Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MITYVFPGQGS--QQKGMGQGLFEQYQHLT-DQ---ADQIL----------------GYSIEKLCTEK----SYLDVNHTEYTQPALYVVNALSYLKRVEETGRKPD-------FAAGHSLGEYNALMAAGAFDFETGLRLVKKRGELMGR---------------------I------TGGGMAAVIGLSKEQVTAVLEEHRL-----YDIDVANENTPQQIVISGPKKEIEKARAVFENTKD-----------------VKLFHPLNVSGAFHSRYMNEAKQVFKQYID--SFQF--APLAIPVISNVYAEPYHQ--DRLKDTLSEQ-MDNTVKWTDSIRFLMGRGEMEFAEIGPGTV--LTGLIHRIKNEAEPLTYIPKKNPAISAH-LK-----EQ-------RNVQAGI----------TAESLGSAEFKQDYHLTYAYLAGGMYRGIASKEMVVKLSRAGMMGFFGTGGL-SLKEVEDAIHAIQGELGKGQAYGINLVHNMKHT-ESEEKMIDLLLRNQVS--IVEASAFLSVTPVLVR-YRAKGVKRNQNGDVICSNRLIAK-ISRPEVAESFLSPAPENMLQKLLGENKITMNEAELLRCIPMAD---DICVEA-DSGGHTDG----GVAYSLMPAMTSLRDEMMKKYQYRKKIRVGAAGGIGTPEAAMAAFM-----------LGADFILTGSINQCTVEAATSDKVKDLLQQMN-VQDTAYAPAG--------D-MFESGSKVQVLKKGVFFPARANKLYELYQRYGSIRELDAKMLAQLEEKYFKRSIEDIYKDIALHYPAADIEKAEQNPKHKMALIFRWYFRYSSKLAISGSEHSKVDYQIHCGPALGAFNQWVKGSQLENWRNRHVDEIGKKLMTETAVLLHERMQSMYQPSHETDNIKIKV 2UV8 Chain:G ((152-865)) -LVAIFGGQGNTDDYFEELRDLYQTYHVLVGDLIKFSAETLSELIRTTLDAEKVFTQGLNILEWLENPSNTPDKDYLLSIPISCPLIGVIQLAHYVVTAKLLGFTPGELRSYLKGATGHSQGLVTAVAIAETDSWESFFVSVRKAITVLFFIGVRCYEAYPNTSLPPSILEDSLENNEGVPSPMLSISNLTQEQVQDYVNKTNSHLPAGKQVEISLVNGAKNLVVSGPPQSLYGLNLTLR-KAKAPSGLDQSRIPFSERKLKFSNRFLPVASPFHSHLLVPASDLINKDLVKNNVSFNAKDIQIPVYDTFDGSDLRVLSGSISERIVDCIIRLPVKWETTTQF----KATHILDFGPGGASGLGVLTHRNKDGTGVRVIVAGTLDINPDDDYGFKQEIFDVTSNGLKKNPNWLEEYHPKLIKNKSGKIFVETKFSKLIGRP-PLLVPGMTPCTVSPDFVAATTNAGYTIELAGGGYFSAAGMTAAIDSVVSQIEKGSTFGINLIYVNPFMLQWGIPLIKELRSKGYPIQFLTIGAGVPSLEVASEYIETLGLK------------YLGLKPGSIDAISQVINIA-----------------------K-AHPNFPIALQWTGGRGGGHHSFEDAHTPMLQMYSKIRR-----------HPNIMLIFGSGFGSADDTYPYLTGEWSTKFDYPPMPFDGFLFGSRVMIAKEVKTSPDAKKCIAACTGVPDDKWEQTYKKPTGGIVTVRSEMGEPIHKIAT---------RGVMLWKEFD-------------------------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 2UV8.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain G - contact count / total energy / energy per contact / energy per residue : 2880 -263497 -91.49 -466.37 target 2D structure prediction score : 0.66 Monomeric hydrophicity matching model chain G : 0.65 3D Compatibility (PKB) : -91.49 2D Compatibility (Sec. Struct. Predict.) : 0.66 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.344

(partial model without unconserved sides chains): PDB file : Tito_2UV8.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2UV8-query.scw PDB file : Tito_Scwrl_2UV8.pdb: