Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MIFLIRMIYNAVDIYSLILVAFAVMSWFPGAYESSLG-----------RWIVAL-----------------VKPVLAPLQRLPLQIAGLDLSVWVAIVLVRFLGENLVRFLAMIG-- 2NAS Chain:A ((1-110)) MI-------PSFAPGTLVWLKQDRFPWWPGFVMDPDEVRDITLPEGSDVWVCCLPRDSLTLSAANSEDEGQIRYFLPDRDEGMMEEGKLDASCAVAIEEAIQLYEEQLKAQAGGTNE

General information: TITO was launched using: RESULT: Template: 2NAS.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 : 280 -25734 -91.91 -321.67 target 2D structure prediction score : 0.39 Monomeric hydrophicity matching model chain A : 0.65 3D Compatibility (PKB) : -91.91 2D Compatibility (Sec. Struct. Predict.) : 0.39 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.109

(partial model without unconserved sides chains): PDB file : Tito_2NAS.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2NAS-query.scw PDB file : Tito_Scwrl_2NAS.pdb: