Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSTSQGEMRGR-LRSNASSTGILSSNTYA-KHTLKCSLKPEAMELI-RCRHLNIQTTH-V-KAIELVSFNEAK-NRLITKKVIGKELFHA-LWNPTNLLGRLQGHR-LQNPDTLVHRI-TEIGTWL-RKYHNSSAGLTPESTDGSWLVTAFAQKIRGIRASKLIPEPNLKKIEQ-KYS-TELQKLTTPDYLSFNNAFPCQVHGDFVLYNV-LVDSQQNMH-ILDFSKTRISSN-LEDVARFY-STLW------AIAQTNRTRRSL--LRELPTRFLKAYGLPPLIAETPYFRANLVYN-FLAHLEAQHR-GRKTFSWNTNREMGQITRAGMK-WI-YQQI------ 3DXP Chain:A ((20-359)) -RFDTEALEAWMRQHVEGFAGPLSVEQFKGQSNPTFKLVTPGQTYVMRAKPGAIEREYRVMDALAGTDVPVAKMYALCEDESVIGRAFYIMEFVSGRVLWDQSLPGMSPAERTAIYDEMNRVIA-AMHTVDYQAIGLGDYGKPGNYFQRQIERWTKQYKLSET------ESIPAMDSLMDWLPQHIPQE----DADLTSIVHGDYRLDNLMFHPTEPRVLAVLDWELSTLGHPMG-DFGYHCMSWHIAPGQFRGIAGLDHAALGIPDEASYRKLYEQRTGRPI----TGDWNFYLAFSMFRIAGILQGIMKRVVDGTASSAQALDAGKRARPMAEMGWEYAKKAKQ

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 : 1343 26334 19.61 89.27 target 2D structure prediction score : 0.49 Monomeric hydrophicity matching model chain A : 0.61 3D Compatibility (PKB) : 19.61 2D Compatibility (Sec. Struct. Predict.) : 0.49 1D Compatibility (Hydrophobicity) : 0.61 QMean score : 0.250

(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: