Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNKPLLLVFHPDL--S-QSKVNRALVATLKDQDKIDIVDIQKLYNGSLDIMNDGAIEAQRLISASHIILQFPIYWYSVPPIFKAWMDAVLTRMFYLFYEQEGQHIEGKPLYLHITVGNLSSAYQKLGQNGFTLDELMAPLKATARRCGLIWHPPHVIFNANQLNENDITEQTSLSLKQFEQWGIFNNNSFILVLSQKKRTSEKSEVRTML 3HA2 Chain:B ((1-161)) -MQTLIIVAHPELARSNTQPFFKAAIENFS---NVTWHPLVA--------DFNVEQEQSLLLQNDRIILEFPLYWYSAPALLKQWMDTVMTTKFATGH---QYALEGKELGIVVSTGDNGNAFQAGAAEKFTISELMRPFEAFANKTKMMYLPILAVHQFLYLEPDAQQRLLVAYQ----------------------------------

General information: TITO was launched using: RESULT: Template: 3HA2.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 : 667 -66629 -99.89 -421.70 target 2D structure prediction score : 0.55 Monomeric hydrophicity matching model chain B : 0.68 3D Compatibility (PKB) : -99.89 2D Compatibility (Sec. Struct. Predict.) : 0.55 1D Compatibility (Hydrophobicity) : 0.68 QMean score : 0.509

(partial model without unconserved sides chains): PDB file : Tito_3HA2.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3HA2-query.scw PDB file : Tito_Scwrl_3HA2.pdb: