Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRGYVQMEKSEGSLRRKSMNPVSPLFEKIDASIEKKANLFENSFSRYAVRAVLACLFLTLGTAVAFA----IAMKGEDIAHGLGKILYAFMFSWGLVMILYMNAELGTSNMLYMTVGVFRQRLALSKAAKILFACIFFNMIGGILCGFLISMTTPFQDLTLDNFMLESIAVKLAKPSATILVE---GMFANIVVNTAVLISMRMKEDVGKVITVVFIIFIFAFLGYEHVIANF---P-AFTLTYFA--SHGQMDGMTVSN---------VLHNLFFALAGNYIGGGLVMGLGYAWLNQSKSSYVD 3KLZ Chain:A ((21-275)) --------------------------------------TGEGKAKKAAYKSFLLAISAGIQIGIAFVFYTVVTTGAHDMPYGVTKLLGGLAFSLGLILVVITGGELFTSSVLIL-VAKASGKISWKELVRNWTVVYFGNLCGSIILVFIMLATRQFME-DGGQLGLNAMAISQHKLHHTFLQAFALGLMCNILVCLAVWMTFSARSLTDKVMVLILPVAMFVSSGFEHCIANMFQVPMAIGIKYFAPESFWAMTGANIAQYADLNFVNFIVNNLIPVTLGNIVGGGVFVGMWY-WL---------

General information: TITO was launched using: RESULT: Template: 3KLZ.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 : 1020 -153952 -150.93 -660.74 target 2D structure prediction score : 0.64 Monomeric hydrophicity matching model chain A : 0.73 3D Compatibility (PKB) : -150.93 2D Compatibility (Sec. Struct. Predict.) : 0.64 1D Compatibility (Hydrophobicity) : 0.73 QMean score : 0.230

(partial model without unconserved sides chains): PDB file : Tito_3KLZ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3KLZ-query.scw PDB file : Tito_Scwrl_3KLZ.pdb: