Project name: Y32N

Chain sequence(s)	H: EVQLVESGGGLVQPGGSLRLSCAVSGLSLTSNSVNWIRQAPGKGLEWVGLIWSNGDTDYNSAIKSRFTISRDTSKSTVYLQMNSLRAEDTAVYYCAREYYGYFDYWGQGTLVTVSS; L: DIQMTQSPSSLSASVGDRVTITCLASEGISSNLAWYQQKPGKAPKLLIYGANSLQTGVPSRFSGSGSATDYTLTISSLQPEDFATYYCQQSYKFPNTFGQGTKVEVK
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                                          (00:01:52)
[INFO]       Main:     Simulation completed successfully.                                          (00:01:54)

• Minimal score value: -2.6604
• Maximal score value: 1.734
• Average score: -0.5274
• Total score value: -117.6089

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	-2.0115
2	V	H	-1.0358
3	Q	H	-0.9722
4	L	H	0.0000
5	V	H	0.9362
6	E	H	0.0000
7	S	H	-0.1637
8	G	H	-0.4077
9	G	H	0.2537
11	G	H	0.8337
12	L	H	1.3810
13	V	H	-0.0205
14	Q	H	-1.3236
15	P	H	-1.5961
16	G	H	-1.4162
17	G	H	-1.1534
18	S	H	-1.0974
19	L	H	-0.6848
20	R	H	-1.4557
21	L	H	0.0000
22	S	H	-0.2417
23	C	H	0.0000
24	A	H	-0.0409
25	V	H	0.0000
26	S	H	-0.6601
27	G	H	-1.1419
28	L	H	-0.5412
29	S	H	-0.2568
30	L	H	0.0000
35	T	H	-0.6375
36	S	H	-0.5136
37	N	H	-0.4066
38	S	H	-0.3902
39	V	H	0.0000
40	N	H	0.0000
41	W	H	0.0000
42	I	H	0.0000
43	R	H	0.0000
44	Q	H	-0.5506
45	A	H	-0.9946
46	P	H	-0.7895
47	G	H	-1.4487
48	K	H	-2.3322
49	G	H	-1.5619
50	L	H	0.0000
51	E	H	-0.9358
52	W	H	0.0000
53	V	H	0.0000
54	G	H	0.0000
55	L	H	0.0000
56	I	H	0.0000
57	W	H	-0.9875
58	S	H	-1.1600
59	N	H	-1.8811
63	G	H	-1.7255
64	D	H	-2.2697
65	T	H	-1.2119
66	D	H	-0.7814
67	Y	H	-0.4979
68	N	H	-0.7591
69	S	H	-0.8966
70	A	H	-0.5537
71	I	H	0.0000
72	K	H	-1.8376
74	S	H	-1.1678
75	R	H	-1.0362
76	F	H	0.0000
77	T	H	-0.7364
78	I	H	0.0000
79	S	H	-0.6008
80	R	H	-0.8138
81	D	H	-1.1377
82	T	H	-1.0369
83	S	H	-1.2264
84	K	H	-2.0005
85	S	H	-1.1508
86	T	H	-0.6584
87	V	H	0.0000
88	Y	H	-0.4466
89	L	H	0.0000
90	Q	H	-0.9889
91	M	H	0.0000
92	N	H	-1.1921
93	S	H	-1.1864
94	L	H	0.0000
95	R	H	-2.1760
96	A	H	-1.6322
97	E	H	-2.1794
98	D	H	0.0000
99	T	H	-0.3055
100	A	H	0.0000
101	V	H	0.9305
102	Y	H	0.0000
103	Y	H	0.0000
104	C	H	0.0000
105	A	H	0.0000
106	R	H	0.0804
107	E	H	0.2722
108	Y	H	0.9429
109	Y	H	1.4089
113	G	H	0.5629
114	Y	H	0.0000
115	F	H	0.0000
116	D	H	0.0285
117	Y	H	0.1243
118	W	H	-0.3384
119	G	H	0.0000
120	Q	H	-1.2698
121	G	H	-0.2261
122	T	H	0.6269
123	L	H	1.7340
124	V	H	0.0000
125	T	H	0.3878
126	V	H	0.0000
127	S	H	-0.5069
128	S	H	-0.5464
1	D	L	-2.1872
2	I	L	0.0000
3	Q	L	-1.8133
4	M	L	0.0000
5	T	L	-0.6285
6	Q	L	0.0000
7	S	L	-0.4153
8	P	L	-0.4883
9	S	L	-0.7794
10	S	L	-0.8992
11	L	L	-0.7029
12	S	L	-0.9841
13	A	L	-0.8551
14	S	L	-0.7082
15	V	L	0.2103
16	G	L	-0.6045
17	D	L	-1.6429
18	R	L	-2.2556
19	V	L	0.0000
20	T	L	-0.6039
21	I	L	0.0000
22	T	L	-0.4117
23	C	L	0.0000
24	L	L	-0.4945
25	A	L	0.0000
26	S	L	-1.2590
27	E	L	-1.2513
28	G	L	-0.8300
29	I	L	0.0000
36	S	L	-0.7799
37	S	L	-1.0822
38	N	L	-1.0060
39	L	L	0.0000
40	A	L	0.0000
41	W	L	0.0000
42	Y	L	0.0000
43	Q	L	-0.9321
44	Q	L	0.0000
45	K	L	-1.5747
46	P	L	-1.0770
47	G	L	-1.6735
48	K	L	-2.6604
49	A	L	-1.6598
50	P	L	0.0000
51	K	L	-1.8967
52	L	L	0.0000
53	L	L	0.0000
54	I	L	0.0000
55	Y	L	-0.0468
56	G	L	-0.6990
57	A	L	0.0000
65	N	L	-1.4754
66	S	L	-0.4867
67	L	L	0.0047
68	Q	L	-0.3405
69	T	L	-0.2223
70	G	L	-0.4304
71	V	L	-0.3174
72	P	L	-0.3111
74	S	L	-0.3891
75	R	L	-0.7452
76	F	L	0.0000
77	S	L	-0.5485
78	G	L	-0.7518
79	S	L	-1.1613
80	G	L	-1.3461
83	S	L	-1.2553
84	A	L	-0.9719
85	T	L	-1.1392
86	D	L	-1.9079
87	Y	L	0.0000
88	T	L	-0.7172
89	L	L	0.0000
90	T	L	-0.5665
91	I	L	0.0000
92	S	L	-1.2103
93	S	L	-1.1159
94	L	L	0.0000
95	Q	L	-0.7534
96	P	L	-0.8365
97	E	L	-1.5033
98	D	L	0.0000
99	F	L	-0.0403
100	A	L	0.0000
101	T	L	-0.6689
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	S	L	0.1366
108	Y	L	0.1983
109	K	L	-0.4761
114	F	L	0.4285
115	P	L	-0.0696
116	N	L	0.0000
117	T	L	-0.6739
118	F	L	0.0000
119	G	L	0.0000
120	Q	L	-1.5799
121	G	L	0.0000
122	T	L	0.0000
123	K	L	-1.1950
124	V	L	0.0000
125	E	L	-1.1150
126	V	L	-0.5022
127	K	L	-1.4593