Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTNNLKQRRIILDLAVTLDGFIEGKNGEVDWCIMD-PDMGFTDFLNQIDTILYGRKSFDLWGQYIPKN---------------------ED-PDTEKELWKLVHS-----KKKYVFSRTQNEID------------NQAIFIN----D-NILEEVNKLKKNPG-KDIWLYGGASLITTFINLGLVDEFRLSIHPVVLGEG-KPLFIDVK---QRINLKMVNTRTFSSGVVQIVYHWNG 2P4G Chain:A ((31-261)) ----INEPECRAIAITSINGSAT-LSGVSGPMGDQTDADLLIQLRGWADAIVVGAETARKENYGPVVLPHGIKNQRQKLGRCGLPKLTLLSKSLYFDFSSELFSPDLPSELSPLVITQQPANNSEQWDQRLQKLIDVGVEVIVAPTSTNPLKIAFDALHA-RRLKKISIEGGPSVYRQALSLGIVDRLHLTIAPNIICPVESPLFGKISDDSFTTRLVLEMLSSSPNGLIFSRYKVI-

General information: TITO was launched using: RESULT: Template: 2P4G.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 : 821 -5151 -6.27 -28.46 target 2D structure prediction score : 0.56 Monomeric hydrophicity matching model chain A : 0.64 3D Compatibility (PKB) : -6.27 2D Compatibility (Sec. Struct. Predict.) : 0.56 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.440

(partial model without unconserved sides chains): PDB file : Tito_2P4G.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2P4G-query.scw PDB file : Tito_Scwrl_2P4G.pdb: