Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNQHTLLPKKTERLQYFGSVSPIKGEKPVEKEKMKDLQNIRKDYFFDIQHVGVANVSHPVTITSAMMPAEQTTAANFTMTCNLPRNQKGINMSRLTELLQVYHQNGWILSFSSLQQFTKELAENMDTSSATVEVRFPWFFERKSPKLEKAGLMHADIFMSVTYRKDQPFKQRAGISAKVTTLCPCSKEISEYSAHNQRGTVSIWADIHPAASLPSDVKA---DLLHAAESNASARLHPVLKRPDEKAVTETAYENPRFVEDLARLIAADLFELEWVSAFEIECRNEESIHLHDAYAKLCFSKEVDKI 3D2O Chain:A ((14-256)) -------------------------------------------RNLPINQVGIKDLRFPITLKTA--EGTQSTVARLTMTVYLPAEQKGTHMSRFVALME---QHTEVLDFAQLHRLTAEMVALLDSRAGKISVSFPFFRKKTAPVSGIRSLLDYDVSLT-GEMKDGAYGHSMKVMIPVTSLCPCSKEISQYGAHNQRSHVTV--------SLTSDAEVGIEEVIDYVETQASCQLYGLLKRPDEKYVTEKAYENPKFVEDMVRDVATSLIADKRIKSFVVESENFESIHNHSAYAYIAY-------

General information: TITO was launched using: RESULT: Template: 3D2O.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 : 1197 -100779 -84.19 -419.91 target 2D structure prediction score : 0.50 Monomeric hydrophicity matching model chain A : 0.77 3D Compatibility (PKB) : -84.19 2D Compatibility (Sec. Struct. Predict.) : 0.50 1D Compatibility (Hydrophobicity) : 0.77 QMean score : 0.333

(partial model without unconserved sides chains): PDB file : Tito_3D2O.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3D2O-query.scw PDB file : Tito_Scwrl_3D2O.pdb: