Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSGAAEIIEAILGESGPDY-ESYSFEETPGDTRSDSHFVTVEYQGESYEVVVKLAPEVDSTFAVEPFLHEYVAERTDVPLPGILVFKEEPEQDVPPYFITERIHGDNLDEH-FESFSMDERGAIMFEIGEILGDMHSTIAFEGYGRLDLDDGRLIVRDLSWDWRAYFEELTQGHIDQLAETTFEDLQPTARERLADRLSVVPKQGTPRLVHDDFRPGNLLIEPD-GPEISAVLDWEKTLAGDPLYNLAQIELLFIDSV--F------RDPDEREQLRERLYEGYGTETDFDADESYQACKPLYQFSTLVWRMAGFDSIYGDASPLARTRAEAYYREQFTNLARTLEPDR 3DXP Chain:A ((21-324)) --FDTEALEAWMRQHVEGFAGPLSVEQFKG-QSNPTFKLVTP-GQ---TYVMRAKPG---AIEREYRVMDALAG-TDVPVAKMYALCEDESVIGRAFYIMEFVSGRVLWDQSLPGMSPAERTAIYDEMNRVIAAMHTV-DYQAIGLGDYGKPGNYFQRQIERWTKQYKLS--------E-TESIPAMDSLMDWLPQHIPQ-EDADLTSIVHGDYRLDNLMFHPTEP-RVLAVLDWELSTLGHPMGDFGYHCMSWHIAPGQFRGIAGLDHAALGIPDEASYRKLYEQRTGRPIT----GDWNFYLAFSMFRIAGILQGIMK-----------------------------

General information: TITO was launched using: RESULT: Template: 3DXP.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 : 1267 -4576 -3.61 -16.23 target 2D structure prediction score : 0.56 Monomeric hydrophicity matching model chain A : 0.68 3D Compatibility (PKB) : -3.61 2D Compatibility (Sec. Struct. Predict.) : 0.56 1D Compatibility (Hydrophobicity) : 0.68 QMean score : 0.345

(partial model without unconserved sides chains): PDB file : Tito_3DXP.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3dxp-query.scw PDB file : Tito_Scwrl_3DXP.pdb: