Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MHSQPLLDCWNLDQILDDLNAHGFAIVNQAYSAEYHTQVAKECSHHFD--EFREAGIQNG---VVSTIRSDHILWINESL---PVAEQHVETLTSFCQHLNQAFFL-GIK-EVEAHFACYNP-GEFYALHRDNPQQKNDRIMSTVYYLHPQWQDD-WGGQLRLQDKNDI-WHIITPEPNRLVIFQSN--LLHEVLVSKQQRLSITAWLRSGNSIWV 4BQY Chain:A ((17-225)) -------LKLALEYIVPCMNKHGICVVDDFLGKETGQQIGDEVRALHDTGKFTDGQLVSQKSDSSKDIRGDKITWIEGKEPGCETIGLLMSSMDDLIRHCNGKLGSYKINGRTKAMVACYPGNGTGYVRHVDNPN-GDGRCVTCIYYLNKDWDAKVSGGILRIFPEGKAQFADIEPKFDRLLFFWSDRRNPHEVQPAYATRYAITVWYFDAD----

General information: TITO was launched using: RESULT: Template: 4BQY.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 : 828 -9655 -11.66 -51.08 target 2D structure prediction score : 0.65 Monomeric hydrophicity matching model chain A : 0.71 3D Compatibility (PKB) : -11.66 2D Compatibility (Sec. Struct. Predict.) : 0.65 1D Compatibility (Hydrophobicity) : 0.71 QMean score : 0.464

(partial model without unconserved sides chains): PDB file : Tito_4BQY.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4BQY-query.scw PDB file : Tito_Scwrl_4BQY.pdb: