Project name: SH3_N136P

Chain sequence(s)	A: TLFVALYDYEARTEDDLSFHKGEEKFQQILNSSEGDWWEARRSLTTGETGYIPSNYVAPV
Distance of aggregation	10 Å
Dynamic mode	No
Mutated residues	NA136P
Energy difference between WT (input) and mutated protein (by FoldX)	0.114276 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: -0.9031
• Total score value: -51.4748

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	0.9358
88	V	A	0.4467
89	A	A	0.0000
90	L	A	0.0249
91	Y	A	-0.4471
92	D	A	-2.5448
93	Y	A	-1.9144
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	-2.3925
106	G	A	-1.4581
107	E	A	-1.3078
108	K	A	-0.6426
109	F	A	0.0000
110	Q	A	-0.5090
111	I	A	-0.0563
112	L	A	0.1431
113	N	A	-0.8877
114	S	A	-1.1783
115	S	A	-1.5952
116	E	A	-2.5582
117	G	A	-2.1299
118	D	A	-2.2577
119	W	A	-0.9410
120	W	A	-0.9458
121	E	A	-1.1528
122	A	A	0.0000
123	R	A	-1.7154
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	-1.4996
132	Y	A	-0.8681
133	I	A	0.0000
134	P	A	0.0000
135	S	A	-0.3953
136	P	A	-0.0830	mutated: NA136P
137	Y	A	0.4692
138	V	A	0.0000
139	A	A	0.6254
140	P	A	0.7757
141	V	A	1.7964