Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRYRIHYIDVQNALQNYIWILEDTETHEAVAVDPTEAELVTHFCQEHQLTLKQIWLTHWHKDHIGGVADLTANTP-MAVYGPRDELSKIPGITHPLQHDDHLKFNDLKVEIIATPGHTLGHIVYFIEELNALFCGDTLFAMGCGRLFEGTAEQMYHSLNRLAALPTATKVYCTHEYTLSNAEFALSVEPENHALQERAEQVRMLRQEGKITLPSSIELELATNPFLRAESVD----------------EFAHLRSLKDNF 2QED Chain:A ((19-258)) ---------------NYIWVLTNDEGR-CVIVDPGEAAPVLKAIAEHKWMPEAIFLTHHHHDHVGGVKELLQHFPQMTVYGPAETQDK--GATHLVGDGDTIRVLGEKFTLFATPGHTLGHVCYFSRPY--LFCGDTLFSGGCGRLFEGTPSQMYQSLMKINSLPDDTLICCAHEYTLANIKFALSILPHDSFINEYYRKVKELRVKKQMTLPVILKNERKINLFLRTEDIDLINEINKETILQQPEARFAWLRSKKDTF

General information: TITO was launched using: RESULT: Template: 2QED.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 : 1268 -85918 -67.76 -385.28 target 2D structure prediction score : 0.54 Monomeric hydrophicity matching model chain A : 0.79 3D Compatibility (PKB) : -67.76 2D Compatibility (Sec. Struct. Predict.) : 0.54 1D Compatibility (Hydrophobicity) : 0.79 QMean score : 0.569

(partial model without unconserved sides chains): PDB file : Tito_2QED.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2QED-query.scw PDB file : Tito_Scwrl_2QED.pdb: