Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNELKDFFFLGKPIQTEIGEIDFIRLKDYPLYTKELSMLRMNKKSLIKEYSRFNEDGSL--DPFIIEMKKRDLYEIVHSVLPDFHEAYFKVFSKVLINKDSLSLIGKHNFPRLRKLILDMHCITE--DKVVDNDELQEFHDISKSLKQQDSQSDLKDIVSCVAAFNGYTYEEISEMTMYQLYLS-FYRMAEVMNYNTTTLFATVSPDVKVSDWSSHINLYKEESYHLSTKDAKNIEQLFGG 2E1B Chain:A ((1-216)) --MINMTRKLYYEDAYLKEAKGRVL-------EIRDNAILLDQTIFYPTGGGQPHDRGTINGVEVLDVYKDEEGNVWHVVKE---------PEKFKVGDEVELKIDWDYRYKLMRIHTGLHLLEHVLNEVLGEGNWQLVGSGMSVEKGRYDIAYPENLNKYKEQIISLFNKYVDEGGEVKIWWEGDRRYTQIRDFEVIPCGGTHVKD------IKEIGHIKKLKRSSIGRGKQRLEMWLE-

General information: TITO was launched using: RESULT: Template: 2E1B.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 : 994 25768 25.92 122.12 target 2D structure prediction score : 0.31 Monomeric hydrophicity matching model chain A : 0.59 3D Compatibility (PKB) : 25.92 2D Compatibility (Sec. Struct. Predict.) : 0.31 1D Compatibility (Hydrophobicity) : 0.59 QMean score : 0.087

(partial model without unconserved sides chains): PDB file : Tito_2E1B.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2E1B-query.scw PDB file : Tito_Scwrl_2E1B.pdb: