Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MISLESLEENFR---FLTLEVANQARATRDILGKPEKELVERLI-------------ARDDYIDNLKTI----IENKCFSRIHAEEGAEQSESNRI---RAIHIICVNLERIADHCVNIVRQIKHFSDPTFLHRYEFHSMFNLIQSGLDMILPVQRSQKVAQALTICKIEHELDNQYKERFDQIQDEMRAQHNA--DVGDLITALFIFRYLERIGDALLNVGEAFIFAFLGEKI-------KIHQFQALQETLSQAGYEGSLSEIDFESIWGGRSGCRIRRVKNTNPDPSKEVIFKEGQKEKIQQERDNIDRWSDLFPGIAPHVVGYNEGGNYASMLVEFLPGCTLDEVVLTTEPEQVRNALFVFEQTLVDVWEDTIDPQDHPSPGFIKQLSGRLDKIQQVHPGILTPHKRIGRITIPSLRKR-LEQGTALEQAVQAPFTVLLHGDCNLNNVVYDFEEQRIRFIDLYRSRQADYIQDVSVFLVSNFRMPIFEPSLRARLNWTIRHFYHFARGFAAKHGDTTFSFRLALGLCRSFLTSTRFELDTEFAYEMAERGGYLLDRLLEHGSKHQEEFTFPEAVLYY 4LLG Chain:F ((6-612)) QSQLKLLVTRGKEQGYLTYAEVND-HLPEDIVDSDQIEDIIQMINDMGIQVMGRTTDPVRMYMREMGTVELLTREGEIDIAKRIEDGINQVQCSVAEYPEAITYLLEQYDRVEAEEARLSDLITGFVDDPELAREKFAELRAQYVVTRDTIKATAQEEILKLSEVFKQF-----RLVPKQFDYLVNSMRVMMDRVRTQERLIMKLCV--------EQCKMPKKNFITLFTGNETSDTWFNAAIAMNKPWSEKLHDVSEEVHRALQKLQQI-EEETGLTIEQVKDINRR------MSIGEAKARRAKKEMVEANLRLVISIAKKY--TNRGLQFLDLIQEGNIG--LMKAVDKFEYRRGYKFSTYATWWIRQAITRSIADQAR-TIRIPVHMIETINKLNRISRQMLQEMGR--EPTPEELAERMLMPEDKIRKVLKIA-----KEPISMETPIGDDED----------SHLGDFIEDTTL-----------ELPLDSATTESLRAATHDVLAGLTAREAKVLRMRFGIDMNTDY-TLEEVGKQFDVTRERIRQIEAKALRKLRHPSRSEVLRSFLD-----

General information: TITO was launched using: RESULT: Template: 4LLG.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain F - contact count / total energy / energy per contact / energy per residue : 1431 81195 56.74 166.38 target 2D structure prediction score : 0.53 Monomeric hydrophicity matching model chain F : 0.65 3D Compatibility (PKB) : 56.74 2D Compatibility (Sec. Struct. Predict.) : 0.53 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.258

(partial model without unconserved sides chains): PDB file : Tito_4LLG.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4llg-query.scw PDB file : Tito_Scwrl_4LLG.pdb: