Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MPNTIFLQRVADLYDTFKQHDSQQSDRLQRYRNIEVESAQLISQLIRMQQAKSILEIGTSTGYSTLWLAEAAQATGGQVITVEIDAKRSAEAKRHVAELELSEIVQFWVGDAADYLKA--AQEKFDFILLDAERDAYENYWPDLKRLMKPKGGVLVVDNVISHA------------AEVNRFIALIKKDPDYMSSIL-PVG----AGLCLVVTK 3TFW Chain:B ((45-223)) ---------------------------------VAANQGQFLALLVRLTQAKRILEIGTLGGYSTIWMARELPA-DGQLLTLEADAHHAQVARENLQLAGVDQRVTLREGPALQSLESLGECPAFDLIFIDADKPNNPHYLRWALRYSRPG-TLIIGDNVVRDGEVVNPQSADERVQGVRQFIEMMGAEPRLTATALQTVGTKGWDGFTLAWVN

General information: TITO was launched using: RESULT: Template: 3TFW.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 : 750 -42758 -57.01 -267.23 target 2D structure prediction score : 0.56 Monomeric hydrophicity matching model chain B : 0.75 3D Compatibility (PKB) : -57.01 2D Compatibility (Sec. Struct. Predict.) : 0.56 1D Compatibility (Hydrophobicity) : 0.75 QMean score : 0.611

(partial model without unconserved sides chains): PDB file : Tito_3TFW.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3TFW-query.scw PDB file : Tito_Scwrl_3TFW.pdb: