Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MFKIKKKKLFIPIIILVLTAFLALIGYISIIFLGHYVIDEKKLILHASSKIVDQNGDEVASLYTENR-EPVSINEIPKQVREAFIAVEDKRFYEHHGIDAKSVGRAVYRDILAGGKVEGGSTITQQLAKNIFLTHDKTFLRKTKEVIIAINLERDYSKDKLLEMYLNQLYFGHGVYGIQAASHYYFNKEVKDLTVSEGAVLAAIPKAPSTYSPILHPDKNKERRDTILGMMNDQGYISAKEAVTAQGRTLGLHVKKQSETP------------WFDSYIDLVIKEAEDKYSISGEQL---LQGGYTIKVPLDSKLQKTAYQVMKEGSYYPGTDQNAEGSAVFINNKTGGVEAAIGGRDYTS-KGYNRVTAVRQPGSTFKPLAVYGPAMQEKKFKPYSLLKDELQSYGD-YTPKNYDSRYEGEVTMSDAITYSKNAPAVWTLNEI----GVETGKSYLKANGIDIP-DEGLALALGGLEKGVSPLQLAGAFHTFAANGTYTEPFFISSIIDEDGETIA-DHKEEGKRVFSKQTSWNMTRMLQQVVKK-----GTATSGTYHGDLAGKTGSTSYTGVS--------GATKDAWFAGYTPKITGAVWMGYDKTDQ---NHYL-KAGSSYPTRLFKDILTQ-AGETGHVFTKPKNVKELESPIELKPVKTLTADYTFKAAGLFTIELKWDAQEDDRAVYRIYVNKDGEETLLDSVEGKGSYEIPYANLFSGASYKIVPYNTQTKREGEGTDYVQPKLFSS 2OLU Chain:A ((10-611)) -----------------------------------------KLQDPIPAKIYDKNGELVKTLDNGQRHEHVNLKDVPKSMKDAVLATEDNRFYEHGALDY-------------GFGSEGASTLTQQVVKDAFLS----IGRKAQEAYLSYRLEQEYSKDDIFQVYLNKIYYSDGVTGIKAAAKYYFNKDLKDLNLAEEAYLAGLPQVPNNYNIYDHPKAAEDRKNTVLYLMHYHKRITDKQWEDA--KKIDLKANLVNRTPEERQNIDTNQDSEYNSYVNFVKSELMNNKAFKDENLGNVLQSGIKIYTNMDKDVQKTLQNDVDNGSFYKNKDQQV--GATILDSKTGGLVAISGGRDFKDVVNRNQATDPHPTGSSLKPFLAYGPAIENMKWATNHAIQDESSYQVDGSTFRNYDTKSHGTVSIYDALRQSFNIPALKAWQSVKQNAGNDAPKKFAAKLGLNYEGDIGPSEVLGGSASEFSPTQLASAFAAIANGGTYNNAHSIQKVVTRDGETIEYDHTSH--KAMSDYTAYMLAEMLKGTFKPYGSAYGHGVSGVNMG---AKTGTGTYGAETYSQYNLPDNAAKDVWINGFTPQYTMSVWMGFSKVKQYGENSFVGHSQQEYPQFLYENVMSKISSRDGEDFKRPSSV--------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 2OLU.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 : 2992 -118171 -39.50 -217.63 target 2D structure prediction score : 0.55 Monomeric hydrophicity matching model chain A : 0.73 3D Compatibility (PKB) : -39.50 2D Compatibility (Sec. Struct. Predict.) : 0.55 1D Compatibility (Hydrophobicity) : 0.73 QMean score : 0.392

(partial model without unconserved sides chains): PDB file : Tito_2OLU.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2OLU-query.scw PDB file : Tito_Scwrl_2OLU.pdb: