Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKKRNNSQNLIMLKHDFASHIEDLKCATKPRSEALGRHLWTCTI---------DADFYWLKFHLPNVHAQSEQDFLHELQFYEDI-TYKKANWLLPFKIIEGRTISQQTQFQGKVLV--LPDTECWFDDLDQ-------KQNLKNINEKIYLALVKLAELHELGWIHGDIKKEHFRKFK-QELYLIDFEKTRLISSP-----DPITDATPRYMAPELFHGANKTVQSDLYALGIVLYEWLT-QTRLQANSYHEWAVLHC-QKLNVELPSSF-QIFLPLLSGLLQKQQQNRFSNVHEAINCLKALST 2PSQ Chain:A ((72-362)) ------------EDPKWEFPRDKLTLGKPLGEGCFGQ-VVMAEAVGIDKDKPKEAVTVAVKMLKDDATEKDLSDLVSEMEMMKMIGKH--KNIINLLGACTQ--------DGPLYVIVEYASKGNLREYLRARRPPPEEQMTFKDLVSCTYQLARGMEYLASQKCIHRDLAARNVLVTENNVMKIADFGLARDINNIDYYKKTTNGRLPVKWMAPEALFDRVYTHQSDVWSFGVLMWEIFTLGGSPYPGIPVEELFKLLKEGHRMDKPANCTNELYMMMRDCWHAVPSQRPT-FKQLVEDLDRI--

General information: TITO was launched using: RESULT: Template: 2PSQ.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 : 1169 -8412 -7.20 -33.38 target 2D structure prediction score : 0.58 Monomeric hydrophicity matching model chain A : 0.67 3D Compatibility (PKB) : -7.20 2D Compatibility (Sec. Struct. Predict.) : 0.58 1D Compatibility (Hydrophobicity) : 0.67 QMean score : 0.409

(partial model without unconserved sides chains): PDB file : Tito_2PSQ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2PSQ-query.scw PDB file : Tito_Scwrl_2PSQ.pdb: