Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MAEVLHHDNHGHDGHHEHDDTDLTVFGFWTYLMSDLILFGSLFIAF------------AVLSSHVPPGTPSAYDLFHESLGYVLTETFALLISSVTF-----GFAVLASYKKNVNQVITWLFITFLFGATFIGMELYEFHHLVEEGHGPTHSAFLSSFFTLVGTHGIHVTSGLVWMLVLMYQIKTKGLTLPNTRRLACLSLFWHFLDIVWICVFSVVYLLGVL 1QLE Chain:C ((71-272)) --------NEGETGEHTPVVRIGLQYGFILFIMSEVMFFVAWFWAFIKNALYPMGPDSPIKDGVWPPEGIVTFDPWHLPL----INTLILLLSGVAVTWAHHAFVLEGDRKTTINGLI----VAVILGVCFTGLQAYEYSH---AAFGLADTVYAGAFYMATGFHGAHVIIGTIFLFVCLIRLLKGQMTQKQHVGFEAAAWYWHFVDVVWLFLFVVIYIWG--

General information: TITO was launched using: RESULT: Template: 1QLE.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain C - contact count / total energy / energy per contact / energy per residue : 584 -97492 -166.94 -526.98 target 2D structure prediction score : 0.72 Monomeric hydrophicity matching model chain C : 0.73 3D Compatibility (PKB) : -166.94 2D Compatibility (Sec. Struct. Predict.) : 0.72 1D Compatibility (Hydrophobicity) : 0.73 QMean score : 0.299

(partial model without unconserved sides chains): PDB file : Tito_1QLE.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1QLE-query.scw PDB file : Tito_Scwrl_1QLE.pdb: