Project name: c95f008dbb2664e

Chain sequence(s)	H: EVQLQQSGAEVVRSGASVKLSCTASGFNIKDYYIHWVKQRPEKGLEWIGWIDPEIGDTEYVPKFQGKATMTADTSSNTAYLQLSSLTSEDTAVYYCNAGHDYDRGRFPYWGQGTLVTVSAAKTTPPSVYPLAPGSAAQTNSMVTLGCLVKGYFPEPVTVTWNSGSLSSGVHTFPAVLQSDLYTLSSSVTVPSSTWPSETVTCNVAHPASSTKVDKKIVPRD; L: DIVMTQSQKFMSTSVGDRVSITCKASQNVGTAVAWYQQKPGQSPKLMIYSASNRYTGVPDRFTGSGSGTDFTLTISNMQSEDLADYFCQQYSSYPLTFGAGTKLELKRADAAPTVSIFPPSSEQLTSGGASVVCFLNNFYPKDINVKWKIDGSERQNGVLNSATDQDSKDSTYSMSSTLTLTKDEYERHNSYTCEATHKTSTSPIVKSFNRNEC
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                                          (00:03:41)
[INFO]       Main:     Simulation completed successfully.                                          (00:03:44)

• Minimal score value: -3.5846
• Maximal score value: 1.016
• Average score: -0.7724
• Total score value: -335.9724

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	D	L	-1.2430
2	I	L	-0.1872
3	V	L	1.0160
4	M	L	0.0000
5	T	L	-0.3049
6	Q	L	0.0000
7	S	L	-1.2817
8	Q	L	-1.9410
9	K	L	-2.1556
10	F	L	-0.7306
11	M	L	-0.4327
12	S	L	-0.4381
13	T	L	0.0000
14	S	L	-0.6251
15	V	L	0.0786
16	G	L	-1.1478
17	D	L	-1.9979
18	R	L	-2.6986
19	V	L	0.0000
20	S	L	-0.6894
21	I	L	0.0000
22	T	L	-0.9529
23	C	L	0.0000
24	K	L	-1.7397
25	A	L	0.0000
26	S	L	-1.0498
27	Q	L	-2.0986
28	N	L	-2.3273
29	V	L	0.0000
30	G	L	-1.1074
31	T	L	-0.8382
32	A	L	0.0000
33	V	L	0.0000
34	A	L	0.0000
35	W	L	0.0000
36	Y	L	0.0000
37	Q	L	0.0000
38	Q	L	-1.4775
39	K	L	-1.8714
40	P	L	-1.3608
41	G	L	-1.3457
42	Q	L	-2.1018
43	S	L	-1.6287
44	P	L	0.0000
45	K	L	-1.3565
46	L	L	0.0000
47	M	L	0.0000
48	I	L	0.0000
49	Y	L	-0.3990
50	S	L	-0.5897
51	A	L	0.0000
52	S	L	-0.9931
53	N	L	-1.4258
54	R	L	-1.5508
55	Y	L	-0.8182
56	T	L	-0.4888
57	G	L	-0.8186
58	V	L	0.0000
59	P	L	-1.2955
60	D	L	-2.1756
61	R	L	-1.9217
62	F	L	0.0000
63	T	L	-0.9356
64	G	L	0.0000
65	S	L	-0.8899
66	G	L	-1.2163
67	S	L	-1.3630
68	G	L	-1.6933
69	T	L	-2.1409
70	D	L	-2.6709
71	F	L	0.0000
72	T	L	-0.7764
73	L	L	0.0000
74	T	L	0.0000
75	I	L	0.0000
76	S	L	-2.0171
77	N	L	-2.2014
78	M	L	0.0000
79	Q	L	-1.3193
80	S	L	-0.7987
81	E	L	-1.8459
82	D	L	0.0000
83	L	L	-0.4457
84	A	L	0.0000
85	D	L	-1.2159
86	Y	L	0.0000
87	F	L	0.0000
88	C	L	0.0000
89	Q	L	0.0000
90	Q	L	0.0000
91	Y	L	0.0000
92	S	L	-0.6550
93	S	L	-0.3066
94	Y	L	0.2520
95	P	L	-0.0240
96	L	L	0.0000
97	T	L	-0.0176
98	F	L	0.0000
99	G	L	0.0000
100	A	L	-1.2488
101	G	L	-1.1319
102	T	L	0.0000
103	K	L	-1.0609
104	L	L	0.0000
105	E	L	0.0000
106	L	L	-0.4953
107	K	L	-1.8234
108	R	L	-1.8437
109	A	L	-1.2852
110	D	L	-2.0568
111	A	L	-1.0976
112	A	L	-0.6059
113	P	L	0.0000
114	T	L	-0.0438
115	V	L	0.2006
116	S	L	0.1244
117	I	L	0.0914
118	F	L	0.0000
119	P	L	0.0000
120	P	L	0.0000
121	S	L	0.0000
122	S	L	-1.6659
123	E	L	-2.1708
124	Q	L	0.0000
125	L	L	-1.1669
126	T	L	-0.8958
127	S	L	-0.8633
128	G	L	-1.1240
129	G	L	-1.0363
130	A	L	0.0000
131	S	L	0.0000
132	V	L	0.0000
133	V	L	0.0000
134	C	L	0.0000
135	F	L	0.0000
136	L	L	0.0000
137	N	L	0.0000
138	N	L	-0.7726
139	F	L	0.0000
140	Y	L	0.0000
141	P	L	-1.8373
142	K	L	-2.0193
143	D	L	-2.4243
144	I	L	-1.5433
145	N	L	-1.7823
146	V	L	-0.7171
147	K	L	-1.5017
148	W	L	0.0000
149	K	L	-2.2196
150	I	L	0.0000
151	D	L	-2.2165
152	G	L	-1.8263
153	S	L	-2.1389
154	E	L	-3.1272
155	R	L	-2.6342
156	Q	L	-2.5804
157	N	L	-2.0853
158	G	L	-0.8815
159	V	L	-0.6128
160	L	L	-0.1868
161	N	L	-0.9270
162	S	L	-0.4433
163	A	L	-0.7550
164	T	L	-1.0751
165	D	L	-2.0840
166	Q	L	-1.7616
167	D	L	-2.0299
168	S	L	-1.7900
169	K	L	-2.4308
170	D	L	-2.0877
171	S	L	-1.9238
172	T	L	0.0000
173	Y	L	0.0000
174	S	L	0.0000
175	M	L	-0.4342
176	S	L	0.0000
177	S	L	0.0000
178	T	L	-0.0831
179	L	L	0.0000
180	T	L	-0.2748
181	L	L	0.0000
182	T	L	-1.3943
183	K	L	-2.3445
184	D	L	-3.3300
185	E	L	-2.6529
186	Y	L	0.0000
187	E	L	-3.5846
188	R	L	-3.5347
189	H	L	-2.9414
190	N	L	-2.8096
191	S	L	-1.6745
192	Y	L	0.0000
193	T	L	-0.9638
194	C	L	0.0000
195	E	L	-0.3081
196	A	L	0.0000
197	T	L	-0.9146
198	H	L	0.0000
199	K	L	-2.4166
200	T	L	-1.1822
201	S	L	-0.7236
202	T	L	-0.5782
203	S	L	-0.3066
204	P	L	-0.3376
205	I	L	0.5624
206	V	L	0.6830
207	K	L	-0.1498
208	S	L	-0.4563
209	F	L	-1.0231
210	N	L	-2.1399
211	R	L	-2.5186
212	N	L	-2.7942
213	E	L	-2.7071
214	C	L	-2.0576
1	E	H	-1.9144
2	V	H	-0.9324
3	Q	H	-1.3007
4	L	H	0.0000
5	Q	H	-1.3838
6	Q	H	0.0000
7	S	H	-0.7703
8	G	H	-0.7039
9	A	H	0.1127
10	E	H	-0.3670
11	V	H	0.7878
12	V	H	-0.2793
13	R	H	-1.9461
14	S	H	-1.2632
15	G	H	-1.0873
16	A	H	-0.8867
17	S	H	-1.0499
18	V	H	0.0000
19	K	H	-1.9186
20	L	H	0.0000
21	S	H	-0.5725
22	C	H	0.0000
23	T	H	-0.7103
24	A	H	0.0000
25	S	H	-0.9900
26	G	H	-1.0417
27	F	H	-0.8092
28	N	H	-1.1273
29	I	H	0.0000
30	K	H	-2.5783
31	D	H	-2.7772
32	Y	H	-1.6413
33	Y	H	-0.9979
34	I	H	0.0000
35	H	H	0.0000
36	W	H	0.0000
37	V	H	0.0000
38	K	H	0.0000
39	Q	H	-1.4945
40	R	H	-2.3080
41	P	H	-1.9920
42	E	H	-2.9857
43	K	H	-3.1574
44	G	H	-1.8229
45	L	H	-1.2505
46	E	H	-1.3858
47	W	H	0.0000
48	I	H	0.0000
49	G	H	0.0000
50	W	H	-0.3095
51	I	H	0.0000
52	D	H	-1.5767
52A	P	H	0.0000
53	E	H	-2.2270
54	I	H	0.0467
55	G	H	-1.0606
56	D	H	-1.8982
57	T	H	-1.1147
58	E	H	-1.2732
