Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKLYYSPGACSLAAHIILNEINVDFDLERVNLKTHKTEKGADYYEINPKGYVPALEINPGLILTENVAILPFLAQHDPKQD-LIPPSG-LGRAKVLEWLGYLNSELHDAYAVFFGAPLTNDEKTKAYAEIDRLLKYIDNYLAESDYDYLVNDNFGPADAYLFVLTNWSNSIEHDLTPYKHIIALRNKVAERQSVQIAMRDEGLIS 4KGI Chain:B ((23-221)) MKLFYKPGACSLASHITLRESGKDFTLVSVDLMKKRLENGDDYFSVNPKGQVPALLLDDGTLLTEGVAIMQYLADSVPDRQLLAPV-NSISRYKTIEWLNYIATELHKGFTPLFRPDTPEEYKPTVRAQLDKKLQYVNEALK--DEHWICGQRFTIADAYLFTVLRWAYAVKLNLEGLEHIAAFMQRMAERPEVQDALSAEG---

General information: TITO was launched using: RESULT: Template: 4KGI.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 : 877 -44662 -50.93 -226.71 target 2D structure prediction score : 0.64 Monomeric hydrophicity matching model chain B : 0.81 3D Compatibility (PKB) : -50.93 2D Compatibility (Sec. Struct. Predict.) : 0.64 1D Compatibility (Hydrophobicity) : 0.81 QMean score : 0.588

(partial model without unconserved sides chains): PDB file : Tito_4KGI.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4KGI-query.scw PDB file : Tito_Scwrl_4KGI.pdb: