Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MEHHKTYHSANIKTATGSLLIEGPVSPEDLAGYEFHKDLTAFRPPREQHEALVDIA---GLPEGRIIIARDGRTIVGYVTYLYPDPLERWSEGNMEDLIELGAIEVA-PDYRGCAVGKTLLTVSMMDEQMENYIVMTTEYYWHWDLKGMKKDVWEYRKIMEKMMNAGGLVWFATDEPEISSHPANCLMARIGKNVSQESIEQFDRLRFYHRYMY 2BEI Chain:A ((3-169)) -----------------SVRIREAKEGDCGDILRLIRELAEFEKLKISEEALRADGFGDNPFYHCLVAEILGPCVVGYGIYYFIYSTWKGRTIYLEDIY-------VMPEYRGQGIGSKIIK-KVAEVALDKGCSQFRLAVLDWNQRAM------------DLYKALGAQDLTEAEGWHFFCFQGEATRKLAG---------------------

General information: TITO was launched using: RESULT: Template: 2BEI.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 : 573 -39133 -68.29 -257.45 target 2D structure prediction score : 0.55 Monomeric hydrophicity matching model chain A : 0.64 3D Compatibility (PKB) : -68.29 2D Compatibility (Sec. Struct. Predict.) : 0.55 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.203

(partial model without unconserved sides chains): PDB file : Tito_2BEI.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2BEI-query.scw PDB file : Tito_Scwrl_2BEI.pdb: