Project name: 689a90b0ae9491d

Chain sequence(s)	H: EVQLVQSGAEVKKPGASVKVSCKASGYTFTRNFMHWVRQAPGQGLEWMGWIYPGDGETEYAQKFQGRVTITADTSTSTAYMELSSLRSEDTAVYYCARGVYGGFAGGYFDFWGQGTLVTVSS; L: DIQMTQSPSSLSASVGDRVTITCKASQNIYKNLAWYQQKPGKAPKLLIYDANTLQTGVPSRFSGSGSGSDFTLTISSLQPEDFATYFCQQYYSGWAFGQGTKVEIK
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                                        (00:00:01)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:02:29)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:31)

• Minimal score value: -2.8427
• Maximal score value: 1.7404
• Average score: -0.6154
• Total score value: -140.3193

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	-2.1234
2	V	H	-1.0610
3	Q	H	-1.3395
4	L	H	0.0000
5	V	H	0.7288
6	Q	H	0.0000
7	S	H	-0.3453
8	G	H	-0.3722
9	A	H	0.3329
11	E	H	0.1625
12	V	H	1.0265
13	K	H	-0.9212
14	K	H	-2.1299
15	P	H	-2.1253
16	G	H	-1.4968
17	A	H	-1.1725
18	S	H	-1.2362
19	V	H	0.0000
20	K	H	-1.6559
21	V	H	0.0000
22	S	H	-0.4049
23	C	H	0.0000
24	K	H	-0.7603
25	A	H	0.0000
26	S	H	-0.9053
27	G	H	-1.2166
28	Y	H	-0.7430
29	T	H	-0.6577
30	F	H	0.0000
35	T	H	-1.4134
36	R	H	-1.8176
37	N	H	0.0000
38	F	H	0.0000
39	M	H	0.0000
40	H	H	0.0000
41	W	H	0.0000
42	V	H	0.0000
43	R	H	0.0000
44	Q	H	-0.4587
45	A	H	-0.8591
46	P	H	-0.7026
47	G	H	-1.2110
48	Q	H	-1.8128
49	G	H	-1.2816
50	L	H	0.0000
51	E	H	-0.9120
52	W	H	0.0000
53	M	H	0.0000
54	G	H	0.0000
55	W	H	0.0000
56	I	H	0.0000
57	Y	H	-1.3913
58	P	H	0.0000
59	G	H	-2.1247
62	D	H	-2.6268
63	G	H	-2.1852
64	E	H	-2.6487
65	T	H	-1.4697
66	E	H	-1.3613
67	Y	H	-1.1959
68	A	H	-1.7635
69	Q	H	-2.8427
70	K	H	-2.7310
71	F	H	0.0000
72	Q	H	-2.5104
74	G	H	-1.6659
75	R	H	-1.5226
76	V	H	0.0000
77	T	H	-0.8108
78	I	H	0.0000
79	T	H	-0.3877
80	A	H	-0.7944
81	D	H	-0.7050
82	T	H	-0.7192
83	S	H	-0.4120
84	T	H	-0.5308
85	S	H	-0.6026
86	T	H	0.0000
87	A	H	0.0000
88	Y	H	-0.4485
89	M	H	0.0000
90	E	H	-1.1929
91	L	H	0.0000
92	S	H	-1.0459
93	S	H	-1.1381
94	L	H	0.0000
95	R	H	-2.7041
96	S	H	-2.1845
97	E	H	-2.4241
98	D	H	0.0000
99	T	H	-0.6055
100	A	H	0.0000
101	V	H	0.7268
102	Y	H	0.0000
103	Y	H	0.0000
104	C	H	0.0000
105	A	H	0.0000
106	R	H	0.0450
107	G	H	0.0000
108	V	H	0.5347
109	Y	H	0.4626
110	G	H	0.0788
111	G	H	0.4315
111A	F	H	1.7404
112A	A	H	0.0000
112	G	H	0.4591
113	G	H	0.0000
114	Y	H	0.0000
115	F	H	0.0000
116	D	H	0.0090
117	F	H	0.2214
118	W	H	-0.2070
119	G	H	0.0000
120	Q	H	-1.1512
121	G	H	-0.3749
122	T	H	0.0000
123	L	H	1.0324
124	V	H	0.0000
125	T	H	-0.0229
126	V	H	0.0000
127	S	H	-1.2215
128	S	H	-1.0328
1	D	L	-2.4230
2	I	L	0.0000
3	Q	L	-2.0932
4	M	L	0.0000
5	T	L	-1.1386
6	Q	L	0.0000
7	S	L	-0.5187
8	P	L	-0.5456
9	S	L	-0.9106
10	S	L	-1.2562
11	L	L	-0.8486
12	S	L	-0.9435
13	A	L	0.0000
14	S	L	-0.0909
15	V	L	0.8699
16	G	L	-0.4068
17	D	L	-1.1609
18	R	L	-2.0484
19	V	L	0.0000
20	T	L	-0.5563
21	I	L	0.0000
22	T	L	-0.6862
23	C	L	0.0000
24	K	L	-2.0423
25	A	L	-1.7432
26	S	L	-1.7765
27	Q	L	-1.7695
28	N	L	-1.1898
29	I	L	0.0000
36	Y	L	0.1386
37	K	L	-1.2337
38	N	L	-0.5861
39	L	L	0.0000
40	A	L	0.0000
41	W	L	0.0000
42	Y	L	0.0000
43	Q	L	-1.0057
44	Q	L	-1.4179
45	K	L	-1.8627
46	P	L	-1.3016
47	G	L	-1.7103
48	K	L	-2.6057
49	A	L	-1.5289
50	P	L	0.0000
51	K	L	-1.3830
52	L	L	0.0000
53	L	L	0.0000
54	I	L	0.0000
55	Y	L	-0.4659
56	D	L	-1.1602
57	A	L	0.0000
65	N	L	-1.2922
66	T	L	-0.4164
67	L	L	0.0183
68	Q	L	-0.3670
69	T	L	-0.3043
70	G	L	-0.5181
71	V	L	0.0000
72	P	L	-0.3972
74	S	L	-0.4255
75	R	L	-0.6941
76	F	L	0.0000
77	S	L	-0.4574
78	G	L	0.0000
79	S	L	-1.1258
80	G	L	-1.3079
83	S	L	-1.2550
84	G	L	-0.9847
85	S	L	-1.6915
86	D	L	-2.4676
87	F	L	0.0000
88	T	L	-0.8056
89	L	L	0.0000
90	T	L	-0.5521
91	I	L	0.0000
92	S	L	-1.1569
93	S	L	-0.9836
94	L	L	0.0000
95	Q	L	-0.6479
96	P	L	-0.5271
97	E	L	-1.7135
98	D	L	0.0000
99	F	L	-0.7318
100	A	L	0.0000
101	T	L	-1.2946
102	Y	L	0.0000
103	F	L	0.0000
104	C	L	0.0000
105	Q	L	0.0000
106	Q	L	0.0000
107	Y	L	0.0000
108	Y	L	0.3740
114	S	L	-0.3082
115	G	L	-0.6169
116	W	L	0.0000
117	A	L	-0.6803
118	F	L	0.0000
119	G	L	0.0000
120	Q	L	-1.5457
121	G	L	0.0000
122	T	L	0.0000
123	K	L	-2.0359
124	V	L	0.0000
125	E	L	-1.5853
126	I	L	0.4264
127	K	L	-0.9464