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:A ((32-321)) -------------DPRWELPRDRLVLGKPLGEGCFGQ-VVLAEAIGLDKDKPNRVTKVAVKMLKSDATEKDLSDLISEMEMMKMIGKH--KNIINLLGACTQ------DGPLYVIVEYASKGNLREYLQARRPPGLEEQLSSKDLVSCAYQVARGMEYLASKKCIHRDLAARNVLVTEDNVMKIADFGLARD---IDYYKKTTNGRLPVKWMAPEALFDRIYTHQSDVWSFGVLLWEIFTLGGSPYPGVPVEELFKLLKEGHRMDKPSNCTNELYMMMRDCWHAVPSQRPT-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 A - contact count / total energy / energy per contact / energy per residue : 1123 6372 5.67 25.49 target 2D structure prediction score : 0.62 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : 5.67 2D Compatibility (Sec. Struct. Predict.) : 0.62 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.386

(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: