Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MIINSAQLDQLIDLRDRSELHDILDMMIDQFSDDPFAVKLVIFYDKILFHMQAPIKKICVHFETKQWRNKMVATVTLYLTFTLILDLGIYLFFSKQLLVKNSFGCIALMVVTLLLPIPKVSFPYLVGLLLMFLFYFTTKNLFISCLISNLFFAITGLSFFLVFDLMDYLGKRHLGTASFFALLIAFIFYLLVKSIDKQTRFLNLLFTYPTEHYFGGICILLSWGVIYLVLGSVHFRSSNYLLLSLLSIVISFFSLFFSIMLISFQVKERQHQESLQLYQINEEYYHHLEEFKHDYKSLLFSLKITLQENKKETLEFLEILEDHSAAIFEKPQIQQLTNIVSPAVRGVFLKFLEKAESEKIPIQVVIPVEVKTIPIDLVVFIRCLSIFISNAFDHRVADQSPITINLLEEKEGSRFSIANKANPTNLTLSEMVKRGKTSKKNGGLGLYSAKKMLDVYENAELKIEFSKQNHYFFVEMYLASRKSKSAY 4IC4 Chain:A ((625-996)) --------------KSVTRRNDIPEAAASPPSLLSFLRKNV---GKDLSSIAMPVTS--------------------------------NEPISILQLISETFEYAPLLTKATQRP-DPITFVSAFAISFLSIYRDKTRTL------RKPFNPLLAETFELIREDMG--------------------FRLISEKVSHRPP----VFAFFAEH--------LDWECSYTVTPSQKFWGKSIELNNEGILRLKFKTTGELFEWTQPTTILKNLIAGERYMEPVNEFEVHSS--KGDKSHILFD----------KAGMFSGRSEGFKVSIIPPPS----SNRKKETLAGKWTQSLANETTHETIWEVGDLVSNPKKKYGFTKFTANLNEITEIEKGNLPPTDSRLRPDIRAYEEGN----VDKAEEWKLKLEQLQRERRNKGQD------VEPKYFEKVSKNEWKYITGPKS-YWERRKKHDWSDISQLW

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 : 2042 -135326 -66.27 -363.78 target 2D structure prediction score : 0.32 Monomeric hydrophicity matching model chain A : 0.58 3D Compatibility (PKB) : -66.27 2D Compatibility (Sec. Struct. Predict.) : 0.32 1D Compatibility (Hydrophobicity) : 0.58 QMean score : 0.113

(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: