Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSKHVYRHVCSYFKENKISIFLRPLQYTEIDLIWQQINRRELITQLYLQKQEHLELTDCFYDVKHWDAYHLENDPPKLKELYE-QGALFIGTFDASEQLAGISVVSNQTITD---YPNAKLLQYFYVDADQQGKGIGAKLMQAAKESAKQLEAHQLYISATP-SKRTVDFYIKHGAVVLKHPDRQLWELEPEDIHLLCTL 4E2A Chain:A ((3-172)) ------------------QVEIRKVNQDELSLLQKIAIQTFRETFAFDNTA--EQ-------LQNFFDEA--YTLSVLKLELDDKESETYFILM-SGKAAGFLKVNWGSSQTEQVLEDAFEIQRLYILKAYQGLGLGKQLFEFALERAQISGLSWVWLGVWEKNVKAQLLYAKYGFEQFSKHSFFVGNKVDTDWLLKKSL

General information: TITO was launched using: RESULT: Template: 4E2A.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 : 620 -34620 -55.84 -209.82 target 2D structure prediction score : 0.64 Monomeric hydrophicity matching model chain A : 0.60 3D Compatibility (PKB) : -55.84 2D Compatibility (Sec. Struct. Predict.) : 0.64 1D Compatibility (Hydrophobicity) : 0.60 QMean score : 0.446

(partial model without unconserved sides chains): PDB file : Tito_4E2A.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4E2A-query.scw PDB file : Tito_Scwrl_4E2A.pdb: