Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MREIIMKAAHFYDRGDIRIEDIPEPEVTPGTVGIKVAWCGICGTDLHEFMEGPIFIPPCGHPHPISGESAPITMGHEFSGVVYAVGEGVDDIEIGQHVVVEPYIVADDVPTGPGDNYHLSKNMNFIGLGGRGGGLSEKIAVRRRWVHPISNKIPLDQAALIEPLSVGHHAFVRSGAKAGDIALVGGAGPIGLLLSAILKAKGLK-VIITELSAKRKEKAKESGVADYILDPSEVDVVSEVMKIT--NGDGVDVAFECSSVNKVLDTLVAAVKPTGVIVIVSIWSHPA--SINVHSVVMKELDVRGTIAYVN-DHQETIKLVEEGKINLEPFITQRIQLDDLISQGFETLIHNNESAVKIIVHP 4EJ6 Chain:A ((21-361)) --QSMMKAVRLESVGNISVRNVGIPEPGPDDLLVKVEACGICGTDRHLLHGEFP-------------STPPVTLGHEFCGIVVEAGSAVRDIAPGARITGDPNISCGRCPQCQAGRVNLCRNLRAIGIH-RDGGFAEYVLVPRKQAFEIPLTLDPVHGAFCEPLACCLHGVDLSGIKAGSTVAILGGGVIGLLTVQLARLAGATTVILSTRQATKRRLAEEVG-ATATVDPSAGDVVEAIAGPVGLVPGGVDVVIECAGVAETVKQSTRLAKAGGTVVILGVLPQGEKVEIEPFDILFRELRVLGSFI-NPFVHRRAADLVATGAIEIDRMISRRISLDEA-PDVISNPAAA-GE-VKVLVI-

General information: TITO was launched using: RESULT: Template: 4EJ6.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 : 1995 -149148 -74.76 -445.22 target 2D structure prediction score : 0.59 Monomeric hydrophicity matching model chain A : 0.75 3D Compatibility (PKB) : -74.76 2D Compatibility (Sec. Struct. Predict.) : 0.59 1D Compatibility (Hydrophobicity) : 0.75 QMean score : 0.526

(partial model without unconserved sides chains): PDB file : Tito_4EJ6.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4EJ6-query.scw PDB file : Tito_Scwrl_4EJ6.pdb: