Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSVLQELTKKKYSSLKTMFDDKYCPTFVYSILDQTIPGAVYADDQTF-------PKSFFIGTESGIYFIAGDQGNRDFHDFIAGYY------------EEQVKSSKRFTLFSSSDTWDSVLKPILKDDLNQMRRAAFSYQPKSFKKTLQLPKG--LVLKRI---DEDIISH---STAFNSAYYEEYWNSVSQFASK-----GFGFAVLHGNHVVSECTSIFLGHNRAEMDIYTL--EEYRGLGLAYCVANRFIAFCMENGIVPSWDCDIC--NNSSIALAAKLGF--------KTVTEYTIYYSG------------------------ 4AVA Chain:A ((2-333)) -DGIAELTGARVEDLAGMDVFQGCPAEGLVSLAASVQPLRAAAGQVLLRQGEPAVSFLLISSGSAEVSHVGDDGVAIIARALPGMIVGEIALLRDSPRSATVTTIEPLTGWTGGRGAFATMVHIPGVGERLLRTARQRLAAFVSPIPVRLADGTQLMLRPVLPGDRERTVHGHIQFSGETLYRRFMSPALMHYLSEVDYVDHFVWVVTDGSDPVADARFVRDETDPTVAEIAFTVADAYQGRGIGSFLIGALSVAARVDG-VERFAARMLSDNVPMRTIMDRYGAVWQREDVGVITTMIDVPGPGELSLGREMVDQINRVARQVIEAVG

General information: TITO was launched using: RESULT: Template: 4AVA.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 : 1144 -148018 -129.39 -571.50 target 2D structure prediction score : 0.48 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : -129.39 2D Compatibility (Sec. Struct. Predict.) : 0.48 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.352

(partial model without unconserved sides chains): PDB file : Tito_4AVA.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4AVA-query.scw PDB file : Tito_Scwrl_4AVA.pdb: