Project name: IL10_WT_ref [mutate: IA145L]

Chain sequence(s)	L: CTHFPGNLPNMLRDLRDAFSRVKTFFQMKDQLDNLLLKESLLEDFKGYLGCQALSEMIQFYLEEVMPQAENQDPDIKAHVNSLGENLKTLRLRLRRCHRFLPCENKSKAVEQVKNAFNKLQEKGIYKAMSEFDIFINYIEAYMTM
Selected Chain(s)	L
Distance of aggregation	10 Å
FoldX usage	Yes
Dynamic mode	No
Automated mutations	No
Mutated residues	IA145L
Energy difference between WT (input) and mutated protein (by FoldX)	0.160774 kcal/mol

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 L 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]       FoldX:    Building mutant model                                                       (00:01:38)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:01:42)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:03:22)
[INFO]       Main:     Simulation completed successfully.                                          (00:03:23)

• Minimal score value: -3.797
• Maximal score value: 1.9804
• Average score: -1.1375
• Total score value: -164.9402

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
12	C	L	-0.4464
13	T	L	-0.5579
14	H	L	-1.4674
15	F	L	-0.8390
16	P	L	-0.8087
17	G	L	-1.3111
18	N	L	-1.6355
19	L	L	-1.2565
20	P	L	-1.6514
21	N	L	-2.4308
22	M	L	-2.0719
23	L	L	-2.1476
24	R	L	-3.7343
25	D	L	-3.2833
26	L	L	-2.5444
27	R	L	-3.5921
28	D	L	-3.7970
29	A	L	0.0000
30	F	L	-1.8526
31	S	L	-2.1030
32	R	L	-2.6689
33	V	L	0.0000
34	K	L	-1.8176
35	T	L	-0.9859
36	F	L	-0.8135
37	F	L	-0.9755
38	Q	L	-1.6883
39	M	L	-0.7931
40	K	L	-1.8887
41	D	L	-2.6699
42	Q	L	-2.1382
43	L	L	-0.7454
44	D	L	-1.7857
45	N	L	-1.0744
46	L	L	0.4463
47	L	L	1.3675
48	L	L	0.7199
49	K	L	-1.4914
50	E	L	-2.1937
51	S	L	-1.9550
52	L	L	-0.9407
53	L	L	-1.1363
54	E	L	-2.5857
55	D	L	-1.4960
56	F	L	-0.7805
57	K	L	-1.6763
58	G	L	-0.6752
59	Y	L	0.8066
60	L	L	0.5452
61	G	L	0.0000
62	C	L	-0.3729
63	Q	L	-1.0061
64	A	L	0.0000
65	L	L	-0.1165
66	S	L	-1.0480
67	E	L	-1.8200
68	M	L	-0.8101
69	I	L	0.0000
70	Q	L	-1.4561
71	F	L	-0.7495
72	Y	L	-0.5227
73	L	L	-1.6231
74	E	L	-2.3193
75	E	L	-2.0951
76	V	L	-0.6333
77	M	L	0.0000
78	P	L	-2.0756
79	Q	L	-2.5562
80	A	L	-2.1679
81	E	L	0.0000
82	N	L	-3.1554
83	Q	L	-2.9718
84	D	L	-2.8503
85	P	L	-2.6141
86	D	L	-2.7885
87	I	L	0.0000
88	K	L	-2.8913
89	A	L	-1.7380
90	H	L	-1.8589
91	V	L	0.0000
92	N	L	-2.2875
93	S	L	-1.7484
94	L	L	-1.9092
95	G	L	0.0000
96	E	L	-2.5843
97	N	L	-2.1548
98	L	L	-1.2718
99	K	L	-1.7970
100	T	L	-1.1890
101	L	L	0.0000
102	R	L	-1.0056
103	L	L	-0.6885
104	R	L	-1.0844
105	L	L	-1.1000
106	R	L	-2.0377
107	R	L	-2.5493
108	C	L	0.0000
109	H	L	-2.5766
110	R	L	-2.3833
111	F	L	-0.9182
112	L	L	0.0000
113	P	L	-1.7393
114	C	L	-0.8350
115	E	L	-1.4218
116	N	L	-2.5397
117	K	L	-2.4947
118	S	L	-1.7807
119	K	L	-2.3667
120	A	L	-1.0417
121	V	L	-0.5317
122	E	L	-1.7274
123	Q	L	-1.6521
124	V	L	-0.8212
125	K	L	-2.1268
126	N	L	-2.1617
127	A	L	-1.3829
128	F	L	-1.4356
129	N	L	-2.7769
130	K	L	-2.8342
131	L	L	-1.9173
132	Q	L	-2.5919
133	E	L	-2.6251
134	K	L	-2.2475
135	G	L	0.0000
136	I	L	1.3868
137	Y	L	0.8991
138	K	L	-0.3501
139	A	L	0.7308
140	M	L	1.6076
141	S	L	0.1496
142	E	L	-0.9044
143	F	L	1.1375
144	D	L	-0.5547
145	A	L	0.0851	mutated: IA145L
146	F	L	1.7402
147	I	L	0.7502
148	N	L	-0.2908
149	Y	L	1.6623
150	I	L	1.1288
151	E	L	-0.1465
152	A	L	0.9126
153	Y	L	1.9804
154	M	L	1.6164
155	T	L	1.1598
156	M	L	1.5586