Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MEQYSEACIEACIDCMKACNHCFTKCLEESV-QHHLSGCIRLDRECADICALAVKAMQTDSPFMKEICALCADICEACGTECGKHDHDHCQACAKACFTCAEQCRSMAA 3KAV Chain:A ((35-129)) -----ERCRLAAQACIRACERYLALCTESSREQRQHAG------DCADLCRLAALLMERRSPWAPAACELAARYALACAERC-DGDEPLERECAGACRRFVEACRPL--

General information: TITO was launched using: RESULT: Template: 3KAV.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 : 439 -79835 -181.86 -849.31 target 2D structure prediction score : 0.80 Monomeric hydrophicity matching model chain A : 0.74 3D Compatibility (PKB) : -181.86 2D Compatibility (Sec. Struct. Predict.) : 0.80 1D Compatibility (Hydrophobicity) : 0.74 QMean score : 0.678

(partial model without unconserved sides chains): PDB file : Tito_3KAV.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3KAV-query.scw PDB file : Tito_Scwrl_3KAV.pdb: