Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MQEFLISTSIVALAEMGDKTQLL-ALLLSACFRKPIPIL-IAILLATLINHGISAVLGQWITTVLSPAILVWVLAVGFIGMAFWMLIPDELDDETASINKWQKFGVFG-ATFILFFLAEIGDKTQIATVALAARYDSIFWVMLGTTLGMMIANAP--AVFIG-NKLAERL----------SIALIH-------KIGAAIFF-------IVGVSTLVQHYFF---- 5IOO Chain:A ((2-210)) ---------EINRKQAKEFYNSDMATALESCQKYGHALFMPELIDAKILATKGSSLLSNW---LTAPSIRATGRTKQGNPVVVYVHVDNYLSNPENIRNAERINGAGVMPVDEFQRLLDLGDNKNVFVID----YDKLKSSSSGVIPVERALEHPQTIPFIGGEERAQRYLEKFKQVYGNNIGIWHCDDLKDEPLGRLLFVGDYCNNGLIGNYGIGNYARFVGVR

General information: TITO was launched using: RESULT: Template: 5IOO.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 : 757 -46365 -61.25 -264.94 target 2D structure prediction score : 0.32 Monomeric hydrophicity matching model chain A : 0.63 3D Compatibility (PKB) : -61.25 2D Compatibility (Sec. Struct. Predict.) : 0.32 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.216

(partial model without unconserved sides chains): PDB file : Tito_5IOO.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5IOO-query.scw PDB file : Tito_Scwrl_5IOO.pdb: