Project name: SH3_Q110F

Chain sequence(s)	A: TLFVALYDYEARTEDDLSFHKGEEKFQQILNSSEGDWWEARRSLTTGETGYIPSNYVAPV
Distance of aggregation	10 Å
Dynamic mode	No
Mutated residues	QA110F
Energy difference between WT (input) and mutated protein (by FoldX)	-0.30066 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: -3.1028
• Maximal score value: 1.7839
• Average score: -0.813
• Total score value: -46.3394

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	0.9457
86	L	A	1.5654
87	F	A	1.4474
88	V	A	0.7277
89	A	A	0.0000
90	L	A	-0.1511
91	Y	A	-0.5748
92	D	A	-2.5599
93	Y	A	-1.9315
94	E	A	-2.6452
95	A	A	-2.6259
96	R	A	-2.9852
97	T	A	-2.6608
98	E	A	-3.1028
99	D	A	-3.0435
100	D	A	0.0000
101	L	A	0.0000
102	S	A	-2.2060
103	F	A	0.0000
104	H	A	-2.7282
105	K	A	-2.4059
106	G	A	-1.4581
107	E	A	-1.2929
108	K	A	-0.1488
109	F	A	0.0000
110	F	A	1.6867	mutated: QA110F
111	I	A	0.8299
112	L	A	0.4472
113	N	A	-0.7650
114	S	A	-1.2577
115	S	A	-1.6198
116	E	A	-2.5599
117	G	A	-2.1340
118	D	A	-2.4444
119	W	A	-1.1028
120	W	A	-0.8933
121	E	A	-0.9399
122	A	A	0.0000
123	R	A	-0.9782
124	S	A	0.0000
125	L	A	0.6236
126	T	A	-0.4318
127	T	A	-0.7947
128	G	A	-1.0714
129	E	A	-2.2162
130	T	A	-1.4373
131	G	A	-1.5271
132	Y	A	-0.8995
133	I	A	0.0000
134	P	A	0.0000
135	S	A	-0.9371
136	N	A	-1.1504
137	Y	A	-0.1243
138	V	A	0.0000
139	A	A	0.4098
140	P	A	0.9987
141	V	A	1.7839