Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MPTLDEMTTVTDDQSELTMSVLMTPDMANFSGNVHGGTILKLLDQVAYACASRYSGSYVVTLSVDKVNFKEPIYVGELVTFLASVNHVGRTSMEVGIRVEAQNIQKRTVRHTNSCYFTMVAVDEHGKPRKVPKLNLDTEWKRCRFEAAEHRKVLRLQENHNPSCSMYKKTS 4IEN Chain:A ((14-161)) ---------------ELIMSELMMPDTANFSGNVHGGELLLLLDQVAYSCASRYSGNYCVTLSVDKVLFKEPIHIGDLVTFYAAVNYTGRTSMEIGIRVEAQNIRTGEIRHTNSCYFTMVAVKD-GKPVPVPPLEILTDRQRCRYEKAKKRRDISLQASEDMSC-------

General information: TITO was launched using: RESULT: Template: 4IEN.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 : 634 -84401 -133.12 -570.27 target 2D structure prediction score : 0.70 Monomeric hydrophicity matching model chain A : 0.84 3D Compatibility (PKB) : -133.12 2D Compatibility (Sec. Struct. Predict.) : 0.70 1D Compatibility (Hydrophobicity) : 0.84 QMean score : 0.483

(partial model without unconserved sides chains): PDB file : Tito_4IEN.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4IEN-query.scw PDB file : Tito_Scwrl_4IEN.pdb: