Project name: orf_duf

Chain sequence(s)	A: QPQPQQTQRKMLLDVTTGQYYLVDTPVQPMTRRLFDPETGQYVDVPMTSQQQPVAPM
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]                                                (00:00:01)
[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 A 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                                          (00:00:34)
[INFO]       Main:     Simulation completed successfully.                                          (00:00:34)

• Minimal score value: -3.1183
• Maximal score value: 2.3262
• Average score: -0.5719
• Total score value: -32.5972

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
1596	Q	A	-1.6608
1597	P	A	-1.6518
1598	Q	A	-2.2344
1599	P	A	-1.9452
1600	Q	A	-2.4366
1601	Q	A	-2.6520
1602	T	A	-2.5022
1603	Q	A	-3.1183
1604	R	A	-3.0639
1605	K	A	-1.8631
1606	M	A	1.2328
1607	L	A	1.7872
1608	L	A	2.1662
1609	D	A	0.9340
1610	V	A	1.6398
1611	T	A	0.4510
1612	T	A	0.0391
1613	G	A	0.0173
1614	Q	A	-0.0586
1615	Y	A	2.1528
1616	Y	A	2.3262
1617	L	A	2.0069
1618	V	A	0.0356
1619	D	A	-2.1431
1620	T	A	-2.0680
1621	P	A	-1.6343
1622	V	A	-0.7686
1623	Q	A	-1.0097
1624	P	A	-0.2071
1625	M	A	0.2696
1626	T	A	-1.0331
1627	R	A	-1.8392
1628	R	A	-2.0725
1629	L	A	0.2023
1630	F	A	1.1459
1631	D	A	-0.2964
1632	P	A	-1.0618
1633	E	A	-2.1899
1634	T	A	-1.2065
1635	G	A	-1.0103
1636	Q	A	-0.8581
1637	Y	A	0.7271
1638	V	A	0.2419
1639	D	A	-1.6287
1640	V	A	-0.5879
1641	P	A	-0.5592
1642	M	A	-0.2125
1643	T	A	-0.4569
1644	S	A	-1.1235
1645	Q	A	-2.2501
1646	Q	A	-2.2639
1647	Q	A	-1.7704
1648	P	A	-0.4810
1649	V	A	1.2394
1650	A	A	0.8541
1651	P	A	0.6861
1652	M	A	1.1671