Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKPKKRKLLDLLMLFLLLSGIGILAYPFVSDALNNYLDQQIISHYQQQAVKENEEVMAKIQENMTKKNQQLAKEGGNPGADPFT---KKKEPAKKDRTYFEKHTIGILTIPEINVHLPIFDETNTVLLEKGASLLEGTSYPTGGENTHAVISSHRGLPQAKLFTDLPKLTLGDSFYIEINGRTLAYQVDQIKTVEPTDTKDLRIEKGQDFVTLLTCTPYMVNSHRLLVRGHRVPYHAKEVQKEVQKVSENKRFFLYGLLAACILIFLLLIYLFRQSFKIRNRS 2WTS Chain:A ((42-200)) -------------------------------------------------------------------------------GDPWSEEMKKKGRAEYARMLEIHERMGHVEIPVIDVDLPVYAGTAEEVLQQGAGHLEGTSLPIGGNSTHAVITADTGLPTAKMFTDLTKLKVGDKFYVHNIKEVMAYQVDQVKVIEPTNFDDLLIVPGHDYVTLLTCTPYMINTHRLLVRGHRIPYVA-E--------------------------------------------

General information: TITO was launched using: RESULT: Template: 2WTS.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 : 857 1307 1.52 8.38 target 2D structure prediction score : 0.71 Monomeric hydrophicity matching model chain A : 0.69 3D Compatibility (PKB) : 1.52 2D Compatibility (Sec. Struct. Predict.) : 0.71 1D Compatibility (Hydrophobicity) : 0.69 QMean score : 0.591

(partial model without unconserved sides chains): PDB file : Tito_2WTS.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2WTS-query.scw PDB file : Tito_Scwrl_2WTS.pdb: