Project name: 8942c5ce756448d

Chain sequence(s)	A: PRDYNPISSTICHLTNESDGHTTSLYGIGFGPFIITNKHLFRRNNGTLLVQSLHGVFKVKNTTTLQQHLIDGRDMIIIRMPKDFPPFPQKLKFREPQREERICLVTTNFQTKSMSSMVSDTSCTFPSSDGIFWKHWIQTKDGQAGSPLVSTRDGFIVGIHSASNFTNTNNYFTSVPKNFMELLTNQEAQQWVSGWRLNADSVLWGGHKVFMSKP
Selected Chain(s)	A
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 A 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                                          (00:02:40)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:41)

• Minimal score value: -3.2015
• Maximal score value: 1.2779
• Average score: -0.7879
• Total score value: -168.6197

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
8	P	A	-1.3108
9	R	A	-2.6165
10	D	A	-2.7352
11	Y	A	-1.5063
12	N	A	-1.7773
13	P	A	-1.3618
14	I	A	0.0000
15	S	A	0.0000
16	S	A	-0.4444
17	T	A	0.0000
18	I	A	0.0000
19	C	A	0.0000
20	H	A	-0.1586
21	L	A	0.0000
22	T	A	-0.5873
23	N	A	0.0000
24	E	A	-2.4528
25	S	A	0.0000
26	D	A	-2.6523
27	G	A	-2.0396
28	H	A	-2.2745
29	T	A	-1.7320
30	T	A	0.0000
31	S	A	-0.6363
32	L	A	0.0000
33	Y	A	0.0000
34	G	A	0.0000
35	I	A	0.0000
36	G	A	0.0000
37	F	A	0.0000
38	G	A	0.0000
39	P	A	-1.0383
40	F	A	0.0000
41	I	A	0.0000
42	I	A	0.0000
43	T	A	0.0000
44	N	A	0.0000
45	K	A	0.0000
46	H	A	-0.6620
47	L	A	0.0000
48	F	A	0.0000
49	R	A	-1.8811
50	R	A	-2.9435
51	N	A	0.0000
52	N	A	-2.6263
53	G	A	-2.3441
54	T	A	-1.9605
55	L	A	0.0000
56	L	A	-0.4160
57	V	A	0.0000
58	Q	A	0.2593
59	S	A	0.0000
60	L	A	0.7453
61	H	A	-0.3280
62	G	A	0.4031
63	V	A	1.2779
64	F	A	-0.1981
65	K	A	-1.5368
66	V	A	0.0000
67	K	A	-2.5020
68	N	A	-1.9503
69	T	A	0.0000
70	T	A	-1.2176
71	T	A	-0.7969
72	L	A	0.0000
73	Q	A	-0.9389
74	Q	A	0.0000
75	H	A	0.0000
76	L	A	-0.3407
77	I	A	0.0000
78	D	A	-1.9522
79	G	A	-1.1782
80	R	A	-0.8998
81	D	A	0.0000
82	M	A	0.0000
83	I	A	0.0000
84	I	A	0.0000
85	I	A	0.0000
86	R	A	-1.1086
87	M	A	0.0000
88	P	A	-1.9422
89	K	A	-2.7590
90	D	A	-2.6829
91	F	A	0.0000
92	P	A	-1.1949
93	P	A	-1.1301
94	F	A	0.0000
95	P	A	-1.3530
96	Q	A	-2.3617
97	K	A	-2.6721
98	L	A	0.0000
99	K	A	-1.7902
100	F	A	0.0000
101	R	A	-1.2177
102	E	A	-1.5403
103	P	A	0.0000
104	Q	A	-2.0661
105	R	A	-2.8016
106	E	A	-2.6922
107	E	A	0.0000
108	R	A	-2.1233
109	I	A	0.0000
110	C	A	0.0000
111	L	A	0.0000
112	V	A	0.0000
113	T	A	0.0000
114	T	A	0.0000
115	N	A	-0.9571
116	F	A	-0.8609
117	Q	A	-1.7488
118	T	A	-1.3888
119	K	A	-2.0449
120	S	A	-1.3161
121	M	A	-0.4388
122	S	A	-0.2837
123	S	A	0.0447
124	M	A	0.5763
125	V	A	0.1231
126	S	A	-0.6013
127	D	A	-1.8582
128	T	A	-0.9664
129	S	A	-0.3943
130	C	A	0.0303
131	T	A	0.0000
132	F	A	0.6194
133	P	A	-0.1126
134	S	A	0.0000
135	S	A	-1.0708
136	D	A	-1.9514
137	G	A	-0.8438
138	I	A	-0.8777
139	F	A	0.0000
140	W	A	0.0000
141	K	A	0.3160
142	H	A	0.0000
143	W	A	0.0942
144	I	A	0.0000
145	Q	A	-1.8523
146	T	A	-2.0606
147	K	A	-3.1683
148	D	A	-3.2015
149	G	A	-1.8192
150	Q	A	-1.7144
151	A	A	-0.8531
152	G	A	0.0000
153	S	A	0.0000
154	P	A	0.0000
155	L	A	0.0000
156	V	A	0.0000
157	S	A	0.0000
158	T	A	-1.7801
159	R	A	-2.4274
160	D	A	-1.5850
161	G	A	-1.2727
162	F	A	-0.5936
163	I	A	0.0000
164	V	A	0.0000
165	G	A	0.0000
166	I	A	0.0000
167	H	A	0.0000
168	S	A	-0.2572
169	A	A	-0.6088
170	S	A	-0.8415
171	N	A	-0.1682
172	F	A	0.8218
173	T	A	-0.1620
174	N	A	-1.4878
175	T	A	-0.6799
176	N	A	-0.6364
177	N	A	0.0000
178	Y	A	0.1288
179	F	A	0.0000
180	T	A	0.0000
181	S	A	0.0000
182	V	A	0.0000
183	P	A	-1.5301
184	K	A	-2.6691
185	N	A	-2.6606
186	F	A	0.0000
187	M	A	-1.5422
188	E	A	-2.7394
189	L	A	-1.9878
190	L	A	0.0000
191	T	A	-1.4609
192	N	A	-2.1404
193	Q	A	-2.7100
194	E	A	-2.9624
195	A	A	-2.1630
196	Q	A	-1.8043
197	Q	A	-1.4691
198	W	A	-0.4879
199	V	A	0.1576
200	S	A	-0.2006
201	G	A	-0.7718
202	W	A	-0.7150
203	R	A	-1.8208
204	L	A	-1.6166
205	N	A	-2.0370
206	A	A	-1.5767
207	D	A	-1.7806
208	S	A	-0.6171
209	V	A	0.1824
210	L	A	0.9133
211	W	A	-0.1878
212	G	A	-0.7828
213	G	A	-0.9758
214	H	A	-0.6398
215	K	A	-0.9109
216	V	A	-0.3364
217	F	A	-0.0490
218	M	A	-0.5439
219	S	A	-1.0257
220	K	A	-1.4414
221	P	A	-0.6378