Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKMTSRKLSDILKQRLQHENRSFLFDREKDTLRVEDQTTKKGITLDLPPIIAKWELKKDEAIDEIVYYVSEAMTAMEGKAQEMTGKETRIYPVIRSTSFPDKSSEDIPLIYDDHTAETRIYYALDLGKTYRLIDQRMLEKENW---------------TKERIRETAAFNLRSLPT---------VVKEDTVAGNYF------------------YFFRANDGYDASRILN--EAILNEYKQHAEGELAIS--------VPHQDVLILADIRNESGYDILGQMS--------MSFFAGGTVPITA--------LSFLYNEGKLEPVFILAKS---RPKKD 4R1D Chain:B ((1-301)) MDKTG--------------WITHCFGR---------------FLIDLPP---------DAVINAGYYLWGDRIEYLDDKPTELAARVDRLEQEWRTQRHKSKGNMFLRKIDFGNESVGLLSWSSEVASKTYLLDTYVTSKPTWHVYRWKGKVSVDREQHAVEISRALARNLRSRAPKEIPSEPGFCIDHAYIAGDSFQVERFGVGVTFPEHPGARFEFRSSTGAELNSLLERVDGFVQNMLSTFAGMETLRKGKHPVGSLPGEEYLVAGSDKGQRGYTFMWEVQGKEESLTEPNLTAGLAVLERSNENGKPPPPAFKSDKEALELWDTIVDSIRVRPTS-

General information: TITO was launched using: RESULT: Template: 4R1D.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 931 -11019 -11.84 -47.91 target 2D structure prediction score : 0.45 Monomeric hydrophicity matching model chain B : 0.69 3D Compatibility (PKB) : -11.84 2D Compatibility (Sec. Struct. Predict.) : 0.45 1D Compatibility (Hydrophobicity) : 0.69 QMean score : 0.148

(partial model without unconserved sides chains): PDB file : Tito_4R1D.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4R1D-query.scw PDB file : Tito_Scwrl_4R1D.pdb: