Project name: 8.35A10

Chain sequence(s)	H: EVMLVESGGGLVKPGGSLKLSCAASGFTFSSYTMSWVRQTPEKRLEWVATISGGGGITYYPDSVKGRFTISRDNAKNTLYLQMSSLRSEDTALYYCSRILLLFYAMDYWGQGTSVTVSS; L: DIQMNQSPSSLSASLGDTITITCHASQNLNVWLSWYQQKPGNIPKLLIYKASNLHTGVPSRFSGSGSGTGFTLTISSLQPEDIATYYCQQGQSYPWTFGGGTKLEIK
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                                          (00:01:39)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:41)

• Minimal score value: -3.4051
• Maximal score value: 2.9007
• Average score: -0.512
• Total score value: -115.7052

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	-1.6723
2	V	H	-0.4051
3	M	H	0.3387
4	L	H	0.0000
5	V	H	0.6286
6	E	H	0.0000
7	S	H	-0.5509
8	G	H	-0.8559
9	G	H	-0.3520
11	G	H	0.3831
12	L	H	1.0530
13	V	H	-0.2856
14	K	H	-1.8214
15	P	H	-1.7064
16	G	H	-1.3824
17	G	H	-0.9707
18	S	H	-1.0172
19	L	H	-0.5410
20	K	H	-1.5017
21	L	H	0.0000
22	S	H	-0.4030
23	C	H	0.0000
24	A	H	-0.0881
25	A	H	0.0000
26	S	H	-0.4603
27	G	H	-0.7633
28	F	H	-0.2569
29	T	H	-0.2521
30	F	H	0.0000
35	S	H	-0.6437
36	S	H	-0.0931
37	Y	H	0.4138
38	T	H	0.0000
39	M	H	0.0000
40	S	H	0.0000
41	W	H	0.0000
42	V	H	0.0000
43	R	H	0.0000
44	Q	H	0.0000
45	T	H	-2.1788
46	P	H	-1.8606
47	E	H	-3.1972
48	K	H	-3.3390
49	R	H	-3.4051
50	L	H	0.0000
51	E	H	-1.3809
52	W	H	0.0000
53	V	H	0.0000
54	A	H	0.0000
55	T	H	0.0000
56	I	H	0.0000
57	S	H	0.4524
58	G	H	-0.1306
59	G	H	-0.5681
62	G	H	-0.2303
63	G	H	0.2448
64	I	H	1.6910
65	T	H	1.0517
66	Y	H	0.6529
67	Y	H	-0.5785
68	P	H	-1.5038
69	D	H	-2.4587
70	S	H	-1.8251
71	V	H	0.0000
72	K	H	-2.4086
74	G	H	-1.6338
75	R	H	-1.3145
76	F	H	0.0000
77	T	H	-0.6770
78	I	H	0.0000
79	S	H	-0.2498
80	R	H	-0.9567
81	D	H	-1.4367
82	N	H	-1.6750
83	A	H	-1.3365
84	K	H	-2.2347
85	N	H	-1.6657
86	T	H	-1.0068
87	L	H	0.0000
88	Y	H	-0.4092
89	L	H	0.0000
90	Q	H	-1.0183
91	M	H	0.0000
92	S	H	-0.8946
93	S	H	-1.0364
94	L	H	0.0000
95	R	H	-2.1733
96	S	H	-1.8819
97	E	H	-2.2861
98	D	H	0.0000
99	T	H	-0.6622
100	A	H	0.0000
101	L	H	-0.0730
102	Y	H	0.0000
103	Y	H	0.0000
104	C	H	0.0000
105	S	H	0.0000
106	R	H	0.0000
107	I	H	0.0000
108	L	H	1.9029
109	L	H	2.8442
110	L	H	2.9007
112	F	H	2.3284
113	Y	H	1.7533
114	A	H	0.0000
115	M	H	0.0000
116	D	H	0.0000
117	Y	H	0.3506
118	W	H	0.0000
119	G	H	0.0000
120	Q	H	-1.0009
121	G	H	0.0000
122	T	H	-0.3411
123	S	H	-0.1333
124	V	H	0.0000
125	T	H	-0.1448
126	V	H	0.0000
127	S	H	-0.7273
128	S	H	-0.6838
1	D	L	-2.1669
2	I	L	0.0000
3	Q	L	-2.1916
4	M	L	0.0000
5	N	L	-1.5851
6	Q	L	-1.0042
7	S	L	-0.8698
8	P	L	-0.6724
9	S	L	-0.8849
10	S	L	-0.9799
11	L	L	-0.6162
12	S	L	-0.8110
13	A	L	0.0000
14	S	L	-0.6722
15	L	L	0.0690
16	G	L	-0.4990
17	D	L	-1.0135
18	T	L	-0.6050
19	I	L	0.0000
20	T	L	-0.2041
21	I	L	0.0000
22	T	L	-0.6156
23	C	L	0.0000
24	H	L	-1.8146
25	A	L	0.0000
26	S	L	-1.8176
27	Q	L	-2.1870
28	N	L	-2.0218
29	L	L	0.0000
36	N	L	-1.5051
37	V	L	-0.5661
38	W	L	-0.0749
39	L	L	0.0000
40	S	L	0.0000
41	W	L	0.0000
42	Y	L	0.0000
43	Q	L	0.0000
44	Q	L	-1.2083
45	K	L	-1.6852
46	P	L	-1.1680
47	G	L	-1.2084
48	N	L	-1.8469
49	I	L	-1.1559
50	P	L	0.0000
51	K	L	-1.5602
52	L	L	0.0000
53	L	L	0.0000
54	I	L	0.0000
55	Y	L	-0.1545
56	K	L	-0.9475
57	A	L	0.0000
65	S	L	-0.9045
66	N	L	-1.1658
67	L	L	-0.2946
68	H	L	-0.3664
69	T	L	-0.3170
70	G	L	-0.4055
71	V	L	-0.2609
72	P	L	-0.2960
74	S	L	-0.4179
75	R	L	-0.6713
76	F	L	0.0000
77	S	L	-0.5132
78	G	L	-0.5812
79	S	L	-0.7338
80	G	L	-0.9004
83	S	L	-1.0513
84	G	L	-1.3080
85	T	L	-1.3622
86	G	L	-1.2583
87	F	L	0.0000
88	T	L	-0.4909
89	L	L	0.0000
90	T	L	-0.2767
91	I	L	0.0000
92	S	L	-0.7718
93	S	L	-0.6827
94	L	L	0.0000
95	Q	L	-0.8846
96	P	L	-1.1223
97	E	L	-1.8360
98	D	L	0.0000
99	I	L	-0.7863
100	A	L	0.0000
101	T	L	-1.1137
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	G	L	0.2911
108	Q	L	-0.2696
109	S	L	-0.2564
114	Y	L	-0.0337
115	P	L	-0.7155
116	W	L	0.0000
117	T	L	-0.8102
118	F	L	0.0000
119	G	L	0.0000
120	G	L	-1.8806
121	G	L	0.0000
122	T	L	0.0000
123	K	L	-1.6925
124	L	L	0.0000
125	E	L	-1.2051
126	I	L	-0.8004
127	K	L	-1.5629