Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKKRNNSQNLIMLKHDFASHIEDLKCATKPRSEALGRHLWTCTI-------DADFYWLKFHLPNVHAQSEQDFLHELQFYEDI-TYKKANWLLPFKIIEGRTISQQTQFQGKVLVLPDTECWFDDLDQ---------KQNLKNINEKIYLALVKLAELHELGWIHGDIKKEHFRKFK-QELYLIDFEKTRLISSP-----DPITDATPRYMAPELFHGANKTVQSDLYALGIVLYEWLT-QTRLQANSYHE-WAVLHCQKLNVELPSS-FQIFLPLLSGLLQKQQQNRFSNVHEAINCLKALST 5A46 Chain:B ((32-321)) -------------DPRWELPRDRLVLGKPLGEGCFGQ-VVLAEAIGLDKPNRVTKVAVKMLKSDATEKDLSDLISEMEMMKMIGKH--KNIINLLGACTQ------DGPLYVIVEYASKGNLREYLQARRPPHNPEEQLSSKDLVSCAYQVARGMEYLASKKCIHRDLAARNVLVTEDNVMKIADFGLARDIHHIDYYKKTTNGRLPVKWMAPEALFDRIYTHQSDVWSFGVLLWEIFTLGGSPYPGVPVEELFKLLKEGHRMDKPSNCTNELYMMMRDCWHAVPSQRPT-FKQLVEDLDRI--

General information: TITO was launched using: RESULT: Template: 5A46.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 : 1163 19293 16.59 76.25 target 2D structure prediction score : 0.63 Monomeric hydrophicity matching model chain B : 0.67 3D Compatibility (PKB) : 16.59 2D Compatibility (Sec. Struct. Predict.) : 0.63 1D Compatibility (Hydrophobicity) : 0.67 QMean score : 0.369

(partial model without unconserved sides chains): PDB file : Tito_5A46.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5A46-query.scw PDB file : Tito_Scwrl_5A46.pdb: