Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSLDDLQAATKIQKRYLTALEEGNYDIIPGKFYVRAFIKQYAEAVGLDADQLFEEHKKDIPNTYHDDVSEKISGMNLQKEMPKPASKALELLPTILVILGVIVVIAIVYAIIQFANHKNSDDHNAASEKAITQSESKYEIPKDSTLKENQNNSSEKETDTKKETKENEDKKKENDSEKLEIKAAGTEGSLTTYEVSGADKIELELKASDSSWIRVRDENSSSLKEGTLKKDETYKKDITDQKQVDIRTGYAPNLKIKINGKVLSYELDPKKVMAQTIKIVNKKEEKSS 3KXA Chain:A ((82-135)) FTQSELATAAGLPQPYLSRIENSKQS--L----QDKTVQKLANALGVSPLEVRAAFERRY------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 3KXA.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 : 146 -19579 -134.10 -362.57 target 2D structure prediction score : 0.81 Monomeric hydrophicity matching model chain A : 0.62 3D Compatibility (PKB) : -134.10 2D Compatibility (Sec. Struct. Predict.) : 0.81 1D Compatibility (Hydrophobicity) : 0.62 QMean score : 0.700

(partial model without unconserved sides chains): PDB file : Tito_3KXA.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3KXA-query.scw PDB file : Tito_Scwrl_3KXA.pdb: