Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MERRIFIRLRHRVLAHPGDIITVGDAAQIEGQLQLKKKLSAMPLYQVSEKDKNIVILDIIQVLRAIHLQDPTIDVQTVGGAETIVEIQYRKRNLSTVLFIGVWLLLFIGSCLAIMNFHEDVSMRDVHIAL-YEIITG----------ERNDYPYLLQIPYSIGLGLGMIVFFNHIFKKRLNEEPSPLEVEMFNYQLDLDQYVAMHENQETIKDLHDR 3ECN Chain:A ((101-222)) ---------------------------------------------------------------------DPIDEVAALIAA-TIHDVDHPGRTNS--------FLCNAGSELAIL-YNDTAVLESHHAALAFQLTTGDDKCNIFKNMERNDYRTLRQGIIDMVLATEMTKHFEHV-NKFVNSINKPLATLEENGETDKNQEV---------------

General information: TITO was launched using: RESULT: Template: 3ECN.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 : 297 -14837 -49.96 -133.67 target 2D structure prediction score : 0.35 Monomeric hydrophicity matching model chain A : 0.62 3D Compatibility (PKB) : -49.96 2D Compatibility (Sec. Struct. Predict.) : 0.35 1D Compatibility (Hydrophobicity) : 0.62 QMean score : 0.080

(partial model without unconserved sides chains): PDB file : Tito_3ECN.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3ECN-query.scw PDB file : Tito_Scwrl_3ECN.pdb: