Project name: 2dbc6999fccc340

Chain sequence(s)	H: EVQLVESGGGLVQPGGSLRLSCAASGFSLSNYNMGWVRQAPGKGLEWVSVIDASGTTYYATWAKGRFTISRDNSKNTLYLQMNSLRAEDTATYYCARELLYFGSSYYDLWGQGTLVTVSS; L: DVVMTQSPSTLSASVGDRVTITCQASQNIDSNLAWYQQKPGKAPKFLIYYASNLPFGVPSRFKGSGSGTEFTLTISSLQPDDFATYYCQSADVGSTYVAAFGGGTKVEIK
Selected Chain(s)	H,L
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 all 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                                          (00:01:30)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:32)

• Minimal score value: -2.8341
• Maximal score value: 2.6587
• Average score: -0.4736
• Total score value: -108.9183

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	-1.7742
2	V	H	-0.6615
3	Q	H	-0.8810
4	L	H	0.0000
5	V	H	0.9864
6	E	H	0.3757
7	S	H	-0.1412
8	G	H	-0.4285
9	G	H	0.1634
11	G	H	0.8327
12	L	H	1.3910
13	V	H	-0.0200
14	Q	H	-1.3332
15	P	H	-1.6337
16	G	H	-1.4304
17	G	H	-1.1360
18	S	H	-1.0799
19	L	H	-0.6586
20	R	H	-1.4242
21	L	H	0.0000
22	S	H	-0.2564
23	C	H	0.0000
24	A	H	-0.0346
25	A	H	0.0000
26	S	H	-0.4779
27	G	H	-0.8869
28	F	H	-0.5113
29	S	H	-0.7633
30	L	H	0.0000
35	S	H	-1.2156
36	N	H	-1.2584
37	Y	H	-0.1003
38	N	H	0.0000
39	M	H	0.0000
40	G	H	0.0000
41	W	H	0.0000
42	V	H	0.0000
43	R	H	0.0000
44	Q	H	-0.8040
45	A	H	-1.1363
46	P	H	-0.8890
47	G	H	-1.4510
48	K	H	-2.2694
49	G	H	-1.4181
50	L	H	0.0000
51	E	H	-0.9397
52	W	H	0.0000
53	V	H	0.0000
54	S	H	0.0000
55	V	H	0.0000
56	I	H	0.0000
57	D	H	-0.3712
58	A	H	-0.5493
59	S	H	-0.5556
63	G	H	-0.4757
64	T	H	-0.2197
65	T	H	0.0173
66	Y	H	0.1186
67	Y	H	-0.2324
68	A	H	0.0000
69	T	H	-0.6482
70	W	H	-0.3398
71	A	H	0.0000
72	K	H	-1.8198
74	G	H	-1.4136
75	R	H	-1.1567
76	F	H	0.0000
77	T	H	-0.7489
78	I	H	0.0000
79	S	H	-0.5380
80	R	H	-1.1922
81	D	H	-1.7811
82	N	H	-2.4801
83	S	H	-1.8787
84	K	H	-2.5090
85	N	H	-1.8998
86	T	H	-1.0691
87	L	H	0.0000
88	Y	H	-0.4381
89	L	H	0.0000
90	Q	H	-0.9980
91	M	H	0.0000
92	N	H	-1.2409
93	S	H	-1.2021
94	L	H	0.0000
95	R	H	-2.2882
96	A	H	-1.7008
97	E	H	-2.2236
98	D	H	0.0000
99	T	H	-0.4174
100	A	H	0.0000
101	T	H	0.3074
102	Y	H	0.0000
103	Y	H	0.0000
104	C	H	0.0000
105	A	H	0.0000
106	R	H	-0.2397
107	E	H	0.0000
108	L	H	0.8914
109	L	H	1.8388
110	Y	H	2.6587
111	F	H	2.5860
112A	G	H	0.8480
112	S	H	0.0000
113	S	H	0.0000
114	Y	H	0.3293
115	Y	H	0.0000
116	D	H	-0.9551
117	L	H	-0.6456
118	W	H	0.0000
119	G	H	0.0000
120	Q	H	-1.3277
121	G	H	-0.4260
122	T	H	0.4025
123	L	H	1.3470
124	V	H	0.0000
125	T	H	0.3104
126	V	H	0.0000
127	S	H	-0.5376
128	S	H	-0.5532
1	D	L	-1.4178
2	V	L	-0.4505
3	V	L	1.0694
4	M	L	0.0000
5	T	L	-0.1976
6	Q	L	0.0000
7	S	L	-0.4668
8	P	L	-0.3821
9	S	L	-0.5793
10	T	L	-0.5213
11	L	L	-0.1380
12	S	L	-0.5589
13	A	L	0.0000
14	S	L	-0.8375
15	V	L	-0.0323
16	G	L	-0.8457
17	D	L	-1.8079
18	R	L	-2.3232
19	V	L	0.0000
20	T	L	-0.7577
21	I	L	0.0000
22	T	L	-0.6069
23	C	L	0.0000
24	Q	L	-1.4067
25	A	L	0.0000
26	S	L	-0.9148
27	Q	L	-2.2369
28	N	L	-2.8341
29	I	L	0.0000
36	D	L	-2.7190
37	S	L	-1.3879
38	N	L	-0.7009
39	L	L	0.0000
40	A	L	0.0000
41	W	L	0.0000
42	Y	L	0.0000
43	Q	L	0.0000
44	Q	L	0.0000
45	K	L	-1.5574
46	P	L	-1.0802
47	G	L	-1.6858
48	K	L	-2.6472
49	A	L	-1.7760
50	P	L	0.0000
51	K	L	-1.9348
52	F	L	0.0000
53	L	L	0.0000
54	I	L	0.0000
55	Y	L	0.2374
56	Y	L	0.1462
57	A	L	0.0000
65	S	L	-0.6919
66	N	L	-0.5316
67	L	L	0.3131
68	P	L	0.7688
69	F	L	1.6611
70	G	L	0.5832
71	V	L	0.1754
72	P	L	-0.2206
74	S	L	-0.7252
75	R	L	-1.2436
76	F	L	0.0000
77	K	L	-1.8974
78	G	L	0.0000
79	S	L	-0.8983
80	G	L	-1.0720
83	S	L	-1.5870
84	G	L	-2.1925
85	T	L	-2.1381
86	E	L	-2.2136
87	F	L	0.0000
88	T	L	-0.8100
89	L	L	0.0000
90	T	L	-1.1168
91	I	L	0.0000
92	S	L	-1.7043
93	S	L	-1.2305
94	L	L	0.0000
95	Q	L	-0.8163
96	P	L	-0.9291
97	D	L	-1.5940
98	D	L	0.0000
99	F	L	0.0558
100	A	L	0.0000
101	T	L	-0.4587
102	Y	L	0.0000
103	Y	L	0.0000
104	C	L	0.0000
105	Q	L	0.0000
106	S	L	0.0000
107	A	L	0.0000
108	D	L	-1.0267
109	V	L	0.3296
110	G	L	-0.2459
112	S	L	-0.3386
113	T	L	-0.4795
114	Y	L	0.0000
115	V	L	-0.1845
116	A	L	0.0000
117	A	L	0.0326
118	F	L	0.1639
119	G	L	0.0000
120	G	L	-0.7141
121	G	L	-0.8051
122	T	L	0.0000
123	K	L	-0.8351
124	V	L	0.0000
125	E	L	-0.3921
126	I	L	-0.4423
127	K	L	-1.4313