Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MLTHDLHEKTKHYISIYAELKTKLKWKVSHDQILMLISSAYIVNKREFDFQRFYDLSSYIKSNIGSFSTLNSHHRFTVASILDIHFQHEAKQTFQTFIDVYNEMVKLGYKRDMFTYLSALILLTGKSETTNQKEQMNMGLAVYQQMKKNHYFLTSTQNVPLAVLLGENGKGLQALQKAETCYQLLAANGFKKGQYLHQVSHILALQSEKEPEMLVSACKQIYQSITESVKKTKDYHYPDLALLTFLEEPDIKTVL--CITDELNQEKAF---KWQKEMNFKIAVSLYLSEHMEKNLLMESGLYTAIETVIQAQQAAATAAIISSTAASHTHDGN 1IZN Chain:A ((97-181)) -----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------KFDHLRKEASDPQPEDTESALKQWRDACDSALRAYVKDHYPNGFCTVYGKSIDGQQTIIACIESHQFQPKNFWNGRWRSEWKFTI----------------------------------------------------

General information: TITO was launched using: RESULT: Template: 1IZN.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 : 201 -17679 -87.96 -220.99 target 2D structure prediction score : 0.36 Monomeric hydrophicity matching model chain A : 0.55 3D Compatibility (PKB) : -87.96 2D Compatibility (Sec. Struct. Predict.) : 0.36 1D Compatibility (Hydrophobicity) : 0.55 QMean score : 0.394

(partial model without unconserved sides chains): PDB file : Tito_1IZN.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1IZN-query.scw PDB file : Tito_Scwrl_1IZN.pdb: