Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSKQILILAGDGIGPEIVGAAEKVLNKVNEKFNLSLTWEHGLLGGAAIDAHGEPYPAVTSEQAK-KADAILLGAVGGPKWDTIERSIRPERGLLKIRSELNLFANLRPAILYPQLADASSLKPEIVAGLDILIVRELTGGIYFGQPRGIRELENGEKQGYNTDVYSESEIKRIAKVAFELAGLR-----GGK--------VCSVDKANVLEVTE-LWKQTVTDLQQ--ANYPNIQLSHMYVDNAAMQLVRAPKQFDVIVTGNLFGDILSDEAAMLTGSIGMLPSASLDENGKGMYEPCHGSAPDIAGQNVANPLATILSVAMMLRYTFREEAAAKAIEDAVGQVLDQG-LRTADIMSEGMTKVGTAEMGEAVVAALA 3TY4 Chain:A ((15-364)) ------LIPADGIGKEVVPAARRLMENLPAKHKLKFDFIDLDAGWGTFERTGKALPERTVERLKTECNAALFGAVQSPTHKVAGYS----SPIVALRKKMGLYANVRPV----KSLDGAKGKP-----VDLVIVRENTECLYVKEERMVQNTP-GKRVAEAIRRISEEASTKIGKMAFEIAKSRQKIRESGTYSIHKKPLVTIIHKSNVMSVTDGLFRESCRHAQSLDPSYASINVDEQIVDSMVYRLFREPECFDVVVAPNLYGDILSDGAASLIGSLGLVPSANVGDNFV-MSEPVHGSAPDIAGRGIANPVATFRSVALMLEFMGHQDAAAD-IYTAVDKVLTEGKVLTPDLGG----KSGTNEITDAVLANI-

General information: TITO was launched using: RESULT: Template: 3TY4.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 : 1790 -27799 -15.53 -83.73 target 2D structure prediction score : 0.66 Monomeric hydrophicity matching model chain A : 0.80 3D Compatibility (PKB) : -15.53 2D Compatibility (Sec. Struct. Predict.) : 0.66 1D Compatibility (Hydrophobicity) : 0.80 QMean score : 0.479

(partial model without unconserved sides chains): PDB file : Tito_3TY4.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3TY4-query.scw PDB file : Tito_Scwrl_3TY4.pdb: