Project name: 50329f85609fcb7

Chain sequence(s)	A: AIITVTPKSFGSPGSLGKLLCEVTPVSGQERFVWSSLDTPSQRSFSGPWLEAQEAQLLSQPWQCQLYQGERLLGAAVYFTEL; H: QVQLVQSGAEVKKPGASVKVSCKASGFTLTNYGMNWVRQARGQRLEWIGWINTDTGEPTYADDFKGRFVFSLDTSVSTAYLQISSLKAEDTAVYYCARNPPYYYGTNYAEAMDYWGQGTTVTVSS; L: DIQMTQSPSSLSASVGDRVTITCSSSQDISNYLNWYLQKPGQSPQLLIYYTSTLHLGVPSRFSGSGSGTEFTLTISSLQPDDFATYYCQQYYNLPWTFGQGTKVEIK
Selected Chain(s)	A,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                                          (00:03:09)
[INFO]       Main:     Simulation completed successfully.                                          (00:03:11)

• Minimal score value: -3.2802
• Maximal score value: 2.1404
• Average score: -0.461
• Total score value: -144.7634

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	A	A	0.3942
2	I	A	0.6518
3	I	A	0.1332
4	T	A	-0.1280
5	V	A	-0.1077
6	T	A	-0.5592
7	P	A	-1.1337
8	K	A	-1.7061
9	S	A	-0.7142
10	F	A	0.8340
11	G	A	-0.0442
12	S	A	-0.1379
13	P	A	-0.3536
14	G	A	-0.8342
15	S	A	-0.9355
16	L	A	-0.4675
17	G	A	0.0000
18	K	A	-0.8318
19	L	A	0.0000
20	L	A	-0.6029
21	C	A	0.0000
22	E	A	-1.1885
23	V	A	-0.0437
24	T	A	0.2227
25	P	A	0.5059
26	V	A	1.0831
27	S	A	-0.0312
28	G	A	-0.8711
29	Q	A	-1.6833
30	E	A	-1.4701
31	R	A	-1.9571
32	F	A	-0.4526
33	V	A	-0.1996
34	W	A	0.0000
35	S	A	-0.3267
36	S	A	0.0000
37	L	A	0.0952
38	D	A	-1.6050
39	T	A	-0.9755
40	P	A	-0.7217
41	S	A	-0.2650
42	Q	A	-0.3578
43	R	A	0.0000
44	S	A	0.0000
45	F	A	0.0000
46	S	A	-0.2813
47	G	A	-0.2604
48	P	A	-0.3199
49	W	A	0.0741
50	L	A	0.0000
51	E	A	-0.5685
52	A	A	-1.1240
53	Q	A	0.0000
54	E	A	-2.1115
55	A	A	-1.2252
56	Q	A	-1.2062
57	L	A	-0.2635
58	L	A	0.9727
59	S	A	-0.0039
60	Q	A	-0.4182
61	P	A	0.0000
62	W	A	0.0000
63	Q	A	0.3754
64	C	A	0.0000
65	Q	A	0.1239
66	L	A	0.0000
67	Y	A	-0.9662
68	Q	A	-1.6127
69	G	A	-2.0656
70	E	A	-2.8978
71	R	A	-2.1577
72	L	A	0.0881
73	L	A	0.8129
74	G	A	0.4647
75	A	A	0.5271
76	A	A	0.5043
77	V	A	1.3144
78	Y	A	1.4683
79	F	A	2.0682
80	T	A	0.9410
81	E	A	-0.5182
82	L	A	1.1070
83	Q	H	-1.4709
84	V	H	-0.7788
85	Q	H	-1.2560
86	L	H	0.0000
87	V	H	0.3654
88	Q	H	0.0000
89	S	H	-0.4685
90	G	H	-0.5693
91	A	H	0.0195
92	E	H	0.1306
93	V	H	0.9620
94	K	H	-0.8757
95	K	H	-2.0793
96	P	H	-1.8635
97	G	H	-1.4489
98	A	H	-1.1709
99	S	H	-1.1466
100	V	H	0.0000
101	K	H	-1.4290
102	V	H	0.0000
103	S	H	-0.3664
104	C	H	0.0000
105	K	H	-0.6012
106	A	H	-0.3559
107	S	H	-0.7557
108	G	H	-1.0022
109	F	H	-0.3039
110	T	H	-0.0102
111	L	H	0.0000
112	T	H	-0.5143
113	N	H	-0.8257
114	Y	H	0.1489
115	G	H	0.0000
116	M	H	0.0000
117	N	H	0.0000
118	W	H	0.0000
119	V	H	0.0000
120	R	H	-0.4207
121	Q	H	-0.9325
122	A	H	-1.5773
123	R	H	-2.4176
124	G	H	-2.0259
125	Q	H	-1.6049
126	R	H	-1.0190
127	L	H	0.0000
128	E	H	-0.6350
129	W	H	0.0000
130	I	H	0.0000
131	G	H	0.0000
132	W	H	0.0000
133	I	H	0.0000
134	N	H	0.0000
135	T	H	-1.1093
136	D	H	-2.1435
137	T	H	-1.2580
138	G	H	-1.5480
139	E	H	-1.9159
140	P	H	-0.6252
141	T	H	0.0000
142	Y	H	-1.0449
143	A	H	0.0000
144	D	H	-3.2802
145	D	H	-3.2326
146	F	H	0.0000
147	K	H	-2.7180
148	G	H	-1.7496
149	R	H	-1.3318
150	F	H	0.0000
151	V	H	-0.0629
152	F	H	0.0000
153	S	H	-0.0516
154	L	H	0.1512
155	D	H	-0.6508
156	T	H	-0.3053
157	S	H	0.0161
158	V	H	0.5464
159	S	H	-0.1532
160	T	H	0.0000
161	A	H	0.0000
162	Y	H	-0.2846
163	L	H	0.0000
164	Q	H	-0.9396
165	I	H	0.0000
166	S	H	-0.8433
167	S	H	-1.0464
168	L	H	0.0000
169	K	H	-2.4643
170	A	H	-1.8648
171	E	H	-2.2505
172	D	H	0.0000
173	T	H	-0.9578
174	A	H	0.0000
175	V	H	-0.2371
176	Y	H	0.0000
177	Y	H	0.0000
178	C	H	0.0000
179	A	H	0.0000
180	R	H	0.0000
181	N	H	-0.1837
182	P	H	0.2442
183	P	H	0.7518
184	Y	H	1.9070
185	Y	H	2.1404
186	Y	H	1.5297
187	G	H	0.6977
188	T	H	-0.3597
189	N	H	0.0000
190	Y	H	-0.0873
191	A	H	0.0000
192	E	H	-1.6220
193	A	H	-0.7816
194	M	H	0.0000
195	D	H	-0.4667
196	Y	H	-0.1476
197	W	H	-0.2904
198	G	H	0.0000
199	Q	H	-1.4333
200	G	H	-0.7224
201	T	H	0.0000
202	T	H	0.0235
203	V	H	0.0000
204	T	H	-0.2860
205	V	H	0.0000
206	S	H	-0.8339
207	S	H	-0.8375
208	D	L	-1.4270
209	I	L	0.2065
210	Q	L	-0.7250
211	M	L	0.0079
212	T	L	0.0000
213	Q	L	0.0000
214	S	L	-0.3602
215	P	L	-0.6650
216	S	L	-0.9366
217	S	L	-1.1480
218	L	L	-0.8254
219	S	L	-1.1781
220	A	L	0.0000
221	S	L	-1.0177
222	V	L	-0.2013
223	G	L	-0.9640
224	D	L	-1.9774
225	R	L	-2.3989
226	V	L	0.0000
227	T	L	-0.5041
228	I	L	0.0000
229	T	L	-0.5421
230	C	L	0.0000
231	S	L	-1.3915
232	S	L	-1.5572
233	S	L	-1.1522
234	Q	L	-1.8869
235	D	L	-2.6782
236	I	L	-0.8121
237	S	L	-1.1754
238	N	L	-0.7996
239	Y	L	0.3903
240	L	L	0.0000
241	N	L	0.0000
242	W	L	0.0000
243	Y	L	0.0000
244	L	L	-0.4031
245	Q	L	-0.9467
246	K	L	-1.2358
247	P	L	-1.0003
248	G	L	-1.3966
249	Q	L	-2.0555
250	S	L	-1.4271
251	P	L	0.0000
252	Q	L	-1.3697
253	L	L	0.0000
254	L	L	0.0000
255	I	L	0.0000
256	Y	L	0.7205
257	Y	L	0.8100
258	T	L	0.0000
259	S	L	-0.0699
260	T	L	0.5034
261	L	L	0.8272
262	H	L	0.5992
263	L	L	1.4246
264	G	L	0.4227
265	V	L	0.4186
266	P	L	-0.1480
267	S	L	-0.4660
268	R	L	-0.9778
269	F	L	0.0000
270	S	L	-0.3840
271	G	L	-0.1708
272	S	L	-0.7976
273	G	L	-1.2566
274	S	L	-1.3642
275	G	L	-1.6245
276	T	L	-2.0813
277	E	L	-2.4720
278	F	L	0.0000
279	T	L	-0.6767
280	L	L	0.0000
281	T	L	-0.6580
282	I	L	0.0000
283	S	L	-1.5730
284	S	L	-1.4111
285	L	L	0.0000
286	Q	L	-1.0525
287	P	L	-0.9907
288	D	L	-1.6239
289	D	L	0.0000
290	F	L	-0.4857
291	A	L	0.0000
292	T	L	0.0000
293	Y	L	0.0000
294	Y	L	0.0000
295	C	L	0.0000
296	Q	L	0.0000
297	Q	L	0.0000
298	Y	L	0.0000
299	Y	L	0.1530
300	N	L	-0.3923
301	L	L	0.0000
302	P	L	-0.4567
303	W	L	0.0000
304	T	L	0.1694
305	F	L	0.0000
306	G	L	0.0000
307	Q	L	-0.8756
308	G	L	0.0000
309	T	L	0.0000
310	K	L	-2.0907
311	V	L	0.0000
312	E	L	-2.0169
313	I	L	-1.0518
314	K	L	-1.7330