Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MAEFSIIDQYFNRQSHPDVALGIGDDSALITPPPNQQLVICADTLVAGRHFPLETLSHAIGWKSVAVNLSDIAAMGAKPHSILLAISLPQVDHEWLEGFSQGIYDCCNQFGVALIGGDTTQGPHLTITVTAMGWIETGKAVLRSGAKVGDYVCVSGQIGDAAYG--------------LQHLGHSLQQRLDYPTPRCKLGEELKGLASSMIDVSDGLAQDLGHILKASKVGARLILEKLPVDPVLQQLEEQQRWQYA-LAGGDDYELCFTITPQNYEKL--LQKQLDVKITMIGQIVEQTKLTFEHLGSDYPLQIHGYQHFA 3MCQ Chain:A ((8-309)) -----LIQRYF-RRAHPSAVLGVGDDAALIQPSPGMELAVSADMLVANTHFYPNIDPWLIGWKSLAVNISDMAAMGAQPRWATLTIALPEADEDWISKFAAGFFACAAQFDIALIGGDTTRGP-LTISVQIMGETPPGASLLRSTARADDDIWVSGPLGDAALALAAIQGRYPLSDTELAACGKALHQ----PQPRVVLGQALRGLAHSALDISDGLLADLGHILEHSQVGAEVWLKAIPKSEVVSAHSQEVAIQKMILSGGDDYELCFTASTQHRQQIADIGRQLSLDMAVIGRITDTQQLVIHGL-DDAPLT--------

General information: TITO was launched using: RESULT: Template: 3MCQ.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 : 1526 -107818 -70.65 -378.31 target 2D structure prediction score : 0.53 Monomeric hydrophicity matching model chain A : 0.81 3D Compatibility (PKB) : -70.65 2D Compatibility (Sec. Struct. Predict.) : 0.53 1D Compatibility (Hydrophobicity) : 0.81 QMean score : 0.486

(partial model without unconserved sides chains): PDB file : Tito_3MCQ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3MCQ-query.scw PDB file : Tito_Scwrl_3MCQ.pdb: