Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence -------------------------------------MKKITALLF-ALCATVTHAELQTLDNDALQAINGQAGADLSLMLNLNQTSNGIFDNGSGGVCENVEFCHIGLAINKRFVQADTTKPSGWAENSDSGNKLWLVFKGVQGTLNIQKMGLDGADLKYLDKSNTEIIKLAIQLSF----------SAAQPILIRNFGFNALSIEQD--NFTSSTTTQGSSANMYDYA-----YFKKPTYAATANSANQQVATATPSAYDYGRETGFMGLMMNGNMAIQGKVMV-FSCDGSHPRC---------------- 5TNV Chain:A ((21-326)) MYSAHTWPIAANMLGFGNRAPDGGHIKDAPAGVWAKQLRQVRELGFDHIDPTDAWVPLAALSDSRIEEFRTVLADEGLAISSISMTRSSIVDVENGE--KNLADAHRLIDLAPSF--GATIVNTGFMQALTPEQEKQIWFWLVQGHVD--DPALRDLAIERVRELGDHARTNGIQLSLEMYEDTYIGTPDDAVAFIKDVDHDAVGLNPDLGNLVRLHRPMPHPSEMYAKVLPYSNFWHIKNYSRDFDPATGA-YSSAPLPLKYGYVNYRQIIRLALELGYTGPFCCEHYGSDSLGVCAENREYILQVLTSALA

General information: TITO was launched using: RESULT: Template: 5TNV.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 : 1145 45806 40.00 195.75 target 2D structure prediction score : 0.41 Monomeric hydrophicity matching model chain A : 0.65 3D Compatibility (PKB) : 40.00 2D Compatibility (Sec. Struct. Predict.) : 0.41 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.144

(partial model without unconserved sides chains): PDB file : Tito_5TNV.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5TNV-query.scw PDB file : Tito_Scwrl_5TNV.pdb: