Project name: SH3_I111W

Chain sequence(s)	A: TLFVALYDYEARTEDDLSFHKGEEKFQQILNSSEGDWWEARRSLTTGETGYIPSNYVAPV
Distance of aggregation	10 Å
Dynamic mode	No
Mutated residues	IA111W
Energy difference between WT (input) and mutated protein (by FoldX)	4.17129 kcal/mol CAUTION: Your mutation/s can destabilize the protein structure 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: 1.7173
• Average score: -0.9605
• Total score value: -54.7468

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	0.5175
86	L	A	0.7521
87	F	A	0.0000
88	V	A	0.3185
89	A	A	0.0000
90	L	A	-0.1785
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	-3.0434
100	D	A	0.0000
101	L	A	0.0000
102	S	A	-2.2059
103	F	A	0.0000
104	H	A	-2.7282
105	K	A	-2.4059
106	G	A	-1.4857
107	E	A	-1.3614
108	K	A	-0.6968
109	F	A	0.0000
110	Q	A	-0.3514
111	W	A	0.2504	mutated: IA111W
112	L	A	0.4227
113	N	A	-0.7221
114	S	A	-1.0357
115	S	A	-1.5493
116	E	A	-2.5419
117	G	A	-2.1195
118	D	A	-2.4339
119	W	A	-1.0971
120	W	A	-0.9571
121	E	A	-1.0245
122	A	A	0.0000
123	R	A	-1.5970
124	S	A	0.0000
125	L	A	-0.0284
126	T	A	-0.5122
127	T	A	-0.8407
128	G	A	-1.3646
129	E	A	-2.2429
130	T	A	-1.6338
131	G	A	-1.4565
132	Y	A	-0.8218
133	I	A	0.0000
134	P	A	0.0000
135	S	A	-0.9188
136	N	A	-1.1529
137	Y	A	-0.1512
138	V	A	0.0000
139	A	A	0.3365
140	P	A	0.6834
141	V	A	1.7173