Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MLETAIEVLEKCAQLVTASEEWGYESVTMEKEEIEMGMLPE--DVTLPRLVMTHLYIYCAPEDGKDYVVYFITD------------ITSQREFVRGLLVEGRLVWSQIGGTNE 2NAS Chain:A ((1-110)) MIPS---FAPGTLVWLKQDRFPWWPGFVMDPDEVRDITLPEGSDVWVCCLPRDSLTLSAANSEDEGQIRYFLPDRDEGMMEEGKLDASCAVAIEEAIQLYEEQLKAQAGGTNE

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 : 368 -6307 -17.14 -65.70 target 2D structure prediction score : 0.48 Monomeric hydrophicity matching model chain A : 0.70 3D Compatibility (PKB) : -17.14 2D Compatibility (Sec. Struct. Predict.) : 0.48 1D Compatibility (Hydrophobicity) : 0.70 QMean score : -0.006

(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: