Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ----MSMIDIL-QLEGVQPIDYRNEDGCIMITVQPSG----EHLETCP-------ECGGRLYKHGQRINH--FAD---------------TPLQMQPVKIEVIRTRYRCSECKSMITSQLSFLDEKRRA--------------THRLIQQVRKRCLDRTFTQLAED--TGVVVNTIKNITLDFVEELERD---------------IKFETPTIMGIDELKLMGTYRCVITNLA------------MNSLYDMLP-----ERTQDTLIPYFAKLPDAEKVEWICSDMWRPFKKSFRLH-LPNAK--------LIIDKFHVVRMASEALDTERKALQSSLDRDARLNMKKHLRWILLRRPNSLTEDQQRILGNLEKW-HPEFKEAYDLKEQFYNIYEATTKDDAIQRFHEWESSIPKYLKSFRDVAKTVNNNFEDIFTYWDAPIRITIAYTEGHNGITRVANRMGRGYTFEVLRAKMLYNKVARSITTLKTPSSSLKSTKGYEGLTAFPTKQEKTKF----EYGAYIPTLVELYG---------GDEDLDEELT------------------------------------ 5DO7 Chain:A ((34-650)) EPHSLGILHASYSRQILKDVSLYVESGQIMCILGSSGSGKTTLLDAMSGRLGRAGTFLGEVYVNGRALRREQFQDCFSYVLQSDTLLSSLTVRETLHYTALLAIRRGNPGSFQKKVEAVMAELSLSHVADRLIGNYSLGGISTGERRRVSIAAQLLQDPKVMLFDEPTTGLDCMTANQIVVLLVELARRNRIVVLTIHQPRSELFQLFDKIAILSFGELIFCGTPAEMLDFFNDCGYPCPEHSNPFDFYMDLTSVDTQSKEREIETSKRVQMIESAYKKSAICHKTLKNIERMKHLKTLPMVPFKTKDSPGVFSKLGVLLRRVTRNLVRNKLAVITRLLQNLIMGLFL-LFFVLRVRSNVLKGAIQDRVGLLYQFVGATPYTGMLNAVNLFPVLRAVSDQESQDGLYQKWQMMLAYALHVLPFSVVATMIFSSVC-YWTLGLHPEVARFGYFSAALLAPHLIGEFLTLVLLGIVQ-NPNIVNSVVALLSIAGVLVGSGFLRNIQEMPIPFKIISYFTFQKYCSEILVVNEFYGLNFTCAFTQGIQFIEKTCPGATSRFTMNFLILYSFIPALVILGIVVFKIRDHLIS

General information: TITO was launched using: RESULT: Template: 5DO7.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 : 2098 2745 1.31 6.17 target 2D structure prediction score : 0.58 Monomeric hydrophicity matching model chain A : 0.62 3D Compatibility (PKB) : 1.31 2D Compatibility (Sec. Struct. Predict.) : 0.58 1D Compatibility (Hydrophobicity) : 0.62 QMean score : 0.200

(partial model without unconserved sides chains): PDB file : Tito_5DO7.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5DO7-query.scw PDB file : Tito_Scwrl_5DO7.pdb: