Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNHVINFVLKNKFAVWLMTIIVTAAGLYAGMNMKQESIPDVNMPYLTISTTYPGATPSQVADEVTKPVEQAVQNLDGVSVVTSTSYENASSVMIEYDYEKDMDKAKTEAAEALENVNLPDDAKDPEISRYSLN-SFPILTLSVSSDKDNLQELTKQVEDSLVSKLEGIEGVASVQVSGQQVEEVEFSFKEDKLKEYGLDEDTVKQVIQGSDVTTPLGLYTFGNEEKSVVVSGDIETIKDLKNMRIPTASASSAGSSAASQAGAQSAQAAQSAQAAAQVQQSASTAVPTVKLSDIATIKDV-KKAESVSRTNGKDSIGINIVK-ANDANTVEVADDVKAELKKFKE-DHK-GFNYSATLDMAEPITQSVDTMLSKAIFGAIFAIVIILLFLRDIKSTLISVVSIPLSLLIALLVLQQLDITLNIMTLGAMTVAIGRVVDDSIVVIENIYRRMRLKDEPLRGKALVREATKEMFKPIMSSTIVTIAVFLPLALVGGQIGELFIPFALTIVFALAASLVISITLVPMLAHSLFKKSLTGAPIKAKEHKPGRLANIYKKVLNWALSHKWITSIIAVLMLLGSLFLVPLIGASYLPSEEEKTMQLTYSPEPGETKKEAENEAEKAEKILLDRKHVDTVQYSLGSGSPLAG-GDSNGALFYIK-YESDTPDFDKEKDNVLKEIQKQSD--RG-EWKS-QD-----F-SSSGNNNELTYYVYGDSENDIKDTVKDIEKIMKDEKDLKNVNSGLSSTYDEYTFVADQEKLSKLGLTASQISQALMSQTSQEPLTTVKKDGKELDVNIKTEKDEYKSVKDLENKKITSATGQEVKIGDVAKVKEGSTSDTVSKRDGKVYADVTGEVTSDNVTAVSAAIQKKIDKL-D-HPDNVSIDTGGVSADIADSFTKLGLAMLAAIAIVYLVLVITFGGALAPFAILFSLPFTVIGALVGLYVSGETISLNAMIGMLMLIGIVVTNAIVLIDRVIHKEAEGLSTREALLEAGSTRLRPILMTAIATIGALIPLALGFEG-GSQVISKGLGVTVIGGLISSTLLTLLIVPIVYEVLAKFRKKKPGTEEE 4K0J Chain:A ((4-1018)) --RLVTLCFNRRGIVALVFAMVALYGWYAWKQLPLEAYPDIADTTSQVVTQVNGLAAEEVEQQITIPLEREIMGVPGMHVMRSKSTFGLSLITVVFKDGAEDYWSRQRLQERINGVSLPYGA-QPSLDPLTSPIGEIY-RYTLVSKTRDLRELSELQFWKVIPRLKQVAGVVDVANFGGLTTQFMLEFDPVMLSKYNISLNQITQAISENNANAGGSILNRGEQGLVVRGVGLIRNLDDLGNIVVTQ-----------------------------------------------GRVVLGNPQRHGILGMDRNPDTIQGITLLLKNENPSVVMEGVHAAVRDLNDNILPKDVKVVPYIDRSNLVDATVHTVGKTLMEGMFLVSLVLLLFLGSPRAAIIVAVTIPLSLLMAFILMHHFKIPANLLSL-GAI-DFGIIVDGAIVVMENILRRR-----------DIMQSVLQVARPIFFGMIVIITAYLPLFAFQRIEYKLFSPMAFAVGFALFGALLVALLLIPGLA------------------ALVWLAPRYESVLNR---STRTAIGIAVATLVGVMILGATIGRDFLPYLDEGSIWLQVTLPPGISLEKAGQMADNLRAATMEFPEVEHVVTQVGRNDEGTDPFSPSHIETAVTLHPYSTWTSGRDKQQLIEAMATRFRDLPGTQVGFSQPMIDGVLDKLAGAHSDLVVKVYGNDFAETRQVATAITRLLKTVPGAQDVIIDQEPPLPQVRIDVDRAAAARLGINVADVMALIQTGIGGSPVTQVFVEDRSYNVVARFIGSSRNDPEAIGNLTLTAANGAHVALAQVAHIRLAEGETTITREMNKRHLTVRLNLRGRDLSTFLEEARMRIDKEVPYDRTHIQVAWGGQFENQQRAQARLAVILPMVLALMFVLLF-------QPALILMAVPLATLGGLVALHLRGMTLNVSSAVGFIALFGVAVLNAIIMIANL----------KEAVVRGAGERMRPVLMTATVAALGLIPAALA-HGLGS-DVQRPLATVVVGGLITATALTLVLLPALYYLIETR----------

General information: TITO was launched using: RESULT: Template: 4K0J.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 : 5042 -494309 -98.04 -526.98 target 2D structure prediction score : 0.70 Monomeric hydrophicity matching model chain A : 0.72 3D Compatibility (PKB) : -98.04 2D Compatibility (Sec. Struct. Predict.) : 0.70 1D Compatibility (Hydrophobicity) : 0.72 QMean score : 0.396

(partial model without unconserved sides chains): PDB file : Tito_4K0J.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4K0J-query.scw PDB file : Tito_Scwrl_4K0J.pdb: