Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MAVKDFMTRKVVYISPDTTVSHAADLMREQELHRLPVIENDQLVGLVTEGTIAQASPSKATSLSIYEMNYLLNKTKVKDVMIRDVVTVSGYASLEDATYLMLKNKIGILPVVDNHQVYGVITDRDVFQAFLEIAGYGEEGIRVRFVTEDEVGVLGKIVSLIVEENLNISHTVNIPRKDGKVIIEVQIDGSIDLPALKEKFEANGIQVEEIVRTSAKVL 5AWE Chain:A ((1-208)) MLVRDWMTKDPVVVAPDTPVLEAIRLLKEKGFRRLPVMEGGRLVGLVTDKDLKDAMP-----LSVWEMNYLLAKLTVREVMARPVVTVEADAPLEKAALLMEERKIGGLPVMEGERLVGIITVTDVLRAFIEVLGLKLGGLRITVDIPDVPGALAQMAQAVP--PANIVSIATAAHLPGYQRLVMRVVG-EDVEGVPKRLEAAGERVVDVR-------

General information: TITO was launched using: RESULT: Template: 5AWE.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 : 899 -5435 -6.05 -26.90 target 2D structure prediction score : 0.64 Monomeric hydrophicity matching model chain A : 0.80 3D Compatibility (PKB) : -6.05 2D Compatibility (Sec. Struct. Predict.) : 0.64 1D Compatibility (Hydrophobicity) : 0.80 QMean score : 0.140

(partial model without unconserved sides chains): PDB file : Tito_5AWE.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5AWE-query.scw PDB file : Tito_Scwrl_5AWE.pdb: