Project name: 7654b5ceb78c22a

Chain sequence(s)	A: KFNKEQQNAFYEILHLPNLNEEQRNAFIQSLKDDPSQSANLLAEAKKLNEQQAAFYEILSLPNLNEEQRNAFIQSLKDDPSQSANLLAEAKKLNEQQAAFYEILHLPNLNEEQRNAFIQSLKDDPSQSANLLAEAKKLNEQQAAFYEILHLPNLNEEQRNAFIQSLKDDPSQSANLLAEAKKLNDAQA
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                                          (00:02:32)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:32)

• Minimal score value: -3.9312
• Maximal score value: 0.9535
• Average score: -1.7994
• Total score value: -338.2869

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	K	A	-2.0259
35	F	A	-2.1983
36	N	A	-3.0891
37	K	A	-3.6262
38	E	A	-3.5058
39	Q	A	-2.9344
40	Q	A	-2.7783
41	N	A	-2.4205
42	A	A	0.0000
43	F	A	-0.3605
44	Y	A	-0.0405
45	E	A	-0.9532
46	I	A	0.0000
47	L	A	-0.4218
48	H	A	-0.8324
49	L	A	-1.0494
50	P	A	-0.9210
51	N	A	-1.1706
52	L	A	-2.0051
53	N	A	-2.8129
54	E	A	-3.7784
55	E	A	-3.6924
56	Q	A	-2.5907
57	R	A	-2.9833
58	N	A	-3.1374
59	A	A	-2.0990
60	F	A	-1.5189
61	I	A	-1.5494
62	Q	A	-2.7254
63	S	A	-2.2398
64	L	A	0.0000
65	K	A	-3.4103
66	D	A	-3.4240
67	D	A	-2.5779
68	P	A	-2.4043
69	S	A	-1.6755
70	Q	A	-1.8580
71	S	A	-1.5369
72	A	A	-1.3710
73	N	A	-1.9729
74	L	A	-1.4646
75	L	A	-1.3656
76	A	A	-1.9651
77	E	A	-3.1050
78	A	A	0.0000
79	K	A	-3.0963
80	K	A	-3.4990
81	L	A	-2.2440
82	N	A	-2.4015
83	E	A	-3.0087
84	Q	A	-1.8430
85	Q	A	-1.1836
86	A	A	-0.8388
87	A	A	0.0000
88	F	A	0.1849
89	Y	A	0.9535
90	E	A	-0.5352
91	I	A	0.0000
92	L	A	0.4199
93	S	A	0.0040
94	L	A	-0.6505
95	P	A	-0.6374
96	N	A	-1.2461
97	L	A	0.0000
98	N	A	-2.7252
99	E	A	-3.5589
100	E	A	-3.5132
101	Q	A	-2.4924
102	R	A	-2.4216
103	N	A	-2.8526
104	A	A	-2.1576
105	F	A	0.0000
106	I	A	0.0000
107	Q	A	-2.8095
108	S	A	-2.3716
109	L	A	0.0000
110	K	A	-3.3679
111	D	A	-3.5120
112	D	A	-2.8816
113	P	A	-2.1777
114	S	A	-1.9632
115	Q	A	-1.5938
116	S	A	0.0000
117	A	A	-1.2546
118	N	A	-1.9414
119	L	A	-1.4902
120	L	A	-1.2744
121	A	A	-1.8910
122	E	A	-3.0871
123	A	A	0.0000
124	K	A	-3.1491
125	K	A	-3.4487
126	L	A	-2.1413
127	N	A	0.0000
128	E	A	-2.9720
129	Q	A	-1.9916
130	Q	A	-1.1993
131	A	A	-1.0733
132	A	A	0.0000
133	F	A	-0.1760
134	Y	A	0.1500
135	E	A	-1.3788
136	I	A	0.0000
137	L	A	-0.6642
138	H	A	-1.1450
139	L	A	-1.2737
140	P	A	-1.0259
141	N	A	-1.2591
142	L	A	-2.1056
143	N	A	-2.9000
144	E	A	-3.9312
145	E	A	-3.8739
146	Q	A	-3.0207
147	R	A	-3.2950
148	N	A	-3.3520
149	A	A	-2.3923
150	F	A	0.0000
151	I	A	-1.9300
152	Q	A	-2.7943
153	S	A	-2.2769
154	L	A	0.0000
155	K	A	-3.2697
156	D	A	-3.3909
157	D	A	-2.5448
158	P	A	-1.9925
159	S	A	-1.6610
160	Q	A	-1.9144
161	S	A	-1.7429
162	A	A	-1.2843
163	N	A	-1.8088
164	L	A	-1.5365
165	L	A	-1.4787
166	A	A	-1.9340
167	E	A	-3.0027
168	A	A	0.0000
169	K	A	-3.0897
170	K	A	-3.3929
171	L	A	-2.2085
172	N	A	-2.3953
173	E	A	-2.9482
174	Q	A	-2.0667
175	Q	A	-1.3857
176	A	A	-1.1293
177	A	A	0.0000
178	F	A	-0.4642
179	Y	A	0.0856
180	E	A	-1.3715
181	I	A	0.0000
182	L	A	-0.4069
183	H	A	-1.0580
184	L	A	0.0000
185	P	A	-1.2831
186	N	A	-1.6019
187	L	A	0.0000
188	N	A	-2.8310
189	E	A	-3.4700
190	E	A	-3.4357
191	Q	A	-2.2176
192	R	A	-2.3118
193	N	A	-2.4934
194	A	A	-1.5552
195	F	A	0.0000
196	I	A	-1.6233
197	Q	A	-2.6650
198	S	A	-2.3422
199	L	A	0.0000
200	K	A	-3.5125
201	D	A	-3.7123
202	D	A	-3.1671
203	P	A	-2.6388
204	S	A	-1.9714
205	Q	A	-1.9643
206	S	A	0.0000
207	A	A	-1.4139
208	N	A	-1.9349
209	L	A	-1.5697
210	L	A	-1.5328
211	A	A	-2.0227
212	E	A	-3.1406
213	A	A	0.0000
214	K	A	-3.4597
215	K	A	-3.4709
216	L	A	-2.2052
217	N	A	-2.6380
218	D	A	-3.1039
219	A	A	-1.7549
220	Q	A	-1.7438
221	A	A	-0.9359