Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ---------MQRLEVYKNYQHLYDLRMTILLNLST----------LYLYNQDKNMCKQICYTLLEDAK--------NKKSYDRLAICYVRIGICRDNAKLIQKGFSLLELTE-ETSMLSHLKKEVEIYYQAKER------------- 2LPE Chain:A ((-2-170)) MDGGAGAAVSRALQQCGQLQKLIDISIGSLRGLRTKCSVSNDLTQQEIRTLEAKLVKYICKQQQSKLSVTPSDRTAELNSYPRFSDWLYIFNVRPEVVQEIPQELTLDALLEMDEAKAKEMLRRWGASTEECSRLQQALTCLRKVTG

General information: TITO was launched using: RESULT: Template: 2LPE.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 : 334 -14108 -42.24 -133.09 target 2D structure prediction score : 0.42 Monomeric hydrophicity matching model chain A : 0.62 3D Compatibility (PKB) : -42.24 2D Compatibility (Sec. Struct. Predict.) : 0.42 1D Compatibility (Hydrophobicity) : 0.62 QMean score : 0.062

(partial model without unconserved sides chains): PDB file : Tito_2LPE.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2LPE-query.scw PDB file : Tito_Scwrl_2LPE.pdb: