Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MVSTPCKLRGDDFMAKISKYKKKNGQVAWMYKGHIATDPRTGEKINTTRRGFSSKQEAQKDYDEYRHQILYGVKKKAPDMTFEDLYNEWITHQRTSVKASTIAISVRYANNQILPAFGKLKLSNISVPYCQKVVDEWHSKYESYDYMRKQTAQILRYGVAMQYIDNNPMEKTLLPRKKEYEKNRKFYSKEELNNLLDAFKDFGNMKQYAFFRLLAYTGMRKSEVLALQWKDIDTFNKELHVNKTLAVDEFGKVIIQSPKTRASRRVISLDTETLSI---LNNWKLQQKEEYLKLGYNTSSKEQHVFTTVKNTLYIPNTVNDWLRYILKKYNLP-----RITPHGFRHTHASLLLEAGESVKVVQQRLGHENSKVTLDIYAHITNNAPKKTGQDFADMMAHQ 1AE9 Chain:A ((178-351)) ----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------SRLTADEYLKIYQAAESS-PCWLRLAMELAVVTGQRVGDLCEMKWSDIV--DGYLYVE--------------QSKT-GVKIAIPTALHIDALGISMKETLDKCKE---------ILGGETIIASTRREPLSSGTVSRYFMRARKA-SGLSFEGDPPTFHELRSLSA-RLYEKQISDKFAQHLLGH---------FRDDRGREWD-------------

General information: TITO was launched using: RESULT: Template: 1AE9.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 : 736 -19965 -27.13 -126.36 target 2D structure prediction score : 0.66 Monomeric hydrophicity matching model chain A : 0.60 3D Compatibility (PKB) : -27.13 2D Compatibility (Sec. Struct. Predict.) : 0.66 1D Compatibility (Hydrophobicity) : 0.60 QMean score : 0.413

(partial model without unconserved sides chains): PDB file : Tito_1AE9.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1AE9-query.scw PDB file : Tito_Scwrl_1AE9.pdb: