Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKHTFVLFLSLILLVLPGCSAEKSSADTAKKTLTIYSTMSTDSERDTFRKLAAAFEKEHSDIHVSLHFPGNDYENMMRVRMAANDLPDLFDTHGWGKIRYGEYTADLRDMKWTQDLDPNLNSILKNKSGKVYAYPINQAKDGLAYNRNILDRYGIAPPETMDDFIKALRTIKEKSKG--SIVPFWFAGYDKSSFAQYYDQFATPLLITDPAHNEKKQLIN---G----TFQW-S-KFTYLSEILKQMQKEKLINIDAVTAKKSQLIELMAQNKIAFTMQGGTLGQDVAQINPNVKVGIIPTPAIHPGDDPIWIGGERYTLAAWKDSPQLKEAKDFIAFMARPANAKQMAEATSLPSGL-TNVKA-DIFYANDYEYYQDVKVEPY---FDRLYLPNGMWD-VLGTVGQELAADILAPQDISQKLGREYKRLREQSETQGAENNE 4R6H Chain:A ((28-421)) -------------------------ADTAKKTLTIYSTMSTDSERDTFRKLAAAFEKEHSDIHVSLHFPGNDYENMMRVRMAANDLPDLFDTHGWGKIRYGEYTADLRDMKWTQDLDPNLNSILKNKSGKVYAYPINQAKDGLAYNRNILDRYGIAPPETMDDFIKALRTIK-E-KSKGSIVPFWFAGYDKSSFA----QYYDQ-----FATPLLITDPAHNEKKQLINGTFQWSKFTYLSEILKQMQKEKLINIDAVTAKKSQLIELMAQNKIAFTMQGGTLGQDVAQINPNVKVGIIPTPAIHPGDDPIWIGGERYTLAAWKDSPQLKEAKDFIAFMARPANAKQMAEATS-LPSGLTNVKADIF-YA---NDYEYYQDVKVEPYFDRLYLPN-GMWDVLGTVGQELAADILAPQDISQKLGREYKRLREQSET-------

General information: TITO was launched using: RESULT: Template: 4R6H.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 : 2016 6156 3.05 16.33 target 2D structure prediction score : 0.72 Monomeric hydrophicity matching model chain A : 0.88 3D Compatibility (PKB) : 3.05 2D Compatibility (Sec. Struct. Predict.) : 0.72 1D Compatibility (Hydrophobicity) : 0.88 QMean score : 0.550

(partial model without unconserved sides chains): PDB file : Tito_4R6H.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4R6H-query.scw PDB file : Tito_Scwrl_4R6H.pdb: