Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSKIYEKYRDLITNPFDI-KYKNIEIKEIISYPPAGNDVVECLCKIGKDARNVFIKIERSKV--CDFATEIKNLNYLKNNSYYSKIPNIYESGI-YNNKQYIVLSKIEGERLSDILI-KNDN-LRKELLYKYGQELAIIHRIPISNQKI-A-KQRAINSYPNKTMYTTLS--------KEN---NIK-EYIKFLEDNDFKKELTTFIHGDFHYANVLWLN----NDINGVIDWEYSGIGLREQDIAWACTLRPGQKFMDTMEDIQTFLKGYSEKEKFD---I--EKLRWCLINSYCHFYLMNENNEDYKNKLLILLRNCMEEKI 3TDW Chain:A ((4-277)) ---NKLHYTTMIMTQFPDISIQ--SVESL-----GEGFRNYAILVN----GDWVFRFPKSQQGADELNKEIQLLPLLVGC-VKVNIPQYVYIGKRSDGNPFVGYRKVQGQILGEDGMAVLPDDAKDRLALQLAEFMNELSAFPVETAISAGVPVTNLKN-KILL-LSEAVEDQVFPLLDESLRDYLTLRFQSYMTHPVYTRYTPRLIHGDLSPDHFLTNLNSRQTPLTGIIDFGDAAISDPDYDYVYLLE-----DC--GE-LFTRQVMAYRGEVDLDTHIRKVSLFVTFDQVSYLLEG-------------------------

General information: TITO was launched using: RESULT: Template: 3TDW.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 : 1036 30544 29.48 124.67 target 2D structure prediction score : 0.48 Monomeric hydrophicity matching model chain A : 0.62 3D Compatibility (PKB) : 29.48 2D Compatibility (Sec. Struct. Predict.) : 0.48 1D Compatibility (Hydrophobicity) : 0.62 QMean score : 0.313

(partial model without unconserved sides chains): PDB file : Tito_3TDW.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3tdw-query.scw PDB file : Tito_Scwrl_3TDW.pdb: