Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ----MVNGI--------YTKSFLER--------IQEELPEWQRI-AFELLAETLGDDADTFPCIPGR--QAFLTDQLRIAFAGDPRENRTA--EELAPLLAEYGKISRDT----------GKYASLVVLFDTPEDLAEHYSIEAYEELFWRFLNRLSHQDEKEWPEDIPADPEHYKW---------------------EFCFD---GEPYFILCATPGHEARRSRSFPFFMV----------TFQPRW------------VF---------DDLNGSTAFGRNM---------------SRLIRSRLEAYDQAPIHPQLGWYGGKDNREWKQYFLRDDE-----KQVSKCPFSYL---KNMFNKMK----------- 4IC4 Chain:A ((625-996)) KSVTRRNDIPEAAASPPSLLSFLRKNVGKDLSSIAMPVTSNEPISILQLISETF-EYAPLLTKATQRPDPITFVSAFAISFLSIYRDKTRTLRKPFNPLLAETFELIREDMGFRLISEKVSHRPPVFAFFAEHLDWECSYTVTPSQKFWGK---SIELNNEGILRLKFKTTGELFEWTQPTTILKNLIAGERYMEPVNEFEVHSSKGDKSHILFDKAGMFSGRSEGFKVSIIPPPSSNRKKETLAGKWTQSLANETTHETIWEVGDLVSNPKKKYGFTKFTANLNEITEIEKGNLPPTDSRL-RPDIRAYEEGNVDKAEEWKLKLEQLQRERRNKGQDVEPKYFEKVSKNEWKYITGPKSYWERRKKHDWSDISQLW

General information: TITO was launched using: RESULT: Template: 4IC4.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 : 1047 -46408 -44.32 -187.13 target 2D structure prediction score : 0.38 Monomeric hydrophicity matching model chain A : 0.68 3D Compatibility (PKB) : -44.32 2D Compatibility (Sec. Struct. Predict.) : 0.38 1D Compatibility (Hydrophobicity) : 0.68 QMean score : 0.110

(partial model without unconserved sides chains): PDB file : Tito_4IC4.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4IC4-query.scw PDB file : Tito_Scwrl_4IC4.pdb: