Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTHSFAVPRSVEWKETAITILNQQKLPDETEYLELTTKEDVFDAIVTLKVRGAPAIGITAAFGLALA----AKDIETDNVTEFRRRLEDIKQYLNSSRPTAINLSWALERLSHSVEN------AISVNEAKTNLVHEAIQIQVEDEETCRLIGQNALQLFKKGD-----RIMTICNAGSIATSRYGTALAP----FYLAKQKDLGLHIYACETRPVLQGSRLTAWELMQGGIDVTLITDSMAAHTMKEKQISAVIVGADRIAKNGDTANKIGTYGLAILANAFDIPFFVAAPLSTFDTKVKCGADIPIEERDPEEVRQ--ISGVRTAPS--NVPVFNPAFDITPHDLIS-GIITEKGIMTGNYEEEIEQLFKGEKVH 2A0U Chain:A ((20-364)) ---------SIKYTPGSLRLLDQRKLPLETVFDDVLTVEDIWSAIKEMRVRGAPAIAVSAALGIAVATQRKAANGELKSGREVQTFLLTSCDFVMTSRPTAVNLFNCLRDLKAQVDKLDPTKAAAEVAQAFVELAEAVYTNDVAFNEGIMRHGAAHILAAAKAEGRDKVSILTICNTGALATSRYGTALGVVRQLFYDGKLE----RVYACETRPWNQGARLTVYECVQEDIPCTLICDGAASSLMLNRKIDAVVVGADRICQNGDTANKIGTYNLAVSAKFHGVKLYVAAPTTTLDVKTASGNHVEIEEREPTEITTNLVTKQRVVADGPHLSIWNPVFDITPSELITGGIITEKGV-------------------

General information: TITO was launched using: RESULT: Template: 2A0U.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 : 1835 -169335 -92.28 -527.52 target 2D structure prediction score : 0.66 Monomeric hydrophicity matching model chain A : 0.79 3D Compatibility (PKB) : -92.28 2D Compatibility (Sec. Struct. Predict.) : 0.66 1D Compatibility (Hydrophobicity) : 0.79 QMean score : 0.499

(partial model without unconserved sides chains): PDB file : Tito_2A0U.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2A0U-query.scw PDB file : Tito_Scwrl_2A0U.pdb: