Project name: RP5-RSP-NL

Chain sequence(s)	A: MVPQALLFVPLLVFPLCFGKFPIDWLLLARGEPLIPKHNQSLPACSFYIEDRLHCVFQMNLVLFIDPLTRWGNPKVNSILNLFGSGLFDAAFVHCKLHICFRVADSSFLCHKAFFCGRSDYFRLLNRYLIISLTNTVPGPDVVKKCSQHTDLAIEYEVGVARALPQGSQGRCAQKCKLCARENSIEILSSTIKAYNAENNGGMSAEEEIGPGAEPMRGPSLATQLYPYDVPDYA
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                                          (00:02:31)
[INFO]       Main:     Simulation completed successfully.                                          (00:02:33)

• Minimal score value: -3.9656
• Maximal score value: 4.6429
• Average score: -0.0893
• Total score value: -20.9014

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	M	A	1.6911
2	V	A	2.0722
3	P	A	0.8363
4	Q	A	0.4553
5	A	A	1.6417
6	L	A	3.1297
7	L	A	3.6094
8	F	A	4.5250
9	V	A	4.6429
10	P	A	3.4467
11	L	A	4.0290
12	L	A	3.8509
13	V	A	4.0527
14	F	A	3.9141
15	P	A	2.3060
16	L	A	2.7768
17	C	A	2.3062
18	F	A	1.7998
19	G	A	0.1954
20	K	A	-0.4906
21	F	A	1.0694
22	P	A	0.6236
23	I	A	1.7315
24	D	A	0.2790
25	W	A	1.0339
26	L	A	0.8825
27	L	A	0.3472
28	L	A	0.9388
29	A	A	-0.4362
30	R	A	-1.8230
31	G	A	-1.4711
32	E	A	-1.6094
33	P	A	-0.1105
34	L	A	1.0461
35	I	A	1.4309
36	P	A	-0.5048
37	K	A	-2.3633
38	H	A	-2.5641
39	N	A	-2.7399
40	Q	A	-2.2492
41	S	A	-0.7693
42	L	A	1.1690
43	P	A	0.6552
44	A	A	0.8476
45	C	A	0.8772
46	S	A	-0.0745
47	F	A	0.0031
48	Y	A	0.0954
49	I	A	0.0000
50	E	A	-1.1046
51	D	A	-1.9071
52	R	A	-2.0758
53	L	A	-0.1055
54	H	A	-0.6534
55	C	A	0.2790
56	V	A	1.3176
57	F	A	0.8117
58	Q	A	-0.4293
59	M	A	-0.0772
60	N	A	-0.4823
61	L	A	1.2027
62	V	A	3.0654
63	L	A	3.1892
64	F	A	3.3688
65	I	A	2.8356
66	D	A	0.5463
67	P	A	0.2855
68	L	A	0.7509
69	T	A	-0.5369
70	R	A	-1.1447
71	W	A	-0.0644
72	G	A	-1.1737
73	N	A	-1.8128
74	P	A	-1.3868
75	K	A	-1.5869
76	V	A	0.2736
77	N	A	-0.7318
78	S	A	0.2009
79	I	A	0.8617
80	L	A	0.8055
81	N	A	-0.4992
82	L	A	0.0000
83	F	A	0.8886
84	G	A	0.2353
85	S	A	0.0817
86	G	A	0.6651
87	L	A	1.7614
88	F	A	1.7523
89	D	A	-0.0023
90	A	A	1.0501
91	A	A	1.4416
92	F	A	2.4164
93	V	A	2.0324
94	H	A	0.2807
95	C	A	-0.0133
96	K	A	-1.4629
97	L	A	-0.8327
98	H	A	-1.7084
99	I	A	0.0000
100	C	A	-0.3180
101	F	A	0.0000
102	R	A	-0.4931
103	V	A	-0.0659
104	A	A	-0.6905
105	D	A	-1.8583
106	S	A	-0.8977
107	S	A	-0.1763
108	F	A	1.2084
109	L	A	1.0649
110	C	A	0.5224
111	H	A	-0.3476
112	K	A	-0.8555
113	A	A	-0.4787
114	F	A	0.0685
115	F	A	0.0000
116	C	A	-1.3837
117	G	A	-1.4922
118	R	A	-2.4072
119	S	A	-1.8517
120	D	A	-2.3842
121	Y	A	-0.9478
122	F	A	0.0000
123	R	A	-2.5311
124	L	A	-0.7269
125	L	A	-0.0523
126	N	A	-0.6176
127	R	A	-0.7901
128	Y	A	1.2015
129	L	A	1.1369
130	I	A	1.1292
131	I	A	1.4263
132	S	A	0.8586
133	L	A	1.2897
134	T	A	0.3688
135	N	A	-0.3578
136	T	A	0.3122
137	V	A	0.8085
138	P	A	-0.2321
139	G	A	-0.3118
140	P	A	-0.4748
141	D	A	-0.5395
142	V	A	1.0877
143	V	A	1.2982
144	K	A	-0.4975
145	K	A	-1.7614
146	C	A	-1.5366
147	S	A	-1.4848
148	Q	A	-2.1537
149	H	A	-1.5170
150	T	A	-1.3316
151	D	A	-1.4525
152	L	A	0.2229
153	A	A	0.0070
154	I	A	0.2207
155	E	A	-1.1267
156	Y	A	-0.2207
157	E	A	-0.9185
158	V	A	0.8108
159	G	A	0.3623
160	V	A	1.2778
161	A	A	0.3411
162	R	A	-0.9725
163	A	A	-0.0711
164	L	A	0.3864
165	P	A	-0.5842
166	Q	A	-1.3563
167	G	A	-1.0943
168	S	A	-0.8651
169	Q	A	-1.5092
170	G	A	-1.0175
171	R	A	-2.0789
172	C	A	-0.9606
173	A	A	-1.9059
174	Q	A	-2.8347
175	K	A	-3.7337
176	C	A	-2.3317
177	K	A	-1.9633
178	L	A	0.1591
179	C	A	-0.9306
180	A	A	-2.0108
181	R	A	-3.5796
182	E	A	-3.9656
183	N	A	-2.3809
184	S	A	-1.6875
185	I	A	-0.6594
186	E	A	-1.1136
187	I	A	0.6473
188	L	A	1.0349
189	S	A	0.3801
190	S	A	0.1974
191	T	A	0.8424
192	I	A	1.6183
193	K	A	-0.5665
194	A	A	0.0878
195	Y	A	0.2194
196	N	A	-1.6695
197	A	A	-1.7606
198	E	A	-3.1165
199	N	A	-3.0031
200	N	A	-2.7863
201	G	A	-1.8305
202	G	A	-1.0295
203	M	A	0.1921
204	S	A	-0.5644
205	A	A	-1.3129
206	E	A	-2.8388
207	E	A	-3.1618
208	E	A	-2.3690
209	I	A	0.0669
210	G	A	-0.4618
211	P	A	-0.6142
212	G	A	-0.8326
213	A	A	-0.7247
214	E	A	-2.0152
215	P	A	-1.2024
216	M	A	-0.5181
217	R	A	-1.8504
218	G	A	-0.8804
219	P	A	-0.6333
220	S	A	-0.1574
221	L	A	1.3031
222	A	A	0.9837
223	T	A	0.6481
224	Q	A	0.2234
225	L	A	1.9827
226	Y	A	1.9089
227	P	A	0.9153
228	Y	A	1.3006
229	D	A	-0.4500
230	V	A	0.9339
231	P	A	-0.2344
232	D	A	-1.0255
233	Y	A	0.6400
234	A	A	0.1889