Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ----------------MDKQRIFEVLITNICEVLPELDGHRFEPEDQLVELGADSVDRAEIITMVLEDLSLKIPRIELSGVKNIGELAEVLYDKVQSA-- 2LIU Chain:A ((1936-2034)) SGLVPRGSHMTPQVNQVNLSEIKQVLKQQLAEAL-YTEESEIAEDQKFVDLGLDSIVGVEWTTTINQTYNLNLKATKLYDYPTLLELSGYIAQILSSQGT

General information: TITO was launched using: RESULT: Template: 2LIU.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 : 293 -47697 -162.79 -588.85 target 2D structure prediction score : 0.70 Monomeric hydrophicity matching model chain A : 0.71 3D Compatibility (PKB) : -162.79 2D Compatibility (Sec. Struct. Predict.) : 0.70 1D Compatibility (Hydrophobicity) : 0.71 QMean score : 0.684

(partial model without unconserved sides chains): PDB file : Tito_2LIU.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2LIU-query.scw PDB file : Tito_Scwrl_2LIU.pdb: