Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MDESGGEARAYMLGSGIVVKTQRPHRLRPRTSLEKEAHVLSLLAGPL--AGRIPRLFGYGREDTAAGPVEFLVMSRIRGCAALHAG-----LPAREALLASLADVLRSVHAADVTGLRDSGLLPADVDSAALRGRLQLGFADACDGFAAHRDRYAGAGAPERIAIAAVDALAG--LTDESPVLLHSNPGPTHVFVGDGGLCTGLIDFGDAYASHPALDLRSWP-------DPADRIVLHEAYTGGRPT-TRGFDAVWTVVMILADLNAMLHRADLAEAAGRDLALRLAQL 5IQC Chain:A ((35-285)) --GSGYDSVAYLVNNEYIFKTKFSTN--KKKGYAKEKAIYNFLNTNLETNVKIPNIEYSYIS----DELSILGYKEIKGTFLTPEIYSTMSEEEQNLLKRDIASFLRQMHGLDYTDI---SECTID-NKQN---VLEE-YILLRETIYNDLT-----DIEKDYIESFMERLNATTVFEGKKCLCHNDFSCNHLLLDGNNRLTGIIDFGDSGIIDEYCDFIYLLEDSEEEIGTNFGEDILRMYGNIDIEKAKEYQDIVEEYYPIETIVYGIKN------------------

General information: TITO was launched using: RESULT: Template: 5IQC.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 : 1009 -15434 -15.30 -65.96 target 2D structure prediction score : 0.58 Monomeric hydrophicity matching model chain A : 0.68 3D Compatibility (PKB) : -15.30 2D Compatibility (Sec. Struct. Predict.) : 0.58 1D Compatibility (Hydrophobicity) : 0.68 QMean score : 0.337

(partial model without unconserved sides chains): PDB file : Tito_5IQC.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5iqc-query.scw PDB file : Tito_Scwrl_5IQC.pdb: