Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MDQLQIKDLEMFAYHGLFPSEKELGQKFIVSAILSYDMTKAATDLDLTASVHYGELCQQWTTWFQETSEDLIETVAYKLVERTFESYPLVQEMKLELKKPWAPVHLSLDTCSVTIHRRKQRAFIALGSNMGDKQANLKQAIDKLRAR-GIHILKESSVLATEPWGGVEQDS--FANQVVEVETWLPAQDLLETLLAIESELGRVREVHWGPRLIDLDLLFVEDQILYTDDLILPHPYIAERLFVLESLQEIAPHFIHPILKQPIRNLYDALKK 3MCN Chain:B ((25-183)) --------------------------------------------------------------------------------------------------------------------------IIGIGTNSGFTIENIHLAITALESQQNIRIIRKASLYSSKA--------IRFLNTAVKISSSLKPDELLVLLKDIELKIGR-------PRVIDLDILAAEDLILETDKLTIPHKELINRSFALAPLLELSKGWHHP---------------

General information: TITO was launched using: RESULT: Template: 3MCN.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 : 553 -8063 -14.58 -68.33 target 2D structure prediction score : 0.63 Monomeric hydrophicity matching model chain B : 0.64 3D Compatibility (PKB) : -14.58 2D Compatibility (Sec. Struct. Predict.) : 0.63 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.688

(partial model without unconserved sides chains): PDB file : Tito_3MCN.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3MCN-query.scw PDB file : Tito_Scwrl_3MCN.pdb: