Project name: 2510-11.pdb

Chain sequence(s)	H: EVQLQQSGAELVKPGASVKLSCKASGYTFTSYWMHWVKQRPGQGLEWIGGINPSNGRTNYNEKFKNKATLTVDKSSSTAYMQLSSLTYEDSAVYYCTRATIPFAYWGQGTLVTVSA; L: DVQMIQSPSSLSASLGERVSLTCRASQEISGYLSWLQQKPDGTIKRLIYAASTLDSGVPKRFSGSRSGSDYSLTISSLESEDFADYYCLQYASYPYTFGGGTKLELK
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]                                                (00:00:01)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:01)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with all chain(s) selected           (00:00:01)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:01)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:01)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:02:37)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:39)

• Minimal score value: -3.5125
• Maximal score value: 1.6405
• Average score: -0.6261
• Total score value: -139.6163

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	-2.1506
2	V	H	-1.2460
3	Q	H	-2.1057
4	L	H	0.0000
5	Q	H	-2.1686
6	Q	H	0.0000
7	S	H	-0.9387
8	G	H	-0.5921
9	A	H	0.2597
11	E	H	0.0880
12	L	H	1.0279
13	V	H	-0.1645
14	K	H	-1.3297
15	P	H	-0.9021
16	G	H	-0.8989
17	A	H	-0.8795
18	S	H	-0.9551
19	V	H	0.0000
20	K	H	-1.3170
21	L	H	0.0000
22	S	H	-0.6416
23	C	H	0.0000
24	K	H	-1.5578
25	A	H	0.0000
26	S	H	-1.3998
27	G	H	-1.2693
28	Y	H	-0.5467
29	T	H	-0.0992
30	F	H	0.0000
35	T	H	-0.6956
36	S	H	-0.0165
37	Y	H	0.5357
38	W	H	0.2324
39	M	H	0.0000
40	H	H	0.0000
41	W	H	0.0000
42	V	H	0.0000
43	K	H	0.0000
44	Q	H	-0.9008
45	R	H	-1.6247
46	P	H	-1.0902
47	G	H	-1.4031
48	Q	H	-1.9876
49	G	H	-1.3511
50	L	H	0.0000
51	E	H	-0.9975
52	W	H	0.0000
53	I	H	0.0000
54	G	H	0.0000
55	G	H	0.0000
56	I	H	0.0000
57	N	H	-1.0799
58	P	H	0.0000
59	S	H	-1.4537
62	N	H	-2.2504
63	G	H	-2.1078
64	R	H	-2.4746
65	T	H	-1.1874
66	N	H	-0.6953
67	Y	H	-1.0652
68	N	H	-2.1191
69	E	H	-3.5125
70	K	H	-3.3274
71	F	H	0.0000
72	K	H	-3.2558
74	N	H	-2.7136
75	K	H	-1.9614
76	A	H	0.0000
77	T	H	-0.8016
78	L	H	0.0000
79	T	H	-0.5517
80	V	H	-0.6758
81	D	H	-1.4342
82	K	H	-2.2469
83	S	H	-1.2249
84	S	H	-0.9999
85	S	H	-1.1505
86	T	H	0.0000
87	A	H	0.0000
88	Y	H	-0.1495
89	M	H	0.0000
90	Q	H	-0.9870
91	L	H	0.0000
92	S	H	-0.9296
93	S	H	-0.9295
94	L	H	0.0000
95	T	H	-0.4859
96	Y	H	0.1288
97	E	H	-1.3361
98	D	H	0.0000
99	S	H	-0.0748
100	A	H	0.0000
101	V	H	0.1993
102	Y	H	0.0000
103	Y	H	0.0000
104	C	H	0.0000
105	T	H	0.0000
106	R	H	0.0000
107	A	H	0.0000
108	T	H	0.8485
109	I	H	1.6405
114	P	H	0.0000
115	F	H	0.0000
116	A	H	0.4383
117	Y	H	0.2445
118	W	H	-0.3489
119	G	H	0.0000
120	Q	H	-1.6905
121	G	H	-0.5634
122	T	H	0.0000
123	L	H	0.8006
124	V	H	0.0000
125	T	H	0.4169
126	V	H	0.0000
127	S	H	-0.0697
128	A	H	-0.2922
1	D	L	-2.2712
2	V	L	-1.6711
3	Q	L	-1.8708
4	M	L	0.0000
5	I	L	-0.1879
6	Q	L	-0.5290
7	S	L	-0.4772
8	P	L	-0.4204
9	S	L	-0.6670
10	S	L	-0.8872
11	L	L	-0.5513
12	S	L	-0.9006
13	A	L	0.0000
14	S	L	-0.6979
15	L	L	0.3387
16	G	L	-0.7301
17	E	L	-1.4844
18	R	L	-2.2091
19	V	L	0.0000
20	S	L	-0.6650
21	L	L	0.0000
22	T	L	-0.6764
23	C	L	0.0000
24	R	L	-2.4587
25	A	L	0.0000
26	S	L	-1.9536
27	Q	L	-2.8255
28	E	L	-2.6582
29	I	L	0.0000
36	S	L	-0.7599
37	G	L	-0.1522
38	Y	L	1.0371
39	L	L	0.0000
40	S	L	0.0000
41	W	L	0.0000
42	L	L	0.0000
43	Q	L	0.0000
44	Q	L	0.0000
45	K	L	-1.4946
46	P	L	-1.3102
47	D	L	-2.2204
48	G	L	-1.5283
49	T	L	-1.2202
50	I	L	0.0000
51	K	L	-0.7860
52	R	L	0.0000
53	L	L	0.0000
54	I	L	0.0000
55	Y	L	0.7264
56	A	L	0.5336
57	A	L	0.0000
65	S	L	-0.2929
66	T	L	0.0256
67	L	L	-0.1832
68	D	L	-0.5246
69	S	L	-0.4714
70	G	L	-0.8146
71	V	L	0.0000
72	P	L	-1.1320
74	K	L	-1.9300
75	R	L	-1.5014
76	F	L	0.0000
77	S	L	-0.6820
78	G	L	-0.4863
79	S	L	-1.0153
80	R	L	-1.8176
83	S	L	-1.3534
84	G	L	-1.4667
85	S	L	-1.9792
86	D	L	-1.7817
87	Y	L	0.0000
88	S	L	-0.9065
89	L	L	0.0000
90	T	L	-0.6707
91	I	L	0.0000
92	S	L	-1.5900
93	S	L	-1.2923
94	L	L	0.0000
95	E	L	-1.0806
96	S	L	-1.0582
97	E	L	-2.0127
98	D	L	0.0000
99	F	L	-0.7886
100	A	L	0.0000
101	D	L	-1.1964
102	Y	L	0.0000
103	Y	L	0.0000
104	C	L	0.0000
105	L	L	0.0000
106	Q	L	0.0000
107	Y	L	0.0000
108	A	L	0.3670
109	S	L	-0.1114
114	Y	L	0.1323
115	P	L	-0.5259
116	Y	L	-0.1034
117	T	L	-0.4912
118	F	L	-0.1118
119	G	L	0.0000
120	G	L	-0.7487
121	G	L	-0.8843
122	T	L	0.0000
123	K	L	-1.4920
124	L	L	0.0000
125	E	L	-1.4039
126	L	L	-0.6029
127	K	L	-1.4932