Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSPAQRRILLYILSFIFVIGAVVYFVK-----SDYLFTLIFIAIAILFGMRARKADSR------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------- 4WD8 Chain:A ((25-292)) -SKIIFRLLLNVLMSIIAIISYQWYEQLGIHLTVAPFSLLGIAIAIFLGFRNSASYSRFVEARNLWGTVLIAERTLVRQLRNILPAEHDAHRRIVSYLVAFSWSLKHQLRKTDPTADLRRLLPEERVTEILASSMPTNRILLLAGNEIGQLREAGKLSDITYGLMDNKLDELAHVLGGCERLATTPVPFAYTLILQRTVYLFCTLLPFALVGDLHYMTPFVSVFISYTFLSWDSLAEELEDPFGTAANDLPLNAMCNTIERNLLDMTGQ

General information: TITO was launched using: RESULT: Template: 4WD8.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 : 18 -5411 -300.61 -104.06 target 2D structure prediction score : 0.79 Monomeric hydrophicity matching model chain A : 0.51 3D Compatibility (PKB) : -300.61 2D Compatibility (Sec. Struct. Predict.) : 0.79 1D Compatibility (Hydrophobicity) : 0.51 QMean score : 0.386

(partial model without unconserved sides chains): PDB file : Tito_4WD8.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4WD8-query.scw PDB file : Tito_Scwrl_4WD8.pdb: