Project name: SH3_L112L

Chain sequence(s)	A: TLFVALYDYEARTEDDLSFHKGEEKFQQILNSSEGDWWEARRSLTTGETGYIPSNYVAPV
Distance of aggregation	10 Å
Dynamic mode	No
Mutated residues	LA112L
Energy difference between WT (input) and mutated protein (by FoldX)	-0.0252405 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: -3.1025
• Maximal score value: 1.7964
• Average score: -0.9592
• Total score value: -54.6716

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	0.7919
87	F	A	0.9238
88	V	A	0.4313
89	A	A	0.0000
90	L	A	-0.1511
91	Y	A	-0.5748
92	D	A	-2.5597
93	Y	A	-1.9312
94	E	A	-2.6448
95	A	A	-2.6253
96	R	A	-2.9850
97	T	A	-2.6607
98	E	A	-3.1025
99	D	A	-3.0429
100	D	A	0.0000
101	L	A	0.0000
102	S	A	-2.2036
103	F	A	0.0000
104	H	A	-2.7280
105	K	A	-2.4059
106	G	A	-1.4581
107	E	A	-1.3078
108	K	A	-0.6445
109	F	A	0.0000
110	Q	A	-0.5092
111	I	A	-0.0525
112	L	A	0.1555	mutated: LA112L
113	N	A	-0.8824
114	S	A	-1.1768
115	S	A	-1.5951
116	E	A	-2.5604
117	G	A	-2.1343
118	D	A	-2.4445
119	W	A	-1.1027
120	W	A	-1.0541
121	E	A	-1.1505
122	A	A	0.0000
123	R	A	-1.7208
124	S	A	0.0000
125	L	A	0.0581
126	T	A	-0.4728
127	T	A	-0.8188
128	G	A	-1.3547
129	E	A	-2.2335
130	T	A	-1.6903
131	G	A	-1.4968
132	Y	A	-0.8662
133	I	A	0.0000
134	P	A	0.0000
135	S	A	-0.9204
136	N	A	-1.1504
137	Y	A	-0.1243
138	V	A	0.0000
139	A	A	0.4158
140	P	A	0.7757
141	V	A	1.7964