Project name: SH3_W119L

Chain sequence(s)	A: TLFVALYDYEARTEDDLSFHKGEEKFQQILNSSEGDWWEARRSLTTGETGYIPSNYVAPV
Distance of aggregation	10 Å
Dynamic mode	No
Mutated residues	WA119L
Energy difference between WT (input) and mutated protein (by FoldX)	0.727955 kcal/mol Changes in protein stability upon mutation are calculated using the FoldX forcefield. Computational prediction of protein stability is used with the intention of preventing the experimental characterization of proteins bearing mutations that significantly destabilize their structure. Mutations resulting in a predicted reduction in protein stability ≥ 1 kcal/mol are considered disruptive.

• Minimal score value: -3.1044
• Maximal score value: 1.7964
• Average score: -0.9664
• Total score value: -55.0862

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
85	T	A	0.5173
86	L	A	0.7932
87	F	A	0.9231
88	V	A	0.4313
89	A	A	0.0000
90	L	A	-0.1481
91	Y	A	-0.5684
92	D	A	-2.5477
93	Y	A	-1.9104
94	E	A	-2.6331
95	A	A	-2.6241
96	R	A	-2.9823
97	T	A	-2.6608
98	E	A	-3.1044
99	D	A	-3.0467
100	D	A	0.0000
101	L	A	0.0000
102	S	A	-2.1998
103	F	A	0.0000
104	H	A	-2.7220
105	K	A	-2.4016
106	G	A	-1.4581
107	E	A	-1.3078
108	K	A	-0.6426
109	F	A	0.0000
110	Q	A	-0.5085
111	I	A	-0.0576
112	L	A	0.1427
113	N	A	-0.8820
114	S	A	-1.1746
115	S	A	-1.6029
116	E	A	-2.5710
117	G	A	-2.1716
118	D	A	-2.4348
119	L	A	-1.0336	mutated: WA119L
120	W	A	-1.0256
121	E	A	-1.1424
122	A	A	0.0000
123	R	A	-1.7166
124	S	A	0.0000
125	L	A	0.0592
126	T	A	-0.4730
127	T	A	-0.8207
128	G	A	-1.3572
129	E	A	-2.2402
130	T	A	-1.6953
131	G	A	-1.4922
132	Y	A	-0.8541
133	I	A	0.0000
134	P	A	-0.5474
135	S	A	-0.9153
136	N	A	-1.1460
137	Y	A	-0.1195
138	V	A	0.0000
139	A	A	0.4149
140	P	A	0.7757
141	V	A	1.7964