Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence --------------------MEMSFIAQDFEKLDIITVLEGRTQAIIRNHFLRYD----RVVRCRVKIITMDMFSPYYDLARQLFPCAK--------------------IVLDRFH---IVQHLSRAMSRVRVQIMNQLDRKSHEYKAIKRYW----------------KLIQQDSRKLS-------------DKHFYRPTFRMHL-TNKEILD--------KLLSYSQDLKHHYQLYQLLLFHFQNKEPEKFFGLIEDNLKQVHPLFQTVFKTFLKDKEKIVNALQLPYSNAKLEATNNLIKLIKRNAFGFR--------------NFENFKKRIFIALNIKKERTKFVLSRA---------------------- 2B78 Chain:A ((1-385)) MIKLMVGSFAEKKLKRGVQLLSSRDYPNLNLDNQVVQLYSDADIFLGTAYLSKQNKGVGWLISPKKVSLNVTYFIKLFQWSKDKRKNFAHSKLTTAYRLFNQDGDSFGGVTIDCYGDFVLFSWYNSFVYQIRDEIVAAFRQVYPNFLGAYEKIRFNVSAHLYGQEAPEQFLILENGISYNVFLNDGLMTGIFLDQRQVRNELINGSAAGKTVLNLFSYTAAFSVAAAMGGAMATTSVDLAKRSRALSLAHFEANHLDMANHQLVVMDVFDYFKYARRHHLTYDIIIIDPPSFEVFSVSKDYHKLIRQGLEILSENGLIIASTNAANMTVSQFKKQIEKGFGKQKHTYLDLQQLPSDFAVNVQDESSNYLKVFTIKV

General information: TITO was launched using: RESULT: Template: 2B78.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 : 1298 -7913 -6.10 -31.03 target 2D structure prediction score : 0.37 Monomeric hydrophicity matching model chain A : 0.56 3D Compatibility (PKB) : -6.10 2D Compatibility (Sec. Struct. Predict.) : 0.37 1D Compatibility (Hydrophobicity) : 0.56 QMean score : 0.183

(partial model without unconserved sides chains): PDB file : Tito_2B78.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2B78-query.scw PDB file : Tito_Scwrl_2B78.pdb: