Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MPLRKMKIPFLLLFFLWEAESHAASRPNIILVMADDLGIGDPGCYGNKTIRTPNIDRLASGGVKLTQHLAASPLCTPSRAAFMTGRYPVRSGMASWSRTGVFLFTASSGGLPTDEITFAKLLKDQGYSTALIGKWHLGMSCHSKTDFCHHPLHHGFNYFYGISLTNLRDCKPGEGSVFTTGFKRLVFLPLQIVGVTLLTLAALNCLGLLHVPLGVFFSLLFLAALILTLFLGFLHYFRPLNCFMMRNYEIIQQPMSYDNLTQ---RLTVEAAQFIQ----RNTETPFLLVLSYLHVHTALFSSKDFAG-------------------------------------------KSQHGVYGDAVEEMDWSVGQILNLLDELRLANDTLIYFTSDQGAHVEEVSSKGEIHGGSNGIYKGGKANNWEGGIRVPGILRWPRVIQAGQKIDEPTSNMDIFPTVAKLAGAPLPE-DRIIDGRDLMPLLEGKSQRSDHEFLFHYCN----AYLNAVRWHPQNSTSIWKAFFFTPNFNPVGSNGCFATHVCFCFGSYVTHHDPPLLFDISKDPRERNPLTPASEP-RFYEILKVMQEAADRHTQTLPEVPDQFSWNNFLWKPWLQLCCPSTGLSCQCDREKQDKRLSR 4UG4 Chain:G ((7-449)) ------------------------GKPNILIIMVDQLNGKLFPDGPADFLHAPNLKALAKRSARFHNNYTSSPLCAPARASFMAGQLPSRTRVYDNAA-----------EYQSSIPTYAHHLRRAGYYTALSGKMHFVGPD----------QLHGFEERLTTDIYPADFGWT---PDYRK-------------------------------PG-----------ERIDWWYHNLG-------SVTGAG-VAEIT-NQMEYDDEVAFLANQKLYQLSRENDDESRRPWCLTVSFTHPHDPYVARRKFWDLYEDCEHLTPEVGAIPLDEQDPHSQRIMLSCDYQNFDVTEENVRRSRRAYFANISYLDEKVGELIDTLTRTRMLDDTLILFCSDHGDMLGERGL-------------WFKMNFFEGSARVPLMIAGPGIA-PG-LHLTPTSNLDVTPTLADLAGISLEEVRPWTDGVSLVPMVNGVER--TEPVLMEYAAEASYAPLVAI------REGKWKYVYC--------------------------ALDPEQLFDLEADPLELTNLAENPRGPVDQATLTAFRDMRA------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4UG4.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 : 2420 -44711 -18.48 -115.53 target 2D structure prediction score : 0.58 Monomeric hydrophicity matching model chain G : 0.65 3D Compatibility (PKB) : -18.48 2D Compatibility (Sec. Struct. Predict.) : 0.58 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.467

(partial model without unconserved sides chains): PDB file : Tito_4UG4.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4UG4-query.scw PDB file : Tito_Scwrl_4UG4.pdb: