Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MEFVFNGFYTLISAVIVLLLGRFLVNRIDFLERYNIP-EPVAGGLVAAVVSLLVHTFWGYSIVFS----S-----ELQTSFMLVFFASIGLSANFMKLKEGGTALVIFLICVASFIVVQNAVGMSLATLLGLDPLIGLIAGSI-TLTGGHGTA-GAWGEILESQHGI--QGALALGMASATFGLIM-CVIGGPLAKLLINRYSLAQAKTNAEIQQRDTHVEQNSDDLAPFENPHQVRLITADNAITTLGMFAACLAFAEFMTGFS-KG-TWFELPTFVWALGGGVILR--NILESVLKVDIFDRAIDVFGNASL-----SLYLAMALLSLKLWQLADLAGPLVVILVAQTLTMALYAAFVTFRVMGKNYDAAVLAASHCGFGMGATPTAVANMQAITNMYGPSHKAF-LIVPLCGAFFVDLINATVIQLMLKFIA 5A1S Chain:D ((51-443)) ------LVGGFALMFVMGAIFGEIGKRLPIFNKYI-GGAPVMIFLVAAYF----VYAGIFTQKEIDAISNVMDKSNFLNLFIAVLITGAILSVNRKLLLKSLLGYI---PTILAGIVGASLFGIVIGLCFGIPVDRIMMLYVLPIMGGGNGAGAVPLSEIYHSVTGRSREEYYSTAIAILTIANIFAIIFAALLDMVGKKYTWLSGEGELVRK------AS------FKTEDDEKAGQITHRETAVGMVLSTTCFLLAYVVAKKILPSIGGVSIHYFAWMVLIVAALNASGLCSPE-----IKAGAKRLSDFFSKQLLWVLMVGVGVCYTDLQEIIDALTFANVVIAAIIVVGAVVGAAIGGWLIGFYPIESSITAGLCMANRGGSGDLEVL----SACNRMNLISYAQISSRLGGGIVLVIASIVFS-------

General information: TITO was launched using: RESULT: Template: 5A1S.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain D - contact count / total energy / energy per contact / energy per residue : 1845 -186613 -101.14 -507.10 target 2D structure prediction score : 0.73 Monomeric hydrophicity matching model chain D : 0.66 3D Compatibility (PKB) : -101.14 2D Compatibility (Sec. Struct. Predict.) : 0.73 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.316

(partial model without unconserved sides chains): PDB file : Tito_5A1S.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5A1S-query.scw PDB file : Tito_Scwrl_5A1S.pdb: