Project name: ed005386669b2ef

Chain sequence(s)	H: QVQLVQSGAEVKRPGASVKVSCKASGYTFTNDIIHWVRQAPGQRLEWMGWINAGYGNTQYSQNFQDRVSITRDTSASTAYMELISLRSEDTAVYYCAREPLWFGESSPHDYYGMDVWGQGTTVTVSS; L: AIQLTQSPSSLSASVGDRVTITCRASQGISSALAWYQQKPGKAPKLLIYDASSLESGVPSRFSGSGSGTDFTLTISSLQPEDFATYYCQQFNSYPLTFGGGTKVEIK
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                                          (00:02:12)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:14)

• Minimal score value: -2.9931
• Maximal score value: 1.3442
• Average score: -0.5566
• Total score value: -130.2485

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	-1.2903
2	V	H	-0.5244
3	Q	H	-0.6625
4	L	H	0.0000
5	V	H	0.7269
6	Q	H	0.0000
7	S	H	-0.4558
8	G	H	-0.5572
9	A	H	-0.0244
11	E	H	-0.0220
12	V	H	0.8956
13	K	H	-0.9902
14	R	H	-2.3271
15	P	H	-2.0357
16	G	H	-1.4084
17	A	H	-0.8331
18	S	H	-0.7319
19	V	H	0.0000
20	K	H	-1.6950
21	V	H	0.0000
22	S	H	-0.4464
23	C	H	0.0000
24	K	H	-0.4082
25	A	H	0.0000
26	S	H	-0.5280
27	G	H	-0.8180
28	Y	H	-0.2975
29	T	H	-0.2149
30	F	H	0.0000
35	T	H	-0.3672
36	N	H	-0.3175
37	D	H	0.0000
38	I	H	0.0000
39	I	H	0.0000
40	H	H	0.0000
41	W	H	0.0000
42	V	H	0.0000
43	R	H	-0.5941
44	Q	H	-0.9628
45	A	H	-1.2418
46	P	H	-1.1650
47	G	H	-1.4220
48	Q	H	-2.2304
49	R	H	-2.1413
50	L	H	0.0000
51	E	H	-1.1273
52	W	H	0.0000
53	M	H	0.0000
54	G	H	0.0000
55	W	H	-0.2193
56	I	H	0.0000
57	N	H	-0.3780
58	A	H	0.0000
59	G	H	-0.1448
62	Y	H	0.6686
63	G	H	-0.3844
64	N	H	-1.1084
65	T	H	-0.7060
66	Q	H	-0.8401
67	Y	H	-1.0660
68	S	H	0.0000
69	Q	H	-2.5126
70	N	H	-2.5216
71	F	H	0.0000
72	Q	H	-2.9038
74	D	H	-2.8008
75	R	H	-1.5275
76	V	H	0.0000
77	S	H	-0.9844
78	I	H	0.0000
79	T	H	-0.7808
80	R	H	-0.8286
81	D	H	-1.0416
82	T	H	-0.5022
83	S	H	-0.4936
84	A	H	-0.5133
85	S	H	-0.5861
86	T	H	0.0000
87	A	H	0.0000
88	Y	H	-0.6452
89	M	H	0.0000
90	E	H	-1.2067
91	L	H	0.0000
92	I	H	-0.3840
93	S	H	-0.9265
94	L	H	0.0000
95	R	H	-2.9931
96	S	H	-2.3991
97	E	H	-2.5531
98	D	H	0.0000
99	T	H	-0.9191
100	A	H	0.0000
101	V	H	0.1407
102	Y	H	0.0000
103	Y	H	0.0000
104	C	H	0.0000
105	A	H	0.0000
106	R	H	-0.2466
107	E	H	0.0000
108	P	H	0.0000
109	L	H	0.5182
110	W	H	0.9160
111	F	H	1.3442
111A	G	H	-0.3837
111B	E	H	-1.6798
111C	S	H	-1.1704
112D	S	H	-1.0539
112C	P	H	-0.3536
112B	H	H	-1.0361
112A	D	H	-1.4901
112	Y	H	0.0000
113	Y	H	0.0000
114	G	H	0.0000
115	M	H	0.0000
116	D	H	-0.3549
117	V	H	-0.2422
118	W	H	0.0000
119	G	H	0.0000
120	Q	H	-1.2413
121	G	H	-0.6984
122	T	H	0.0000
123	T	H	0.0485
124	V	H	0.0000
125	T	H	-0.3070
126	V	H	0.0000
127	S	H	-1.0229
128	S	H	-0.9517
1	A	L	-0.4490
2	I	L	0.0000
3	Q	L	-1.7804
4	L	L	0.0000
5	T	L	-1.2924
6	Q	L	0.0000
7	S	L	-0.6354
8	P	L	-0.5300
9	S	L	-0.7012
10	S	L	-0.8478
11	L	L	-0.4287
12	S	L	-0.5195
13	A	L	0.0000
14	S	L	0.0311
15	V	L	0.8173
16	G	L	-0.4513
17	D	L	-1.4821
18	R	L	-2.1785
19	V	L	0.0000
20	T	L	-0.5855
21	I	L	0.0000
22	T	L	-0.8405
23	C	L	0.0000
24	R	L	-2.8339
25	A	L	0.0000
26	S	L	-1.7881
27	Q	L	-2.2214
28	G	L	-1.7402
29	I	L	0.0000
36	S	L	-1.0701
37	S	L	-1.0146
38	A	L	-0.9515
39	L	L	0.0000
40	A	L	0.0000
41	W	L	0.0000
42	Y	L	0.0000
43	Q	L	-0.8295
44	Q	L	0.0000
45	K	L	-1.7037
46	P	L	-1.2700
47	G	L	-1.6258
48	K	L	-2.5570
49	A	L	-1.5348
50	P	L	0.0000
51	K	L	-1.2372
52	L	L	0.0000
53	L	L	0.0000
54	I	L	0.0000
55	Y	L	-0.1937
56	D	L	-0.8382
57	A	L	0.0000
65	S	L	-0.4318
66	S	L	-0.0862
67	L	L	0.2580
68	E	L	-0.2743
69	S	L	-0.3502
70	G	L	-0.4949
71	V	L	-0.2749
72	P	L	-0.3065
74	S	L	-0.3854
75	R	L	-0.7158
76	F	L	0.0000
77	S	L	-0.2765
78	G	L	-0.3104
79	S	L	-0.7047
80	G	L	-1.1770
83	S	L	-1.2094
84	G	L	-1.3586
85	T	L	-1.8681
86	D	L	-2.2620
87	F	L	0.0000
88	T	L	-0.7418
89	L	L	0.0000
90	T	L	0.0000
91	I	L	0.0000
92	S	L	-1.3279
93	S	L	-1.0569
94	L	L	0.0000
95	Q	L	-0.8248
96	P	L	-0.4696
97	E	L	-1.6243
98	D	L	0.0000
99	F	L	-0.2143
100	A	L	0.0000
101	T	L	-0.8428
102	Y	L	0.0000
103	Y	L	0.0000
104	C	L	0.0000
105	Q	L	0.0000
106	Q	L	0.0000
107	F	L	0.0000
108	N	L	-1.3191
109	S	L	-0.4214
114	Y	L	0.2310
115	P	L	-0.2506
116	L	L	0.0000
117	T	L	-0.5760
118	F	L	0.0000
119	G	L	0.0000
120	G	L	-1.2542
121	G	L	-1.0718
122	T	L	0.0000
123	K	L	-1.2527
124	V	L	0.0000
125	E	L	-0.3311
126	I	L	1.0406
127	K	L	-0.7435