59	Y	H	-0.7714
60	V	H	-0.7344
61	P	H	-1.4865
62	K	H	-2.1616
63	F	H	0.0000
64	Q	H	-2.0710
65	G	H	-1.5052
66	K	H	-1.3204
67	A	H	0.0000
68	T	H	-0.7623
69	M	H	0.0000
70	T	H	-0.5347
71	A	H	-0.9363
72	D	H	-1.3592
73	T	H	-1.5355
74	S	H	-0.8579
75	S	H	-0.7574
76	N	H	-0.9063
77	T	H	0.0000
78	A	H	0.0000
79	Y	H	-0.2652
80	L	H	0.0000
81	Q	H	-1.1535
82	L	H	0.0000
82A	S	H	-0.8570
82B	S	H	-0.8269
82C	L	H	0.0000
83	T	H	-1.1986
84	S	H	-1.5810
85	E	H	-2.0535
86	D	H	0.0000
87	T	H	-0.5602
88	A	H	0.0000
89	V	H	0.3140
90	Y	H	0.0000
91	Y	H	0.0000
92	C	H	0.0000
93	N	H	0.0000
94	A	H	0.0000
95	G	H	0.0000
96	H	H	-1.2861
97	D	H	-1.6777
98	Y	H	-0.0974
99	D	H	-1.0976
100	R	H	-1.9602
100A	G	H	0.0000
100B	R	H	-0.8060
100C	F	H	0.0000
101	P	H	0.0000
102	Y	H	-0.2213
103	W	H	0.0000
104	G	H	0.0000
105	Q	H	-1.4515
106	G	H	-0.5914
107	T	H	0.0000
108	L	H	0.7326
109	V	H	0.0000
110	T	H	-0.0006
111	V	H	0.0000
112	S	H	-1.2303
113	A	H	-1.3762
114	A	H	-1.5868
115	K	H	-2.1758
116	T	H	-1.0427
117	T	H	-0.6037
118	P	H	-0.6961
119	P	H	0.0000
120	S	H	-0.4221
121	V	H	0.0000
122	Y	H	0.0000
123	P	H	-0.9836
124	L	H	0.0000
125	A	H	0.0000
126	P	H	-0.6684
127	G	H	-1.5647
128	S	H	-1.3564
129	A	H	-0.8656
130	A	H	-0.7698
131	Q	H	-1.5221
132	T	H	-1.2956
133	N	H	-1.4542
134	S	H	-0.4422
135	M	H	0.5296
136	V	H	0.2695
137	T	H	0.0000
138	L	H	0.0000
139	G	H	0.0000
140	C	H	0.0000
141	L	H	0.0000
142	V	H	0.0000
143	K	H	-0.0772
144	G	H	-0.3049
145	Y	H	0.0000
146	F	H	0.0000
147	P	H	-0.8165
148	E	H	-0.9769
149	P	H	-0.9300
150	V	H	-0.4911
151	T	H	-0.3329
152	V	H	-0.3006
153	T	H	-0.4014
154	W	H	0.0000
155	N	H	-0.9746
156	S	H	-0.7724
157	G	H	-0.5780
158	S	H	-0.4471
159	L	H	-0.1071
160	S	H	-0.3089
161	S	H	-0.2667
162	G	H	-0.1709
163	V	H	0.2483
164	H	H	-0.0592
165	T	H	0.0476
166	F	H	0.0000
167	P	H	-0.3952
168	A	H	0.0971
169	V	H	0.4781
170	L	H	0.6390
171	Q	H	-0.2049
172	S	H	-0.7966
173	D	H	-1.6988
174	L	H	-0.6727
175	Y	H	0.0000
176	T	H	0.0000
177	L	H	0.3006
178	S	H	0.0000
179	S	H	0.0000
180	S	H	0.0000
181	V	H	0.0000
182	T	H	0.2387
183	V	H	0.0000
184	P	H	0.0493
185	S	H	-0.2281
186	S	H	-0.5249
187	T	H	-0.8081
188	W	H	0.0000
189	P	H	-0.7260
190	S	H	-1.2895
191	E	H	-2.0605
192	T	H	-1.1879
193	V	H	0.0000
194	T	H	-1.4853
195	C	H	0.0000
196	N	H	-1.6126
197	V	H	0.0000
198	A	H	-0.9987
199	H	H	0.0000
200	P	H	-0.7947
201	A	H	-0.4309
202	S	H	-0.5078
203	S	H	-0.7312
204	T	H	-0.9706
205	K	H	-2.0633
206	V	H	-1.6993
207	D	H	-2.7618
208	K	H	-1.9142
209	K	H	-1.9899
210	I	H	0.0000
211	V	H	0.2663
212	P	H	-0.9322
213	R	H	-2.4517
214	D	H	-2.7282