Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKILVLAVHPHM---ETSVVNKAWAEELSKHDNITVRDLYKEYPDEAIDVAKEQQLCEEYDRIVFQFPLYWYSSPPLLKKWQDLVLTYGWAFGSEGNALHGKELMLAVSTGSEAEKYQAGGANHYSISELLKPFQATSNLIGMKYLPPYVFYGVNYAAAEDISHSAKRLAEYIQQPFV 3HA2 Chain:A ((1-167)) MQTLIIVAHPELARSNTQPFFKAAIENFS---NVTWHPLVA-----DFNVEQEQSLLLQNDRIILEFPLYWYSAPALLKQWMDTVMTTKFATGH-QYALEGKELGIVVSTGDNGNAFQAGAAEKFTISELMRPFEAFANKTKMMYLPILAVHQFLYLEPDAQQRLLVAYQQYATNV--

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 A - contact count / total energy / energy per contact / energy per residue : 714 -64188 -89.90 -391.39 target 2D structure prediction score : 0.65 Monomeric hydrophicity matching model chain A : 0.80 3D Compatibility (PKB) : -89.90 2D Compatibility (Sec. Struct. Predict.) : 0.65 1D Compatibility (Hydrophobicity) : 0.80 QMean score : 0.573

(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: