Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKIYRLSMSLIANTTVVRGRFLDIQQTVSEPTDIPNQVRYLEDGVLISEHGKIKWFGAWEDAQQHLPAGVEVQHYPEQLIVPGFIDTHIHFPQTEMVGAY-GEQLLSWLNTYTFPTEIQFQDKTYASEIAQFFVQELLKHGTTTALVFCTVHPESVDALFEAAERVQMRLIAGKVLMDRNAPEALCDTPETAYSNTKALIEKWHGKGRALYAITPRFAPTSTPEQLERAGQLKQEFPDVYVHTHLSENKDEIAWVKSLFPEQAGYLDVYQHYGLTGKRSVFAHCVHLEDEEWQCMHDTQSAIAFCPTSNLFLGSGLFPLKKTWEKQVKVGLGTDIGAGT-SFSLLQTVNEAYKVQQLQ---GDKLSAYEALYHATLGGAKALDLQDQLGNFNIGKEADFVVLNLKPTALQELRQTKSKSVEDSLFALFTLGDDRNIEATYIYGNRAYQKETAK 4DYK Chain:B ((9-419)) -------DLLLLPTWIVPV---------------EPAGVVLRDHALGIRDGQIALVAPREQAM--RHGATEIRELPGMLLAPGLVNAHGHSAMSLFRGLADDLPLMTWLQDHIWPAEGQWVSEDFIRDGTELAIAEQVKGGITCFSDMYFYPQ----AICGVVHDSGVRAQVAIPVLDFPIPG-A-RDSAEAIRQGMALFDDLKHHPRIRIAFGPHAPYTVSDDKLEQILVLTEEL-DASIQMHVHETAFEVEQAMERN--GERPLARLHRLGLLGPRFQAVHMTQVDNDDLAMLVETNSSVIHCPESNLKLASGFCPVEKLWQAGVNVAIGTDGAASNNDLDLLGETRTAALLAKAVYGQATALDAHRALRMATLNGARALGLERLIGSLEAGKAADLVAFDLSGLAQQP--------VYDPVSQLIYASGRDCVRHVWVGGRQLLDDGRL-

General information: TITO was launched using: RESULT: Template: 4DYK.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 2584 -95858 -37.10 -236.10 target 2D structure prediction score : 0.64 Monomeric hydrophicity matching model chain B : 0.73 3D Compatibility (PKB) : -37.10 2D Compatibility (Sec. Struct. Predict.) : 0.64 1D Compatibility (Hydrophobicity) : 0.73 QMean score : 0.454

(partial model without unconserved sides chains): PDB file : Tito_4DYK.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4DYK-query.scw PDB file : Tito_Scwrl_4DYK.pdb: