Project name: e56cd49dc77f5ad [mutate: VR5H, VK24H, IR36H, VR101H]

Chain sequence(s)	H: EVQLVESGGGEVQPGGSLKLSCVASGTDFSINFVRWYRQRPGKQREWVAGFTANGDTNYPDSMKGRFTISRDNAKNTVYLQINSLKSEDTAVYYCYMLDNWGQGTQVTVSS
Selected Chain(s)	H
Distance of aggregation	5 Å
FoldX usage	Yes
Dynamic mode	No
Automated mutations	No
Mutated residues	VK24H,IR36H,VR101H,VR5H
Energy difference between WT (input) and mutated protein (by FoldX)	-1.173 kcal/mol

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 H 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]       FoldX:    Building mutant model                                                       (00:00:25)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:02:37)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:03:30)
[INFO]       Main:     Simulation completed successfully.                                          (00:03:31)

• Minimal score value: -2.0216
• Maximal score value: 0.6504
• Average score: -0.5062
• Total score value: -56.1863

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	E	H	-1.7852
2	V	H	-0.3507
3	Q	H	-1.1637
4	L	H	0.0000
5	R	H	-1.8441	mutated: VR5H
6	E	H	0.0000
7	S	H	-0.2793
8	G	H	-0.4544
9	G	H	-0.3619
11	G	H	-0.6540
12	E	H	-1.8368
13	V	H	-0.3376
14	Q	H	-1.1833
15	P	H	-0.6306
16	G	H	-0.5383
17	G	H	-0.3072
18	S	H	-0.2618
19	L	H	0.0503
20	K	H	-1.3380
21	L	H	0.0000
22	S	H	0.0167
23	C	H	0.0000
24	K	H	-1.0702	mutated: VK24H
25	A	H	0.0000
26	S	H	-0.2377
27	G	H	-0.4974
28	T	H	-0.4186
29	D	H	-1.7928
30	F	H	0.0000
35	S	H	-0.4671
36	R	H	-1.6870	mutated: IR36H
37	N	H	-1.4632
38	F	H	0.1895
39	V	H	0.0000
40	R	H	-0.2057
41	W	H	0.0000
42	Y	H	0.2295
43	R	H	0.0000
44	Q	H	-0.5952
45	R	H	-0.5825
46	P	H	-0.4204
47	G	H	-0.8110
48	K	H	-1.9995
49	Q	H	-1.6267
50	R	H	-0.9954
51	E	H	-0.3427
52	W	H	0.2997
53	V	H	0.0000
54	A	H	0.0000
55	G	H	0.0000
56	F	H	0.2190
57	T	H	0.0914
58	A	H	-0.3360
59	N	H	-1.3143
63	G	H	-0.8088
64	D	H	-1.8420
65	T	H	-0.4612
66	N	H	-0.7405
67	Y	H	0.0570
68	P	H	-0.3598
69	D	H	-2.0216
70	S	H	-0.5291
71	M	H	0.0000
72	K	H	-1.9120
74	G	H	-0.8394
75	R	H	-0.6086
76	F	H	0.0000
77	T	H	-0.0258
78	I	H	0.0000
79	S	H	-0.1630
80	R	H	-0.2946
81	D	H	-0.6738
82	N	H	-1.3626
83	A	H	-0.4684
84	K	H	-1.7254
85	N	H	-0.6716
86	T	H	-0.2289
87	V	H	0.0000
88	Y	H	0.3874
89	L	H	0.0000
90	Q	H	-0.6966
91	I	H	0.0000
92	N	H	-0.6658
93	S	H	-0.3350
94	L	H	0.0000
95	K	H	-1.5529
96	S	H	-0.6613
97	E	H	-1.8318
98	D	H	0.0000
99	T	H	-0.0133
100	A	H	0.0000
101	R	H	-1.6041	mutated: VR101H
102	Y	H	0.0000
103	Y	H	0.0000
104	C	H	0.0000
105	Y	H	0.1989
106	M	H	0.0000
107	L	H	0.6504
116	D	H	-1.6849
117	N	H	-0.6343
118	W	H	0.3131
119	G	H	0.0000
120	Q	H	-1.2113
121	G	H	-0.2888
122	T	H	-0.1619
123	Q	H	-1.0180
124	V	H	0.0000
125	T	H	-0.2433
126	V	H	0.0000
127	S	H	-0.1290
128	S	H	-0.2295