Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKVMQLLPEL-NSGGVERGTLEIARALVAQGHQSLVVSNGGRLV--SQLEAEGSTHLTLPIHKKSLSSLWQIRPLRQLIEEHQPDIVHVRSRVPAWLTHFALRKIPANKHPHLISTVHGFYSVN---------RYSAI--MTQAEKVIAVSDSVVKYITDHYKNCPPQDIVRIYRGIDPAAFPHNYQPSAQWFNQVFNDFPELENKFLLCLPGRITRLKGHESLIELMQKLGEQ-YPQLHAVVVGGADVKKQTYLSELQNTIQSKGLADKITFVGHRSDIREWLAFSDIVLSLSNQAETFGRTALEALSVGTPVIGWNRGGVAEILSHVYPQGLV-EAENEKALVERVKHHIEQPQTVA--------PVTMFSLKDMCDQTLELYQSVLK 2IW1 Chain:A ((2-371)) -IVAFCLYKYFPFGGLQRDFMRIASTVAARGHHVRVYTQSWEGDCPKAFELIQVPVKSHTN---HGRNAEYYAWVQNHLKEHPADRVVGFNKMPGLDVYFAADV----CYAEKVAQEKGFLYRLTSRYRHYAAFERATFEQGKSTKLMMLTDKQIADFQKHYQ-TEPERFQILPPGIYPDRKYSEQIPN--SREIYRQKNGIKEQQNLLLQVGSDFGRKGVDRSIEALASLPESLRHNTLLFVVGQDKP------RKFEALAEKLGVRSNVHFFSGRNDVSELMAAADLLLHPAY-QEAAGIVLLEAITAGLPVLTTAVCGYAHYIADANCGTVIAEPFSQEQLNEVLRKALTQSPLRMAWAENARHYADTQDLYSLPEKAADIITGG--

General information: TITO was launched using: RESULT: Template: 2IW1.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain A - contact count / total energy / energy per contact / energy per residue : 1803 -23803 -13.20 -68.79 target 2D structure prediction score : 0.62 Monomeric hydrophicity matching model chain A : 0.67 3D Compatibility (PKB) : -13.20 2D Compatibility (Sec. Struct. Predict.) : 0.62 1D Compatibility (Hydrophobicity) : 0.67 QMean score : 0.369

(partial model without unconserved sides chains): PDB file : Tito_2IW1.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2IW1-query.scw PDB file : Tito_Scwrl_2IW1.pdb: