Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSDQFLMSQRPGAPVSPPAPRSVRSATPTISPQPQPQPQPQPQPQPPARPGSLATALRQALAAPDDERGERISQLGLRPLTGGLNNYAFRWGTPSEGEVCVKAYPSGD-RWRAEREWRALSLLARRSVPWAPRPLWWDPHG-----SPPIVIMTMLPGREVRHLDSPRERIAALDGLVDTLRAITAVPLEAGFETLV-RVESIQFCLETLSDTWPRRLARVADSTLSADLRHLLRRWSNSGDPEILGRPAPRVFSRGDGNLRNWLWDG--AVCRCVDFEYSGWSDRVFDAADLVEHPYREEIDDALWPGVIDALGIT-----DADRPRFDAARRACAMRWAAVLWEKRGRQLGEFLVQLDRVRLLTRDL 5IGI Chain:A ((26-283)) ---------------------------------------------------------------------------PLTVNELGLDYRIVIATVDDGRRWVLRIPRRAEVSAKVEPEARVLAMLKNRLPFAVPDWRVANAELVAYPMLEDSTA-VIQPGSSTPDWVVPQDSEVFAESFATALAALHAVPISAA-VDAGMLIRTPTQARQKVAD-DVDRVRREF--VVNDKRLHRWQRWLDDD----SSWPDFSVVVHGDLYVGHVLIDNTERVSGMIDWSEARVDDPAIDMAAHLMVFG-----EEGLAKLLLTYEAAGGRVWPRLAHHIAERLAFGAVTYALFALD-----------------------

General information: TITO was launched using: RESULT: Template: 5IGI.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 : 1068 -38711 -36.25 -159.30 target 2D structure prediction score : 0.74 Monomeric hydrophicity matching model chain A : 0.63 3D Compatibility (PKB) : -36.25 2D Compatibility (Sec. Struct. Predict.) : 0.74 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.260

(partial model without unconserved sides chains): PDB file : Tito_5IGI.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5igi-query.scw PDB file : Tito_Scwrl_5IGI.pdb: