Project name: seed11

Chain sequence(s)	A: NASCEYSASHKQDLLLGSTGSISCPSLSCQSDAQSPAVTWYKNGKLLSVERSNRIVVDEVYDYHQGTYVCDYTQSDTVSSWTVRAVVQVRTIVGDTKDKTHTCPPCPAPEAAGGPSVFLFPPKPKDTLMISRTPEVTCVVVDVSHEDPEVKFNWYVDGVEVHNAKTKPREEQYNSTYRVVSVLTVLHQDWLNGKEYKCKVSNKALGAPIEKTISKAKGQPREPQVYTLPPSRDELTKNQVSLTCLVKGFYPSDIAVEWESNGQPENNYKTTPPVLDSDGSFFLYSKLTVDKSRWQQGNVFSCSVMHEALHNHYTQKSLSLSPGK; B: NASCEYSASHKQDLLLGSTGSISCPSLSCQSDAQSPAVTWYKNGKLLSVERSNRIVVDEVYDYHQGTYVCDYTQSDTVSSWTVRAVVQVRTIVGDTKDKTHTCPPCPAPEAAGGPSVFLFPPKPKDTLMISRTPEVTCVVVDVSHEDPEVKFNWYVDGVEVHNAKTKPREEQYNSTYRVVSVLTVLHQDWLNGKEYKCKVSNKALGAPIEKTISKAKGQPREPQVYTLPPSRDELTKNQVSLTCLVKGFYPSDIAVEWESNGQPENNYKTTPPVLDSDGSFFLYSKLTVDKSRWQQGNVFSCSVMHEALHNHYTQKSLSLSPGK
Selected Chain(s)	A,B
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                                          (00:12:59)
[INFO]       Main:     Simulation completed successfully.                                          (00:13:07)

• Minimal score value: -3.9608
• Maximal score value: 1.5089
• Average score: -0.7207
• Total score value: -467.0459

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	N	A	-1.1976
2	A	A	-0.6688
3	S	A	-0.5446
4	C	A	0.1075
5	E	A	-0.8183
6	Y	A	0.6772
7	S	A	0.2747
8	A	A	0.1808
9	S	A	0.0595
10	H	A	0.0000
11	K	A	-0.7710
12	Q	A	-1.0417
13	D	A	-1.2265
14	L	A	0.0000
15	L	A	0.6063
16	L	A	0.6987
17	G	A	-0.0626
18	S	A	-0.1199
19	T	A	-0.2541
20	G	A	0.0110
21	S	A	0.0615
22	I	A	0.0000
23	S	A	-0.1837
24	C	A	0.0000
25	P	A	0.0000
26	S	A	-0.0854
27	L	A	0.0000
28	S	A	-0.0618
29	C	A	0.2669
30	Q	A	-0.8128
31	S	A	-1.3424
32	D	A	-2.1439
33	A	A	-1.3527
34	Q	A	-1.7264
35	S	A	-1.4624
36	P	A	-0.9258
37	A	A	-0.8678
38	V	A	0.0000
39	T	A	-0.1115
40	W	A	0.0000
41	Y	A	0.0000
42	K	A	-0.9690
43	N	A	-1.4424
44	G	A	-0.8830
45	K	A	-0.9899
46	L	A	0.4033
47	L	A	0.1652
48	S	A	0.0733
49	V	A	0.3599
50	E	A	-0.4487
51	R	A	-1.1551
52	S	A	0.0000
53	N	A	0.0000
54	R	A	-0.8162
55	I	A	0.0000
56	V	A	0.9784
57	V	A	0.0000
58	D	A	-0.3775
59	E	A	0.0000
60	V	A	0.0000
61	Y	A	-0.1713
62	D	A	-0.5759
63	Y	A	-0.6358
64	H	A	-0.8834
65	Q	A	-1.5090
66	G	A	-1.1174
67	T	A	0.0000
68	Y	A	0.0000
69	V	A	0.0000
70	C	A	0.0000
71	D	A	0.0000
72	Y	A	0.0000
73	T	A	-0.2161
74	Q	A	-0.9577
75	S	A	-0.9920
76	D	A	-1.3473
77	T	A	-0.1095
78	V	A	1.0781
79	S	A	0.0552
80	S	A	-0.3606
81	W	A	-0.0426
82	T	A	0.0752
83	V	A	0.1719
84	R	A	0.0000
85	A	A	0.0000
86	V	A	0.0000
87	V	A	0.0000
88	Q	A	-0.8881
89	V	A	0.0000
90	R	A	-1.4042
91	T	A	-0.2187
92	I	A	0.8823
93	V	A	1.4985
94	G	A	-0.1549
95	D	A	-2.3317
96	T	A	-2.4251
97	K	A	-3.7247
98	D	A	-3.9608
99	K	A	-3.5801
100	T	A	-2.0617
101	H	A	-1.5943
102	T	A	-0.8872
103	C	A	0.3099
104	P	A	-0.0166
105	P	A	0.1073
106	C	A	0.4703
107	P	A	-0.3716
108	A	A	-0.5465
109	P	A	-1.0965
110	E	A	-2.0211
111	A	A	-1.0494
112	A	A	-0.7821
113	G	A	-0.9619
114	G	A	-0.7259
115	P	A	0.0000
116	S	A	-0.2836
117	V	A	0.0000
118	F	A	0.0000
119	L	A	0.0000
120	F	A	0.0000
121	P	A	-0.2955
122	P	A	0.0000
123	K	A	-1.1088
124	P	A	-0.7876
125	K	A	-0.6590
126	D	A	0.0000
127	T	A	0.0000
128	L	A	0.0000
129	M	A	0.5216
130	I	A	1.5089
131	S	A	0.4333
132	R	A	-0.3807
133	T	A	-0.0680
134	P	A	0.0000
135	E	A	-0.4280
136	V	A	0.0000
137	T	A	0.0000
138	C	A	0.0000
139	V	A	0.0000
140	V	A	0.0000
141	V	A	0.0000
142	D	A	-0.9439
143	V	A	0.0000
144	S	A	-1.9528
145	H	A	-2.5852
146	E	A	-2.9722
147	D	A	-2.6079
148	P	A	-2.6027
149	E	A	-3.1221
150	V	A	-1.9682
151	K	A	-2.2504
152	F	A	-1.2279
153	N	A	-1.1944
154	W	A	0.0000
155	Y	A	-0.6107
156	V	A	-0.8281
157	D	A	-1.8891
158	G	A	-0.7788
159	V	A	0.6483
160	E	A	-0.6245
161	V	A	-0.5476
162	H	A	-1.8909
163	N	A	-2.1916
164	A	A	-1.8446
165	K	A	-2.4701
166	T	A	-1.9906
167	K	A	-2.2121
168	P	A	-2.1283
169	R	A	-2.9444
170	E	A	-2.6561
171	E	A	-2.6586
172	Q	A	0.0000
173	Y	A	0.1435
174	N	A	-0.3823
175	S	A	-0.7402
176	T	A	-1.4025
177	Y	A	0.0000
178	R	A	0.0000
179	V	A	0.0000
180	V	A	0.0000
181	S	A	0.0000
182	V	A	0.0000
183	L	A	0.0000
184	T	A	-0.4583
185	V	A	0.0000
186	L	A	0.5894
187	H	A	-0.0734
188	Q	A	-1.2433
189	D	A	-1.4970
190	W	A	0.0000
191	L	A	-1.1167
192	N	A	-2.0750
193	G	A	-2.0355
194	K	A	-2.2529
195	E	A	-2.3349
196	Y	A	0.0000
197	K	A	-1.6263
198	C	A	0.0000
199	K	A	-1.5047
200	V	A	0.0000
201	S	A	-1.4952
202	N	A	0.0000
203	K	A	-2.5992
204	A	A	-1.4937
205	L	A	-0.6755
206	G	A	-0.6798
207	A	A	-0.4162
208	P	A	-0.9002
209	I	A	-0.6277
210	E	A	-1.8230
211	K	A	-1.0626
212	T	A	-0.9805
213	I	A	0.0000
214	S	A	0.0000
215	K	A	0.0000
216	A	A	0.0000
217	K	A	-1.9640
218	G	A	-1.8771
219	Q	A	-2.1520
220	P	A	-1.9205
221	R	A	-2.4336
222	E	A	-2.8026
223	P	A	0.0000
224	Q	A	-1.4026
225	V	A	0.0000
226	Y	A	0.0000
227	T	A	-0.8305
228	L	A	0.0000
229	P	A	-0.3612
230	P	A	0.0000
231	S	A	0.0000
232	R	A	-2.6327
233	D	A	-2.7834
234	E	A	0.0000
235	L	A	-1.7636
236	T	A	-1.5346
237	K	A	-2.1070
238	N	A	-2.3713
239	Q	A	-2.1140
240	V	A	0.0000
241	S	A	0.0000
242	L	A	0.0000
243	T	A	0.0000
244	C	A	0.0000
245	L	A	0.0000
246	V	A	0.0000
247	K	A	-0.7817
248	G	A	-1.3238
249	F	A	0.0000
250	Y	A	0.0000
251	P	A	0.0000
252	S	A	-0.4787
253	D	A	-0.8904
254	I	A	-0.4296
255	A	A	-0.3509
256	V	A	0.0000
257	E	A	-1.0071
258	W	A	0.0000
259	E	A	-1.9524
260	S	A	0.0000
261	N	A	-1.9232
262	G	A	-1.9117
263	Q	A	-2.3172
264	P	A	-1.9308
265	E	A	0.0000
266	N	A	-2.0062
267	N	A	-1.4315
268	Y	A	0.0000
269	K	A	0.0000
270	T	A	-0.2068
271	T	A	0.0000
272	P	A	0.0156
273	P	A	-0.1344
274	V	A	0.0000
275	L	A	-0.3428
276	D	A	-1.0735
277	S	A	-1.7436
278	D	A	-2.0942
279	G	A	-1.0891
280	S	A	0.0000
281	F	A	-0.5016
282	F	A	0.0000
283	L	A	0.0000
284	Y	A	0.0000
285	S	A	0.0000
286	K	A	0.0000
287	L	A	0.0000
288	T	A	-0.8034
289	V	A	0.0000
290	D	A	-2.2267
291	K	A	-2.3845
292	S	A	-2.0937
293	R	A	-1.9447
294	W	A	0.0000
295	Q	A	-2.3592
296	Q	A	-2.1576
297	G	A	-1.3093
298	N	A	-0.8955
299	V	A	0.0677
300	F	A	0.0000
301	S	A	-1.0312
302	C	A	0.0000
303	S	A	0.0000
304	V	A	0.0000
305	M	A	0.0000
306	H	A	0.0000
307	E	A	-1.1102
308	A	A	-1.6150
309	L	A	-1.4550
310	H	A	-1.7459
311	N	A	-1.4336
312	H	A	-0.8989
313	Y	A	-0.5212
314	T	A	-0.9627
315	Q	A	-1.6123
316	K	A	-1.3617
317	S	A	-0.7246
318	L	A	0.0000
319	S	A	-0.2788
320	L	A	-0.5267
321	S	A	-0.7868
322	P	A	-1.1501
323	G	A	-1.4470
324	K	A	-2.0304
1	N	B	-1.1987
2	A	B	-0.6773
3	S	B	-0.5473
4	C	B	0.1000
5	E	B	-0.8219
6	Y	B	0.6691
7	S	B	0.2509
8	A	B	0.1344
9	S	B	-0.0432
10	H	B	0.0000
11	K	B	-1.0542
12	Q	B	-1.2526
13	D	B	-1.4300
14	L	B	0.0000
15	L	B	0.5409
16	L	B	0.5411
17	G	B	-0.1599
18	S	B	-0.1103
19	T	B	-0.2206
20	G	B	0.0989
21	S	B	0.1963
22	I	B	0.0000
23	S	B	-0.1267
24	C	B	0.0000
25	P	B	0.0000
26	S	B	-0.1088
27	L	B	0.0000
28	S	B	-0.0677
29	C	B	0.2491
30	Q	B	-0.8346
31	S	B	-1.3138
32	D	B	-2.1245
33	A	B	-1.2854
34	Q	B	-1.7086
35	S	B	-1.5466
36	P	B	-1.0721
37	A	B	-1.0202
38	V	B	0.0000
39	T	B	-0.3073
40	W	B	0.0000
41	Y	B	0.0000
42	K	B	-0.7238
43	N	B	-1.0862
44	G	B	-0.5599
45	K	B	-0.5867
46	L	B	0.4904
47	L	B	0.2181
48	S	B	0.0023
49	V	B	0.1906
50	E	B	-0.7460
51	R	B	-1.8883
52	S	B	-1.3494
53	N	B	0.0000
54	R	B	-0.7819
55	I	B	0.0000
56	V	B	1.3037
57	V	B	0.0000
58	D	B	-0.3322
59	E	B	0.0000
60	V	B	0.0000
61	Y	B	-0.1990
62	D	B	-0.6231
63	Y	B	-0.9195
64	H	B	-1.0689
65	Q	B	-1.7041
66	G	B	-1.1936
67	T	B	0.0000
68	Y	B	0.0000
69	V	B	0.0000
70	C	B	0.0000
71	D	B	0.0000
72	Y	B	0.0000
73	T	B	-0.2852
74	Q	B	-1.0550
75	S	B	-1.0381
76	D	B	-1.3465
77	T	B	-0.0970
78	V	B	1.0834
79	S	B	0.0301
80	S	B	-0.4171
81	W	B	-0.1297
82	T	B	0.0135
83	V	B	0.1291
84	R	B	0.0000
85	A	B	0.0000
86	V	B	0.0000
87	V	B	0.0000
88	Q	B	-1.0722
89	V	B	0.0000
90	R	B	-1.8173
91	T	B	-0.4389
92	I	B	0.6724
93	V	B	1.2524
94	G	B	-0.0934
95	D	B	-2.2983
96	T	B	-2.3841
97	K	B	-3.6855
98	D	B	-3.9600
99	K	B	-3.5719
100	T	B	-2.0471
101	H	B	-1.5877
102	T	B	-0.8793
103	C	B	0.3122
104	P	B	-0.0159
105	P	B	0.1080
106	C	B	0.5197
107	P	B	-0.3710
108	A	B	-0.5438
109	P	B	-1.0411
110	E	B	-2.0243
111	A	B	-1.0577
112	A	B	-0.7800
113	G	B	-0.9672
114	G	B	-0.7165
115	P	B	0.0000
116	S	B	-0.2025
117	V	B	0.0000
118	F	B	-0.2684
119	L	B	0.0000
120	F	B	0.0000
121	P	B	-0.2328
122	P	B	0.0000
123	K	B	-1.0433
124	P	B	-0.8959
125	K	B	-0.8941
126	D	B	-0.7175
127	T	B	0.0000
128	L	B	0.0000
129	M	B	0.3135
130	I	B	1.3572
131	S	B	0.2630
132	R	B	-0.7360
133	T	B	-0.3357
134	P	B	0.0000
135	E	B	-0.5541
136	V	B	0.0000
137	T	B	0.0000
138	C	B	0.0000
139	V	B	0.0000
140	V	B	0.0000
141	V	B	0.0000
142	D	B	-0.7778
143	V	B	0.0000
144	S	B	-1.7006
145	H	B	-2.1229
146	E	B	-2.7811
147	D	B	-2.4834
148	P	B	-2.3935
149	E	B	-3.0329
150	V	B	-1.9369
151	K	B	-2.2565
152	F	B	-1.1702
153	N	B	-1.0959
154	W	B	0.0000
155	Y	B	-0.3865
156	V	B	-0.5225
157	D	B	-1.4089
158	G	B	-0.5246
159	V	B	0.8218
160	E	B	-0.5296
161	V	B	-0.5254
162	H	B	-1.8816
163	N	B	-2.1869
164	A	B	-1.8020
165	K	B	-2.3397
166	T	B	-1.7109
167	K	B	-1.7089
168	P	B	-1.8825
169	R	B	-2.7501
170	E	B	-2.8670
171	E	B	-2.7046
172	Q	B	0.0000
173	Y	B	-0.0253
174	N	B	-0.4085
175	S	B	-0.6388
176	T	B	-1.2208
177	Y	B	-1.6882
178	R	B	0.0000
179	V	B	0.0000
180	V	B	0.0000
181	S	B	0.0000
182	V	B	0.0000
183	L	B	0.0000
184	T	B	-0.5106
185	V	B	0.0000
186	L	B	0.5272
187	H	B	-0.1762
188	Q	B	-1.2560
189	D	B	-1.4301
190	W	B	0.0000
191	L	B	-1.1202
192	N	B	-2.0437
193	G	B	-1.9268
194	K	B	-2.0036
195	E	B	-1.9132
196	Y	B	0.0000
197	K	B	-1.2978
198	C	B	0.0000
199	K	B	-1.2309
200	V	B	0.0000
201	S	B	-1.4487
202	N	B	0.0000
203	K	B	-2.6163
204	A	B	-1.5099
205	L	B	-0.7081
206	G	B	-0.6623
207	A	B	-0.3787
208	P	B	-0.8174
209	I	B	-0.4106
210	E	B	-1.4005
211	K	B	-1.0350
212	T	B	-0.7998
213	I	B	0.0000
214	S	B	0.0000
215	K	B	0.0000
216	A	B	-1.1031
217	K	B	-1.9874
218	G	B	-1.8862
219	Q	B	-2.1634
220	P	B	-1.9554
221	R	B	-2.4721
222	E	B	-2.8231
223	P	B	0.0000
224	Q	B	-1.2888
225	V	B	0.0000
226	Y	B	0.0000
227	T	B	-0.8475
228	L	B	0.0000
229	P	B	-0.3868
230	P	B	-0.8407
231	S	B	0.0000
232	R	B	-2.6465
233	D	B	-2.7890
234	E	B	0.0000
235	L	B	-1.7408
236	T	B	-1.4942
237	K	B	-2.0155
238	N	B	-2.3215
239	Q	B	-2.0839
240	V	B	0.0000
241	S	B	0.0000
242	L	B	0.0000
243	T	B	0.0000
244	C	B	0.0000
245	L	B	0.0000
246	V	B	0.0000
247	K	B	-0.7886
248	G	B	-1.3377
249	F	B	0.0000
250	Y	B	0.0000
251	P	B	0.0000
252	S	B	-0.6897
253	D	B	-1.2129
254	I	B	-0.6026
255	A	B	-0.4826
256	V	B	0.0000
257	E	B	-1.1565
258	W	B	0.0000
259	E	B	-1.8800
260	S	B	0.0000
261	N	B	-1.9027
262	G	B	-1.8854
263	Q	B	-2.2927
264	P	B	-1.9236
265	E	B	0.0000
266	N	B	-2.0763
267	N	B	-1.5150
268	Y	B	0.0000
269	K	B	-1.0291
270	T	B	-0.3131
271	T	B	0.0000
272	P	B	-0.1043
273	P	B	-0.2603
274	V	B	0.0000
275	L	B	-0.3203
276	D	B	-1.0153
277	S	B	-1.6410
278	D	B	-2.0769
279	G	B	-1.0884
280	S	B	0.0000
281	F	B	0.0000
282	F	B	0.0000
283	L	B	0.0000
284	Y	B	0.0000
285	S	B	0.0000
286	K	B	0.0000
287	L	B	0.0000
288	T	B	-0.8542
289	V	B	0.0000
290	D	B	-2.1923
291	K	B	-2.3648
292	S	B	-2.1016
293	R	B	-1.9561
294	W	B	0.0000
295	Q	B	-2.3219
296	Q	B	-2.1421
297	G	B	-1.2575
298	N	B	-0.8823
299	V	B	0.1070
300	F	B	0.0000
301	S	B	0.0000
302	C	B	0.0000
303	S	B	0.0000
304	V	B	0.0000
305	M	B	0.0000
306	H	B	0.0000
307	E	B	-1.2466
308	A	B	-1.7080
309	L	B	0.0000
310	H	B	-1.8434
311	N	B	-1.5068
312	H	B	-1.0218
313	Y	B	-0.6146
314	T	B	-0.9674
315	Q	B	-1.5320
316	K	B	-1.3875
317	S	B	-0.7191
318	L	B	0.0000
319	S	B	-0.1953
320	L	B	-0.3473
321	S	B	-0.7048
322	P	B	-1.0984
323	G	B	-1.4203
324	K	B	-2.0326