Project name: SH3_N136R

Chain sequence(s)	A: TLFVALYDYEARTEDDLSFHKGEEKFQQILNSSEGDWWEARRSLTTGETGYIPSNYVAPV
Distance of aggregation	10 Å
Dynamic mode	No
Mutated residues	NA136R
Energy difference between WT (input) and mutated protein (by FoldX)	-0.490782 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: -0.9984
• Total score value: -56.9091

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	0.9183
88	V	A	0.4239
89	A	A	0.0000
90	L	A	-0.2472
91	Y	A	-0.6443
92	D	A	-2.5671
93	Y	A	-1.9396
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	-2.4123
106	G	A	-1.4581
107	E	A	-1.3078
108	K	A	-0.6426
109	F	A	0.0000
110	Q	A	-0.5091
111	I	A	-0.0568
112	L	A	0.1429
113	N	A	-0.9020
114	S	A	-1.2003
115	S	A	-1.6090
116	E	A	-2.5790
117	G	A	-2.1630
118	D	A	-2.5968
119	W	A	-1.2925
120	W	A	-1.1664
121	E	A	-1.1762
122	A	A	0.0000
123	R	A	-1.7155
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	-1.6927
131	G	A	-1.5109
132	Y	A	-0.8971
133	I	A	0.0000
134	P	A	0.0000
135	S	A	-1.2430
136	R	A	-1.7595	mutated: NA136R
137	Y	A	-0.4592
138	V	A	0.0000
139	A	A	0.3004
140	P	A	0.7757
141	V	A	1.7964