Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MMNSSTEQIISNSLSLRLKQETAAEHERMHQ---LMSEAKVFSSKEKYAQFTLSQYYFQLEIEHLFEKEGVAGLIPDL---DIRGRSKQALADLNDLG---------IQPNGQQLQSENVQLPE-----ALGWIYVSEGSTL-GAAFLFKEAQKHLGFSETFAARNLAAYP--EGRAKVWKRFVKALDEAGFDQTQQDRVVQGALDAFGYFGQALDQLDELK-- 1N45 Chain:A ((10-223)) ----------PQDLSEALKEATKEVHTQAENAEFMRNFQKGQVTRDGFKLVMASLYHIYVALEEEIERNKESPVFAPVYFPEELHRKAALEQDLAFWYGPRWQEVIPYTPAMQRYVKRLHEVGRTEPELLVAHAYTRYLGDLSGGQVLKKIAQKALDLPSSGEGLAFFTFPNIASATKFKQLYRSRMNSLEMTPAVRQRVIEEAKTAFLLNIQLFEELQELLTH

General information: TITO was launched using: RESULT: Template: 1N45.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 : 668 26596 39.81 140.72 target 2D structure prediction score : 0.70 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : 39.81 2D Compatibility (Sec. Struct. Predict.) : 0.70 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.437

(partial model without unconserved sides chains): PDB file : Tito_1N45.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1N45-query.scw PDB file : Tito_Scwrl_1N45.pdb: