Project name: normalBoltz

Chain sequence(s)	G: EVQLVESGGGLVQPGGSLRLSCAASGFTFSDSWIHWVRQAPGKGLEWVAWISPYGGSTYYADSVKGRFTISADTSKNTAYLQMNSLRAEDTAVYYCARRHWPGGFDYWGQGTLVTVSS
Selected Chain(s)	G
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 G 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                                          (00:00:44)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:44)

• Minimal score value: -2.4469
• Maximal score value: 1.6658
• Average score: -0.5119
• Total score value: -60.4038

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	G	-2.0521
2	V	G	-1.2395
3	Q	G	-0.9185
4	L	G	0.0000
5	V	G	1.0520
6	E	G	0.0000
7	S	G	-0.2990
8	G	G	-0.8417
9	G	G	0.0797
10	G	G	0.6201
11	L	G	1.4260
12	V	G	0.0739
13	Q	G	-1.1962
14	P	G	-1.4572
15	G	G	-1.4285
16	G	G	-1.0206
17	S	G	-1.2063
18	L	G	-1.1328
19	R	G	-2.2782
20	L	G	0.0000
21	S	G	-0.4484
22	C	G	0.0000
23	A	G	-0.0508
24	A	G	0.0000
25	S	G	-0.7854
26	G	G	-1.1487
27	F	G	-0.7645
28	T	G	-0.6819
29	F	G	0.0000
30	S	G	-0.6677
31	D	G	-1.4924
32	S	G	0.0000
33	W	G	-0.0162
34	I	G	0.0000
35	H	G	0.0000
36	W	G	0.0000
37	V	G	0.0000
38	R	G	0.0000
39	Q	G	-0.4507
40	A	G	-0.9979
41	P	G	-1.0779
42	G	G	-1.7493
43	K	G	-2.1270
44	G	G	-0.9533
45	L	G	0.2581
46	E	G	-0.6414
47	W	G	0.1178
48	V	G	0.0000
49	A	G	0.0000
50	W	G	0.5649
51	I	G	0.0000
52	S	G	0.0058
53	P	G	0.0000
54	Y	G	0.4291
55	G	G	-0.2369
56	G	G	-0.3477
57	S	G	0.0138
58	T	G	0.4223
59	Y	G	0.9359
60	Y	G	-0.2484
61	A	G	-1.1581
62	D	G	-2.3555
63	S	G	-1.7434
64	V	G	0.0000
65	K	G	-2.4469
66	G	G	-1.8621
67	R	G	-1.9243
68	F	G	0.0000
69	T	G	-0.8935
70	I	G	0.0000
71	S	G	-0.4807
72	A	G	-0.8081
73	D	G	-1.4772
74	T	G	-1.1019
75	S	G	-1.4759
76	K	G	-2.3172
77	N	G	-1.6592
78	T	G	0.0000
79	A	G	0.0000
80	Y	G	0.0000
81	L	G	0.0000
82	Q	G	-1.5677
83	M	G	0.0000
84	N	G	-1.9545
85	S	G	-1.4233
86	L	G	0.0000
87	R	G	-2.1366
88	A	G	-1.6576
89	E	G	-2.2209
90	D	G	0.0000
91	T	G	-0.3836
92	A	G	0.0000
93	V	G	0.8550
94	Y	G	0.0000
95	Y	G	0.5408
96	C	G	0.0000
97	A	G	0.0000
98	R	G	-0.4088
99	R	G	-0.5606
100	H	G	-0.7062
101	W	G	0.3930
102	P	G	-0.2299
103	G	G	-0.6188
104	G	G	-0.7101
105	F	G	-0.5749
106	D	G	-1.3956
107	Y	G	-0.3912
108	W	G	0.1789
109	G	G	0.0000
110	Q	G	-0.7211
111	G	G	0.0959
112	T	G	0.0000
113	L	G	1.6658
114	V	G	0.0000
115	T	G	0.3988
116	V	G	0.0000
117	S	G	-0.6774
118	S	G	-0.5315