Project name: gp63_004

Chain sequence(s)	H: QVQLVESGGGLVQPGGSLRLSCAASGISGASFSEYSLGWFRQAPGQGLEAVAAIDSDGSHTYYADSVKGRFTISRDNSKNTLYLQMNSLRAEDTAVYYCAARKSKLALQPTPSSYQYWGQGTLVTVS
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                                          (00:02:22)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:23)

• Minimal score value: -2.7979
• Maximal score value: 1.7823
• Average score: -0.6801
• Total score value: -86.369

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	Q	H	-1.5020
2	V	H	0.0000
3	Q	H	-1.0980
4	L	H	0.0000
5	V	H	1.0523
6	E	H	0.0000
7	S	H	-0.2108
8	G	H	-0.7798
9	G	H	0.1562
10	G	H	0.7587
11	L	H	1.4490
12	V	H	-0.0654
13	Q	H	-1.3896
14	P	H	-1.8021
15	G	H	-1.5980
16	G	H	-1.1196
17	S	H	-1.5005
18	L	H	-1.0229
19	R	H	-2.3195
20	L	H	0.0000
21	S	H	-0.4999
22	C	H	0.0000
23	A	H	-0.0117
24	A	H	0.0000
25	S	H	-0.8115
26	G	H	-1.0119
27	I	H	-0.4448
28	S	H	-0.5286
29	G	H	-1.0342
30	A	H	-0.3762
31	S	H	-0.6617
32	F	H	0.0000
33	S	H	-1.6322
34	E	H	-1.9331
35	Y	H	0.0000
36	S	H	0.0000
37	L	H	0.0000
38	G	H	0.0000
39	W	H	0.0000
40	F	H	0.0000
41	R	H	-0.6562
42	Q	H	-1.0473
43	A	H	-1.1677
44	P	H	-0.9254
45	G	H	-1.2974
46	Q	H	-2.0204
47	G	H	-1.5546
48	L	H	-1.0972
49	E	H	-2.0254
50	A	H	-0.9915
51	V	H	0.0000
52	A	H	0.0000
53	A	H	0.0000
54	I	H	0.0000
55	D	H	0.0000
56	S	H	0.0000
57	D	H	-2.3180
58	G	H	-1.4300
59	S	H	-0.9034
60	H	H	-0.4848
61	T	H	-0.1667
62	Y	H	-0.1804
63	Y	H	-0.6745
64	A	H	-1.5007
65	D	H	-2.4381
66	S	H	-1.7970
67	V	H	0.0000
68	K	H	-2.5359
69	G	H	-1.7934
70	R	H	-1.6757
71	F	H	0.0000
72	T	H	-1.0295
73	I	H	0.0000
74	S	H	-0.7836
75	R	H	-1.3029
76	D	H	-1.9174
77	N	H	-1.9402
78	S	H	-1.5684
79	K	H	-2.3026
80	N	H	-1.4184
81	T	H	-0.9121
82	L	H	0.0000
83	Y	H	0.0000
84	L	H	0.0000
85	Q	H	-1.7237
86	M	H	0.0000
87	N	H	-1.9969
88	S	H	-1.5118
89	L	H	0.0000
90	R	H	-2.7979
91	A	H	-1.9784
92	E	H	-2.3996
93	D	H	0.0000
94	T	H	-0.4884
95	A	H	0.0000
96	V	H	0.8618
97	Y	H	0.0000
98	Y	H	0.2175
99	C	H	0.0000
100	A	H	0.0000
101	A	H	0.0000
102	R	H	-1.4266
103	K	H	-2.0208
104	S	H	-1.0260
105	K	H	-1.2555
106	L	H	0.3156
107	A	H	0.0000
108	L	H	0.2225
109	Q	H	-0.6621
110	P	H	-0.7598
111	T	H	-0.6694
112	P	H	-0.8016
113	S	H	-0.6318
114	S	H	-0.7923
115	Y	H	0.0000
116	Q	H	-1.4416
117	Y	H	-0.8065
118	W	H	-0.0797
119	G	H	-0.0631
120	Q	H	-0.8053
121	G	H	0.0000
122	T	H	0.6763
123	L	H	1.7823
124	V	H	0.0000
125	T	H	0.3387
126	V	H	0.0000
127	S	H	-0.8503