Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MLEYGFKDDSLSLHTDLYQINMAETYWRDGIHEKKAIFELFFRRLPFENGYAVFAGLEKAIEYLENFKFTDSDLSYLQDELGYHEDFIEYLRGLSFTGSLYSMKEGELVFNN------EPIMRVEAPLVEAQLIETALLNIVNYQTLIATKAARIKGVIGDEVALEFGTRRAHEMDAAMWGARAALIGGFSATSNVRAGKRFNIPVSGTHAHALVQAYRDEYTAFKKYAETH---KDCVFLVDTYDTLRSGMPNAIRVAKEFGDRINFIGIRLDS-----GDLAYLSKKARKMLDEAGFTDAKVIASSDLDEHTIMNLKAQGARIDVWGVGTKLITAYDQPALGAVYKLVAIEEDGKMVDTIKISSNPEKVTTPGRKKVYRIINQSNHHSEGDYIALYDEQVNDQKRLRMFHPVHTFISKFVTNFYAKDLHELIFEKGILCYQNPEISDIQQYVQDNLSLLWEEYKRISKPEEYPVDLSEDCWSNKMQRIHEVKSRIEEELEEE 2I1O Chain:A ((18-395)) --------IKKGLASDVYFERTISAIGDKC-NDLRVAMEATVSGPLDT--WINFTGLDEVLKLLEGL-----------------------------DVDLYAIPEGTILFPRDANGLPVPFIRVEGRYCDFGMYETAILGFICQASGISTKASKVRLAAGDSPFFSFGIRRMHP-AISPMIDRSAYIGGADGVSGILGAKLIDQDPVGTMPHALSIMLGDE-EAWKLTLENTKNGQKSVLLIDTYMDEK---FAAIKIAEM---FDKVDYIRLDTPSSRRGNFEALIREVRWELALRGRSDIKIMVSGGLDENTVKKLREAG--AEAFGVGTSISSA---KPFDFAMDIVEVNG----KPETKRGK------MSGRKNVLRCTSC-HR---IEVVPA-NVQEK-TC--------------ICG-GSMQNLLVKYLSHGKRTSEYPRPKEIRSRSMKELEYFK------------------------------------------

General information: TITO was launched using: RESULT: Template: 2I1O.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 : 1940 16024 8.26 44.02 target 2D structure prediction score : 0.52 Monomeric hydrophicity matching model chain A : 0.69 3D Compatibility (PKB) : 8.26 2D Compatibility (Sec. Struct. Predict.) : 0.52 1D Compatibility (Hydrophobicity) : 0.69 QMean score : 0.462

(partial model without unconserved sides chains): PDB file : Tito_2I1O.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2I1O-query.scw PDB file : Tito_Scwrl_2I1O.pdb: