Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MDSFFDTPIPEDQVFSNAPKCRTRREATRHYLDHVHYTEPQPDVPGEILHHIVHPFSMGSITDRQITLQDNGTICKSTRIGRSNLGAEKHHLELVAMKTSVPVPRVHQYYVSEEFEHLVMDNMPGTTLQQAWPTLSHLERKSIADQVVSLVQRLRELRSTH--INAALLFRRP-----LRDGLRDATDLSMER----INPYLSDEHIAAYINKRSAIMEGQLNVFTHGDLDWGNILIADKQVCGLIDLESSGFFPPYWE----WIMVKRLSHSLPKDSWFRLLEERLGAEDHSNWQGMWEVEQLIMALDEFSRWDLTPAGREMNRHRGWTEVVRILGPGVGDPPVVLYEMAAEHPWWLVSAADGEVKFTSRREWPTLMKSKTAV 4FEW Chain:A ((81-246)) -----------------------------------------------------------------------------------------------------PLPTIKHFIRTPDDAWLLTTAIPGKTAFQVLEEYPD-SGENIVDALAVFLRRLHSIPVCNCPFNSDRVFRLAQAQSRMNNGLVDASDFDDERNGWPVEQVWKEMHKLLPFSPDS--------VVTHGDFSLDNLIFDEGKLIGCIDVGRVGIADRYQDLAILWNCLGEFSPSLQK------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4FEW.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 : 467 -37975 -81.32 -251.49 target 2D structure prediction score : 0.46 Monomeric hydrophicity matching model chain A : 0.62 3D Compatibility (PKB) : -81.32 2D Compatibility (Sec. Struct. Predict.) : 0.46 1D Compatibility (Hydrophobicity) : 0.62 QMean score : 0.160

(partial model without unconserved sides chains): PDB file : Tito_4FEW.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4few-query.scw PDB file : Tito_Scwrl_4FEW.pdb: