Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MQMNTQREQLIHTWLTSVLEN-------DQFQIAYLAGDASFRRYACIQLQN--------KTYMLMDAPPEKEDCVPFVTIDEFFAGHGVRVPQIVAKDLNQGFLLLEDFGDVLLSTLLNDETVDQYYEQSFKQLIHLQSINGAEHFL-AYSYEKLLSEMQLLTDWMLPSL--DIHPTAEQKKTIDDAFDFLAQAA--LAQPQVIVHRDFHSRNLMKIAN-----EEELGVIDFQDAVIGADTYDLISITRDAYVQ----------------WNAERVYQWFKVFYELLPASARQNRSFDQFKRDADLMAIQRHIKILGIFVRLFERDGKSGYLKDLPRVMWYLLEESRGYHELDDFMAFIHSSVMPKFIEKYGPYEVAA 5FTG Chain:A ((2-308)) EQPEPRTRRRAYLWCKEFLPGAWRGLREDEFHISVIRGG-LSNMLFQCSLPDTTATLGDEPRKVLLRLYG--EAMVLESVMFAILAERSLG-PKLYGIFPQ--GRLEQFIPSRRLDTEELS--LPDISAEIAEKMATFHGMKMPFNKEPKWLFGTMEKYLKEVLRIKFTEESRIKKLHKLLSYNLPLELENLRSLLESTPSPVVFCHNDCQEGNILLLEGRENSEKQKLMLIDFEYSSYNYRGFDIGNHFCEWMYDYSYEKYPFFRANIRKYPTKKQQLHFISSYLPAFQ------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 5FTG.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 : 909 -8418 -9.26 -34.93 target 2D structure prediction score : 0.63 Monomeric hydrophicity matching model chain A : 0.62 3D Compatibility (PKB) : -9.26 2D Compatibility (Sec. Struct. Predict.) : 0.63 1D Compatibility (Hydrophobicity) : 0.62 QMean score : 0.327

(partial model without unconserved sides chains): PDB file : Tito_5FTG.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5FTG-query.scw PDB file : Tito_Scwrl_5FTG.pdb: