Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence --MRVLVIMDPIETVNLKKDSTMAMLWAASRRGHELGYALQQDLYIDQGKAYGLISPLKVFEDYNHYYELGEKKKESIAAYDVVLMRKDPPFDMNFVYTTYVLEQAEREGSWIINKPQSLRDCNEKLFATQFPELQ----VPTLVTSQQSLIREFITEHGD--VIVKPLDGMGGMGIFRLYQDGVNIGSTLEMLTELGTRPIMAQRYIPEIVEGDKRILMVNGEPIPYCLARIPQNGEVRGNLAAGGLGQARPLTENDKLIAAKVGPFLREKGLVFVGLDVI----GNYVTEINVTSPTCIREIDAQFGTSIADDLFDVLEAGRPA 4IWX Chain:A ((19-312)) SHMKIAIL-----SRDGTLYSCKRLREAAIQRGHLVEILDPLSCYMNINPAASSIHY----------------KGRKLPHFDAVIPRIGTA---ITFYGTAALRQFEMLGSYPLNESVAIARARDKLRSMQLLARQGIDLPVTGIAHSPDDTSDLIDMVGGAPLVVKLVEGTQGIGVVLA-ETRQAAESVIDAFRGLNAH-ILVQEYIKEAQGCDIRCLVV-GDEVVAAIERRAKEGDFRSNLHRGGAASVASITPQEREIAIKAARTM---ALDVAGVDILRANRGPLVMEVN--ASPGLEGIEKTTGIDIAGKMIRWIERHATT

General information: TITO was launched using: RESULT: Template: 4IWX.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 : 1452 3905 2.69 13.85 target 2D structure prediction score : 0.50 Monomeric hydrophicity matching model chain A : 0.72 3D Compatibility (PKB) : 2.69 2D Compatibility (Sec. Struct. Predict.) : 0.50 1D Compatibility (Hydrophobicity) : 0.72 QMean score : 0.320

(partial model without unconserved sides chains): PDB file : Tito_4IWX.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4IWX-query.scw PDB file : Tito_Scwrl_4IWX.pdb: