Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MGKNEILWGIAPIGWRNDDMPEIGAGNTLQHLLSDIVVARFQGTEVGG----FFPEPAI--------LNKELKLRNLRIAG----------------KWFSSFILRDGLG---------EAAKTFTLHCEYLQQVNADVAVVSEQTYSVQSLEKNV-FTEKPHF-TDDEWERLCEGLNHLGEIAAQHGLKLVYHHHLGTGVQTAEEVDRLMAGT-DPAHVHLLYDTGHAYISDGDYMGMLEKHIGRIKHVHFKDARLN--VMEQCRLEGQSFRQSFLKGMFTVPGDGCIDFREVYQ-LLLKHSYSGWIVIEAEQDPDVA-NPLEYALIARNYIDQQLLDLA 2ZDS Chain:A ((1-321)) ----PRNFTLFTGQWAD---------LPLEEVCRLARDFGYDGLELACWGDHFEVDKALADPSYVDSRHQLLDKYGLKCWAISNHLVGQAVCDAIIDERHEAILPARIWGDGDAEGVRQRAAAEIKDTARAAARLGVDTVIGFTGS---AIWHLVAMFPPAPESMIERGYQDFADRWNPILDVFDAEGVRFAHEVHPSEIAYDYWTTHRALEAVGHRPAFGLNFDPSHFVWQDLDPVGFLWDFRDRIYHVDCKEARKRLDGRNGRLGSHLPWGDPRRGWDFVSAGHGDVPWEDVFRMLR-SIDYQGPVSVEWE---DAGMDRLQGAPEALTRLKAFDFEPP

General information: TITO was launched using: RESULT: Template: 2ZDS.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 : 1394 -10847 -7.78 -39.16 target 2D structure prediction score : 0.69 Monomeric hydrophicity matching model chain A : 0.65 3D Compatibility (PKB) : -7.78 2D Compatibility (Sec. Struct. Predict.) : 0.69 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.434

(partial model without unconserved sides chains): PDB file : Tito_2ZDS.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2ZDS-query.scw PDB file : Tito_Scwrl_2ZDS.pdb: