Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MEHTWKIGNVEIPNRVVVAPMAGITNSAFRVTVKEFGAGLVVCEMISDQGIHFR------NKKTLEM--------LHIE-ETEHPLSLQIFGGNKDSLVEAAQFVEENTAADIIDINMGCPVNKVIKAEAGAKWLLDPEKVYEMVQAVSSAVNIPVTIKMRIGWDEEHVFAVENALAAQSAGASAIAMHGRTRVQMYEGKADWEVLKEVKKHLTIPFMGNGD----VKTPEDAKWMLDYVGADGVMIGRAALGNPWMIHRTQHYLETGELIPEPTPAEKIATAKLHLQRLADLKGEKVACREFRTHAAYYLKGIPRAAKVKVAINQTEKQQEINDLLDQFVEKAEKVLLKQTL 4WFS Chain:A ((6-309)) -------------HHLILAPMVRVGTLPMRLLALDYGADIVYCEELIDLKMIQCKRVVNEVLSTVDFVAPDDRVVFRTCEREQNRVVFQMGTSDAERALAVARLVE--NDVAGIDVNMG-------------ALLSDPDKIEKILSTLVKGTRRPVTCKIRILPSLE--DTLSLVKRIERTGIAAIAVHGRKREERPQHPVSCEVIKAIADTLSIPVIANGGSHDHIQQYSDIEDFRQATAASSVMVARAAMWNPSIFLKEGL-------------RPLEEVMQKYIRYAVQYDN---HYTNTKYCLCQMLREQLE-SPQGRLLHAAQSSREICEAFG---------------

General information: TITO was launched using: RESULT: Template: 4WFS.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 : 1498 -14862 -9.92 -54.64 target 2D structure prediction score : 0.71 Monomeric hydrophicity matching model chain A : 0.69 3D Compatibility (PKB) : -9.92 2D Compatibility (Sec. Struct. Predict.) : 0.71 1D Compatibility (Hydrophobicity) : 0.69 QMean score : 0.527

(partial model without unconserved sides chains): PDB file : Tito_4WFS.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4WFS-query.scw PDB file : Tito_Scwrl_4WFS.pdb: