Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MIDVIISTSRNPRHARSKPAFPVVYSTLSPQALVEQVLSNYSIE-PITNCLLWNRG-LSDVYLVETEQEYYVLRVSHHHWR-SRLDI-EFELELLDFLYQNSLPVAYPLRTRADDLFVTVEALEGDRYAALFPYAKGTVPL-GDLTIAQSEIFGRSLAKLHQIGTKFRPSHHSLILEKLTNKTLSLEYLLDHSLTTIAPF-L---EERPEDLKYLRDNITQIKAELKILPRQSPLWTACWGDPHSGNIHFTE--DNQITLFDFDQCGYGWRAFDIAKFLQVSLR-----------AGMNRKIRDAFFEGYQT--VQKLTSEEEDCLQALTQTAHIWAWAININASVIHCWSRLDYRYFSKRLETLKRLNSPDWQLF 4OCV Chain:A ((24-319)) -----------------------------TNEALFDVASHFALEGTVDSIEPYGDGHINTTYLVTTDGPRYILQRMNTGIFPDTVNLMRNVELVTSTLKAQGKETLDIVRTTSGDTWAEI----DGGAWRVYKFIEHTMSYNLVPNPDVFREAGRAFGDFQNFLSGFDANQLTETIAHFH----DTPHRFEDFKKALAADELGRAAGCGPEIEFYLSHADQYAVVMDGLRDGSIPLRVTHNDTKLNNILMDATTGKARAIIDLDTIMPGSMLFDFGDSIRFGASTALEDERDLDKVHFSTELFRAYTEGFVGELRDSITAREAELLPFSGNLL-------------------------------------------

General information: TITO was launched using: RESULT: Template: 4OCV.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 : 1161 -9306 -8.02 -34.21 target 2D structure prediction score : 0.63 Monomeric hydrophicity matching model chain A : 0.65 3D Compatibility (PKB) : -8.02 2D Compatibility (Sec. Struct. Predict.) : 0.63 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.398

(partial model without unconserved sides chains): PDB file : Tito_4OCV.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4ocv-query.scw PDB file : Tito_Scwrl_4OCV.pdb: