Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MN-----------LNFIVPDINMTFGDMKFMGLNRERYVYDRENNKRTDVLESRIYNIASAVQGGQIEVTIPEYAGAKEIPPFADIELKNPKISAMATSQRDS------TYANVMWKLEADDIVVKGGSSVKPAAATGGNEKK 1WPI Chain:A ((1-133)) MSFWKTLQRQPRTISLFTNDIASNIKSQKCLQLLKG------DVSHRFDVEIANRFPTWDQLQYMRTSCPQGPVSLQRQIPKLDSVLKYKHTDPTFGMDLQKCVQRGLWNPKEALWVDWENKLVGNEPADIDKYII----QRK

General information: TITO was launched using: RESULT: Template: 1WPI.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 : 571 -12837 -22.48 -110.66 target 2D structure prediction score : 0.53 Monomeric hydrophicity matching model chain A : 0.65 3D Compatibility (PKB) : -22.48 2D Compatibility (Sec. Struct. Predict.) : 0.53 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.171

(partial model without unconserved sides chains): PDB file : Tito_1WPI.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1WPI-query.scw PDB file : Tito_Scwrl_1WPI.pdb: