Project name: 14.P1H3.pdb

Chain sequence(s)	H: EVQLVESGGGLVQPGGSLRLSCAASGSIFRFNVMSWYRQTPGKQRDWVVSITTDGATTYDASVKGRFTISRDNAKNTVYLQMNSLKPADAAVYYCNGWNVHENYWGQGTQVTVSS
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]                                                (00:00:01)
[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]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:01:17)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:18)

• Minimal score value: -2.5291
• Maximal score value: 1.053
• Average score: -0.6495
• Total score value: -74.6969

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	-2.3152
2	V	H	0.0000
3	Q	H	-1.2448
4	L	H	0.0000
5	V	H	0.8328
6	E	H	-0.0145
7	S	H	-0.5817
8	G	H	-0.9747
9	G	H	-0.6524
11	G	H	0.0829
12	L	H	1.0530
13	V	H	-0.0500
14	Q	H	-1.4036
15	P	H	-1.7282
16	G	H	-1.5721
17	G	H	-1.0028
18	S	H	-1.0523
19	L	H	-0.4426
20	R	H	-1.1399
21	L	H	0.0000
22	S	H	-0.2138
23	C	H	0.0000
24	A	H	-0.2367
25	A	H	0.0000
26	S	H	-1.0346
27	G	H	-0.9692
28	S	H	-0.5655
29	I	H	-0.2069
30	F	H	0.8368
35	R	H	-0.4284
36	F	H	0.0000
37	N	H	-0.4883
38	V	H	-0.0691
39	M	H	0.0000
40	S	H	0.0000
41	W	H	0.0000
42	Y	H	0.0533
43	R	H	0.0000
44	Q	H	-1.4392
45	T	H	-1.2603
46	P	H	-1.1474
47	G	H	-1.5855
48	K	H	-2.4906
49	Q	H	-2.4524
50	R	H	-1.8023
51	D	H	-1.1662
52	W	H	-0.1807
53	V	H	0.0000
54	V	H	0.0000
55	S	H	0.0000
56	I	H	0.0000
57	T	H	-0.7279
58	T	H	-1.5079
59	D	H	-2.1242
63	G	H	-1.2351
64	A	H	-0.5156
65	T	H	-0.2395
66	T	H	-0.3201
67	Y	H	-0.6209
68	D	H	-0.7638
69	A	H	-0.7509
70	S	H	-0.7945
71	V	H	0.0000
72	K	H	-2.1125
74	G	H	-1.5728
75	R	H	-1.4543
76	F	H	0.0000
77	T	H	-0.7585
78	I	H	0.0000
79	S	H	-0.4197
80	R	H	-1.3730
81	D	H	-1.7581
82	N	H	-2.2776
83	A	H	-1.6777
84	K	H	-2.5291
85	N	H	-1.7938
86	T	H	-1.1914
87	V	H	0.0000
88	Y	H	-0.2863
89	L	H	0.0000
90	Q	H	-0.7957
91	M	H	0.0000
92	N	H	-1.3270
93	S	H	-1.4153
94	L	H	0.0000
95	K	H	-2.2583
96	P	H	-1.2269
97	A	H	-0.6060
98	D	H	0.0000
99	A	H	-0.3781
100	A	H	0.0000
101	V	H	-0.5700
102	Y	H	0.0000
103	Y	H	-0.0860
104	C	H	0.0000
105	N	H	0.0000
106	G	H	0.0000
107	W	H	-0.0669
108	N	H	0.0000
109	V	H	0.7039
114	H	H	-0.5527
115	E	H	-1.1728
116	N	H	-1.1220
117	Y	H	-0.6891
118	W	H	0.1402
119	G	H	-0.0700
120	Q	H	-0.9939
121	G	H	-0.5748
122	T	H	-0.8283
123	Q	H	-1.1954
124	V	H	0.0000
125	T	H	-0.1413
126	V	H	0.0000
127	S	H	-0.6575
128	S	H	-0.9547