Project name: LFLESSMT

Chain sequence(s)	H: EVQLLESGGGLVQPGGSLRLSCATSGSIFSINAMGWFRQAPGKQRELVAVITSGGSTLYAESVKGRFTISRDNSKNTVYLQMSSLRPEDTAVYYCNAHVGLKVPTIQELSLGFGSWGQGTMVTVSS
Selected Chain(s)	H
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 H 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                                          (00:00:33)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:34)

• Minimal score value: -2.7806
• Maximal score value: 2.3906
• Average score: -0.306
• Total score value: -38.5524

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	-1.9276
2	V	H	-0.8369
3	Q	H	-1.0661
4	L	H	0.0000
5	L	H	1.0518
6	E	H	0.0000
7	S	H	-0.1934
8	G	H	-0.7492
9	G	H	-0.0927
11	G	H	0.6374
12	L	H	1.3301
13	V	H	0.0271
14	Q	H	-1.3216
15	P	H	-1.6577
16	G	H	-1.2837
17	G	H	-0.7764
18	S	H	-0.8331
19	L	H	-0.4268
20	R	H	-1.2466
21	L	H	0.0000
22	S	H	-0.1712
23	C	H	0.0000
24	A	H	-0.2347
25	T	H	0.0000
26	S	H	-0.3663
27	G	H	-0.7185
28	S	H	0.2292
29	I	H	1.0233
30	F	H	2.3906
35	S	H	2.0124
36	I	H	1.4486
37	N	H	0.0000
38	A	H	0.0000
39	M	H	0.0000
40	G	H	0.0000
41	W	H	0.0000
42	F	H	0.0000
43	R	H	0.0000
44	Q	H	-1.1638
45	A	H	-1.1379
46	P	H	-0.9853
47	G	H	-1.3330
48	K	H	-1.9744
49	Q	H	-2.2416
50	R	H	-1.8178
51	E	H	-1.1866
52	L	H	0.0254
53	V	H	0.0000
54	A	H	0.0000
55	V	H	0.0000
56	I	H	0.0000
57	T	H	0.0000
58	S	H	-0.3554
59	G	H	-0.5965
63	G	H	-0.6874
64	S	H	-0.3242
65	T	H	0.1690
66	L	H	0.6181
67	Y	H	-0.2204
68	A	H	-1.0281
69	E	H	-2.3021
70	S	H	-1.7218
71	V	H	0.0000
72	K	H	-2.3770
74	G	H	-1.6317
75	R	H	-1.2019
76	F	H	0.0000
77	T	H	-0.5107
78	I	H	0.0000
79	S	H	-0.5679
80	R	H	-1.4142
81	D	H	-2.0436
82	N	H	-2.5144
83	S	H	-2.0463
84	K	H	-2.7806
85	N	H	-2.0018
86	T	H	-1.3411
87	V	H	0.0000
88	Y	H	-0.3437
89	L	H	0.0000
90	Q	H	-0.7974
91	M	H	0.0000
92	S	H	-0.8131
93	S	H	-0.9727
94	L	H	0.0000
95	R	H	-2.2152
96	P	H	-1.8921
97	E	H	-2.3122
98	D	H	0.0000
99	T	H	-0.5977
100	A	H	0.0000
101	V	H	0.2220
102	Y	H	0.0000
103	Y	H	0.1620
104	C	H	0.0000
105	N	H	0.0000
106	A	H	0.0000
107	H	H	0.5988
108	V	H	1.4432
109	G	H	1.0904
110	L	H	2.0057
111	K	H	0.1360
111A	V	H	1.5527
111B	P	H	0.9811
111C	T	H	0.7216
112D	I	H	1.3727
112C	Q	H	0.5880
112B	E	H	0.1513
112A	L	H	1.4772
112	S	H	0.7800
113	L	H	1.5498
114	G	H	0.5765
115	F	H	0.0000
116	G	H	-0.0475
117	S	H	-0.0845
118	W	H	0.1165
119	G	H	-0.0880
120	Q	H	-0.8323
121	G	H	-0.0648
122	T	H	0.1285
123	M	H	0.7262
124	V	H	0.0000
125	T	H	0.1248
126	V	H	0.0000
127	S	H	-0.8194
128	S	H	-0.7298