Project name: SH3_S135Q

Chain sequence(s)	A: TLFVALYDYEARTEDDLSFHKGEEKFQQILNSSEGDWWEARRSLTTGETGYIPSNYVAPV
Distance of aggregation	10 Å
Dynamic mode	No
Mutated residues	SA135Q
Energy difference between WT (input) and mutated protein (by FoldX)	-0.0612498 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: 1.7964
• Average score: -0.9841
• Total score value: -56.0918

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	0.5180
86	L	A	0.7941
87	F	A	0.8770
88	V	A	0.4316
89	A	A	0.0000
90	L	A	-0.1506
91	Y	A	-0.5743
92	D	A	-2.5596
93	Y	A	-1.9312
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	-2.4057
106	G	A	-1.4581
107	E	A	-1.3078
108	K	A	-0.6422
109	F	A	0.0000
110	Q	A	-0.5119
111	I	A	-0.1044
112	L	A	0.1359
113	N	A	-0.8909
114	S	A	-1.2382
115	S	A	-1.5801
116	E	A	-2.5325
117	G	A	-2.1210
118	D	A	-2.5440
119	W	A	-1.2292
120	W	A	-1.1953
121	E	A	-1.2149
122	A	A	0.0000
123	R	A	-1.7195
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	-2.2401
130	T	A	-1.6922
131	G	A	-1.5067
132	Y	A	-0.9356
133	I	A	0.0000
134	P	A	0.0000
135	Q	A	-1.3091	mutated: SA135Q
136	N	A	-1.3406
137	Y	A	-0.2472
138	V	A	0.0000
139	A	A	0.3515
140	P	A	0.7757
141	V	A	1.7964