Project name: c024cfe42534690

Chain sequence(s)	A: MFPCLHHSQNLLRAVSNMLQKARQTLEFYPCTSEEIDHEDITKDKTSTVEACLPLELTKNESCLNSRETSFITNGSCLASRKTSFMMALCLSSIYEDLKMYQVEFKTMNAKLLMDPKRQIFLDQNMLAVIDELMQALNFNSETVPQKSSLEEPDFYKTKIKLCILLHAFRIRAVTIDRVMSYLNA
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                                          (00:05:03)
[INFO]       Main:     Simulation completed successfully.                                          (00:05:05)

• Minimal score value: -3.4721
• Maximal score value: 1.7719
• Average score: -0.7685
• Total score value: -142.1786

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
34	M	A	0.8161
35	F	A	0.2999
36	P	A	-0.2641
37	C	A	0.0000
38	L	A	-0.5114
39	H	A	-0.8233
40	H	A	-1.1336
41	S	A	0.0000
42	Q	A	-1.5664
43	N	A	-1.3940
44	L	A	0.0000
45	L	A	-1.0196
46	R	A	-2.3730
47	A	A	-1.7732
48	V	A	0.0000
49	S	A	-1.8076
50	N	A	-2.3373
51	M	A	0.0000
52	L	A	0.0000
53	Q	A	-2.5028
54	K	A	-2.0885
55	A	A	0.0000
56	R	A	-2.2257
57	Q	A	-2.4151
58	T	A	-1.5802
59	L	A	0.0000
60	E	A	-1.4020
61	F	A	0.9054
62	Y	A	0.5685
63	P	A	-0.5409
64	C	A	0.0000
65	T	A	-1.5940
66	S	A	-2.0246
67	E	A	-3.2015
68	E	A	-3.2135
69	I	A	-2.6021
70	D	A	-3.4721
71	H	A	-3.0605
72	E	A	-3.1910
73	D	A	-2.2915
74	I	A	-1.0922
75	T	A	0.0000
76	K	A	-2.8866
77	D	A	-2.9361
78	K	A	-2.2935
79	T	A	0.0000
80	S	A	0.0000
81	T	A	0.0000
82	V	A	0.9751
83	E	A	-0.1265
84	A	A	0.0000
85	C	A	0.0000
86	L	A	0.5375
87	P	A	0.1129
88	L	A	-0.0543
89	E	A	-1.1266
90	L	A	0.3558
91	T	A	-1.1961
92	K	A	-2.7858
93	N	A	-2.7778
94	E	A	-3.4184
95	S	A	-2.0532
96	C	A	-1.4632
97	L	A	0.0000
98	N	A	-2.2304
99	S	A	-1.9803
100	R	A	-2.4229
101	E	A	-1.9000
102	T	A	-0.4211
103	S	A	0.1591
104	F	A	1.7719
105	I	A	1.1818
106	T	A	0.4849
107	N	A	-0.4744
108	G	A	0.0000
109	S	A	-0.0788
110	C	A	0.0000
111	L	A	-0.6626
112	A	A	-1.3695
113	S	A	-1.8338
114	R	A	-2.7105
115	K	A	-2.5984
116	T	A	-1.2693
117	S	A	-0.5828
118	F	A	0.0311
119	M	A	0.0000
120	M	A	0.0000
121	A	A	0.1638
122	L	A	0.0000
123	C	A	0.0000
124	L	A	0.0000
125	S	A	0.0000
126	S	A	0.0000
127	I	A	0.0000
128	Y	A	0.0000
129	E	A	-0.4575
130	D	A	0.0000
131	L	A	0.0000
132	K	A	-0.6969
133	M	A	0.0556
134	Y	A	0.0000
135	Q	A	0.0000
136	V	A	0.1550
137	E	A	-0.2005
138	F	A	0.0000
139	K	A	-0.9325
140	T	A	-0.7226
141	M	A	0.0000
142	N	A	-0.3083
143	A	A	-0.4272
144	K	A	-1.0596
145	L	A	0.0000
146	L	A	0.0894
147	M	A	-0.8373
148	D	A	-1.4213
149	P	A	-1.4344
150	K	A	-2.7283
151	R	A	-2.5297
152	Q	A	-1.4641
153	I	A	0.0000
154	F	A	0.3213
155	L	A	0.0000
156	D	A	-1.3698
157	Q	A	-1.8868
158	N	A	-1.9811
159	M	A	0.0000
160	L	A	0.0000
161	A	A	-1.2187
162	V	A	-1.0364
163	I	A	0.0000
164	D	A	-1.7126
165	E	A	-1.6599
166	L	A	0.0000
167	M	A	0.0000
168	Q	A	-1.2438
169	A	A	-0.6049
170	L	A	0.0000
171	N	A	0.0000
172	F	A	0.6061
173	N	A	-1.0932
174	S	A	-1.4356
175	E	A	-2.1854
176	T	A	-1.3708
177	V	A	-0.8643
178	P	A	-1.1291
179	Q	A	-1.6422
180	K	A	-1.4839
181	S	A	-0.8431
182	S	A	-0.6106
183	L	A	0.1799
184	E	A	-2.0417
185	E	A	-2.8267
186	P	A	-2.1489
187	D	A	-2.2578
188	F	A	-0.9062
189	Y	A	0.1002
190	K	A	-1.5442
191	T	A	0.0000
192	K	A	0.0000
193	I	A	-0.0755
194	K	A	-0.8579
195	L	A	0.0000
196	C	A	0.0000
197	I	A	-1.1429
198	L	A	0.0000
199	L	A	0.0000
200	H	A	0.0000
201	A	A	0.0000
202	F	A	0.0000
203	R	A	0.0043
204	I	A	1.1232
205	R	A	0.6391
206	A	A	0.0000
207	V	A	0.3449
208	T	A	0.3504
209	I	A	0.0000
210	D	A	-0.7504
211	R	A	-1.0654
212	V	A	0.0000
213	M	A	0.0000
214	S	A	-0.5568
215	Y	A	-0.0389
216	L	A	-0.0990
217	N	A	-0.3963
218	A	A	-0.0562