Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MIKVLLVDDHEMVRLGVSSYLSIQEDIEVIGEAENGRQGYEKAMTLRPDVILMDLVMEEMDGIESTKAILKDWPEAKIIIVTSFIDDEKVYPAIEAGAAGYLLKTSTAHEIADAIRATQRGERVLEPEVTTKMMEKMSRRNEPVLHEELTNRENEILMLISEGKSNQEIADELFITLKTVKTHVSNILAKLEVEDRTQAAIYAFKHGLVK 4LDZ Chain:B ((5-191)) MISIFIAEDQQMLLGALGSLLNLEDDMEVVGKGTTGQDAVDFVKKRQPDVCIMDIEMPGKTGLEAAEE-LKD-TGCKIIILTTFARPGYFQRAIKAGVKGYLLKDSPSEELANAIRSVMNGKRIYAPE----LMEDLYSEANP-----LTDREKEVLELVADGKNTKEIAQELSIKSGTVRNYISMILEKLEVKNRIE------------

General information: TITO was launched using: RESULT: Template: 4LDZ.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 : 811 -90508 -111.60 -484.00 target 2D structure prediction score : 0.58 Monomeric hydrophicity matching model chain B : 0.80 3D Compatibility (PKB) : -111.60 2D Compatibility (Sec. Struct. Predict.) : 0.58 1D Compatibility (Hydrophobicity) : 0.80 QMean score : 0.443

(partial model without unconserved sides chains): PDB file : Tito_4LDZ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4LDZ-query.scw PDB file : Tito_Scwrl_4LDZ.pdb: