Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRGLYLITNDDPIQLLLEKLDAALATRQIAILQYRRKKIDKAEQPAEV---EQIKQLCEKYQIPFVINDDLKLAAQFGL-GVHLGQSDGEITDAKSQLPEGVIIGRTCLNSLELAQKAIADGATYVAFGAVYATATKPEAGNV-GIEVIKQAAAQ-YDLPICAIGGLTVENSKPVIEAGADLCAVISDILGRSTAEIPARVQAWAQLFS 2TPS Chain:B ((29-209)) -------TKADPVTVVQKALKGGAT-----LYQFREKGGDALTGEARIKFAEKAQAACREAGVPFIVNDDVELALNLKADGIHIGQEDANAKEVRAAIGD-MILGVSAHTMSEVKQ-AEEDGADYVGLGPIYPTETKKDTRAVQGVSLIEAVRRQGISIPIVGIGGITIDNAAPVIQAGADGVSMISAI---SQAEDP-----------

General information: TITO was launched using: RESULT: Template: 2TPS.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 : 786 10257 13.05 58.61 target 2D structure prediction score : 0.63 Monomeric hydrophicity matching model chain B : 0.78 3D Compatibility (PKB) : 13.05 2D Compatibility (Sec. Struct. Predict.) : 0.63 1D Compatibility (Hydrophobicity) : 0.78 QMean score : 0.579

(partial model without unconserved sides chains): PDB file : Tito_2TPS.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2TPS-query.scw PDB file : Tito_Scwrl_2TPS.pdb: