKGGVEALEHALSMESDVTKSIRNVIKACEDDSEFNDYHLVDYLTGDFLEEQYKGQRDLAGKASTLKKLMDRHEALGEFIFDKKLLGIDV
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]                                                (00:00:01)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:01)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with A chain(s) selected             (00:00:01)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:01)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:01)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:02:44)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:45)

• Minimal score value: -3.74
• Maximal score value: 4.1271
• Average score: -0.6177
• Total score value: -130.3318

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	0.6125
2	N	A	-0.1409
3	S	A	0.9487
4	I	A	2.9822
5	L	A	3.4455
6	L	A	4.1271
7	V	A	3.9957
8	F	A	3.3461
9	A	A	2.2287
10	G	A	1.7878
11	I	A	3.0630
12	L	A	3.0522
13	A	A	2.6367
14	V	A	3.3347
15	C	A	2.5202
16	L	A	2.3173
17	P	A	0.9130
18	A	A	0.3934
19	S	A	-0.1909
20	A	A	-0.3231
21	T	A	-0.6229
22	Q	A	-1.1093
23	C	A	-0.2437
24	N	A	-0.7669
25	V	A	0.6341
26	N	A	-0.6064
27	P	A	0.2215
28	V	A	1.4660
29	Q	A	0.1502
30	I	A	1.0726
31	P	A	-0.5841
32	K	A	-1.8185
33	D	A	-1.7585
34	W	A	-0.1623
35	I	A	-0.0021
36	T	A	-0.2825
37	M	A	0.0000
38	H	A	-1.6789
39	R	A	-2.5161
40	S	A	-1.9060
41	C	A	0.0000
42	R	A	-2.0081
43	N	A	-2.4570
44	S	A	-1.9109
45	M	A	0.0000
46	R	A	-1.1577
47	Q	A	-1.6818
48	Q	A	0.0000
49	I	A	0.0000
50	Q	A	-0.4803
51	M	A	-0.4487
52	E	A	0.0000
53	V	A	0.0000
54	G	A	-0.3573
55	A	A	0.0000
56	S	A	0.0000
57	L	A	0.2919
58	Q	A	0.0000
59	Y	A	0.0000
60	L	A	0.8519
61	A	A	0.2693
62	M	A	0.0000
63	G	A	0.0000
64	A	A	-0.0624
65	H	A	0.0000
66	F	A	0.0000
67	S	A	-1.3978
68	K	A	-1.6344
69	D	A	-1.8291
70	V	A	0.3482
71	V	A	-0.6574
72	N	A	-1.6598
73	R	A	-1.1547
74	P	A	-1.0156
75	G	A	0.0000
76	F	A	0.0000
77	A	A	0.0000
78	Q	A	-1.0572
79	L	A	-0.3316
80	F	A	0.0000
81	F	A	-0.0241
82	D	A	-1.7091
83	A	A	-1.1900
84	A	A	0.0000
85	S	A	-1.5597
86	E	A	-2.2640
87	E	A	0.0000
88	R	A	-2.1897
89	E	A	-2.7094
90	H	A	0.0000
91	A	A	0.0000
92	M	A	-1.5110
93	K	A	-2.0156
94	L	A	0.0000
95	I	A	-0.4764
96	E	A	-1.4033
97	Y	A	0.0000
98	L	A	0.0000
99	L	A	0.5881
100	M	A	0.8755
101	R	A	0.5892
102	G	A	0.3209
103	E	A	-0.0878
104	L	A	-0.2497
105	T	A	-0.5649
106	N	A	-1.6544
107	D	A	-1.6762
108	V	A	0.4667
109	S	A	-0.1955
110	S	A	-0.5028
111	L	A	0.0000
112	L	A	0.2156
113	Q	A	-0.5647
114	V	A	0.3811
115	R	A	-1.3726
116	P	A	-0.9327
117	P	A	-0.6202
118	T	A	-0.7964
119	R	A	-0.8844
120	S	A	-0.5814
121	S	A	-0.9163
122	W	A	0.0000
123	K	A	-1.8674
124	G	A	-1.2669
125	G	A	0.0000
126	V	A	0.0000
127	E	A	-1.5921
128	A	A	0.0000
129	L	A	0.0000
130	E	A	-1.5942
131	H	A	-0.8788
132	A	A	0.0000
133	L	A	-1.0881
134	S	A	-0.8151
135	M	A	-0.9077
136	E	A	0.0000
137	S	A	-1.3048
138	D	A	-2.4935
139	V	A	0.0000
140	T	A	0.0000
141	K	A	-3.1436
142	S	A	-2.5029
143	I	A	0.0000
144	R	A	-3.1035
145	N	A	-2.9469
146	V	A	0.0000
147	I	A	-2.2398
148	K	A	-3.1711
149	A	A	-2.6114
150	C	A	0.0000
151	E	A	-2.6499
152	D	A	-3.2418
153	D	A	-2.6559
154	S	A	-1.8845
155	E	A	-2.2319
156	F	A	-1.3162
157	N	A	-1.8070
158	D	A	0.0000
159	Y	A	0.2202
160	H	A	-0.7540
161	L	A	0.0000
162	V	A	-1.1381
163	D	A	-1.8709
164	Y	A	-1.0716
165	L	A	0.0000
166	T	A	-1.8230
167	G	A	-2.0360
168	D	A	-2.2858
169	F	A	0.0000
170	L	A	0.0000
171	E	A	-2.9213
172	E	A	-2.7016
173	Q	A	0.0000
174	Y	A	-2.1068
175	K	A	-3.4793
176	G	A	-2.5919
177	Q	A	-2.1923
178	R	A	-3.3361
179	D	A	-3.2503
180	L	A	-1.9886
181	A	A	-1.7697
182	G	A	-1.7212
183	K	A	-1.5019
184	A	A	0.0000
185	S	A	-1.5001
186	T	A	-1.1309
187	L	A	0.0000
188	K	A	-3.1076
189	K	A	-3.1403
190	L	A	-2.2969
191	M	A	-2.9220
192	D	A	-3.7400
193	R	A	-3.5114
194	H	A	-2.7809
195	E	A	-2.8189
196	A	A	-0.2058
197	L	A	1.0779
198	G	A	0.0000
199	E	A	0.0000
200	F	A	0.9339
201	I	A	1.1422
202	F	A	0.0000
203	D	A	0.0000
204	K	A	-0.3247
205	K	A	-1.2234
206	L	A	-0.5182
207	L	A	-0.1759
208	G	A	-0.4940
209	I	A	0.0834
210	D	A	-0.8469
211	V	A	1.0235