Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MAFPHHTEHHAIQRSGWLRASVLGANDGIISVTSLIMGMAASGASSHTLFITCVAGLISGATSMAAG---EYISVKSQEDIEKSDLAIEAKELKKYPQKELDELTQIYISRGLSKELAKEVAIQLTTHDALGAHARDEIGIHENTAANPIQAALSSAASFSFGAFFPMLAILFSPEHLIMPSVLITGIAALAILGALSSYFAGTSKIKGSLRITLWGILAMAFSSWIGSLFNVTPL 2KPO Chain:A ((1-110)) -------------------------------------------MLLYVLIISNDKKLIEEARKMAEKANLELRTVKTEDELKKYLEEFRKESQNIKVLILVSNDEELDKAKELAQKMEIDVRTRKVTSPDEAKRWIKEFSEEGGSLEHHHHHH-----------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 2KPO.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 : 458 15075 32.91 140.88 target 2D structure prediction score : 0.38 Monomeric hydrophicity matching model chain A : 0.49 3D Compatibility (PKB) : 32.91 2D Compatibility (Sec. Struct. Predict.) : 0.38 1D Compatibility (Hydrophobicity) : 0.49 QMean score : 0.200

(partial model without unconserved sides chains): PDB file : Tito_2KPO.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2KPO-query.scw PDB file : Tito_Scwrl_2KPO.pdb: