Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MQLDSPGTLKQCLISQRPLQGGLTHDNTLLICADGSQWVCKRSLGRHQSG-LATEANVYSLLVNT-RFALP---------IKLVHLDIASQMLLRPYIEGTTTTSW-----AQLSIEQAILLLKAIHQITATHHGKVSSPTSLTLNPANQLRVIWRYFRSRTSQRAKMMDIYGKL-------STILQNRQSLFNTLSTF----TLNHGDFHPGNLIATPAQQLVP-IDWERAHFGDPAFDLALINWHGQDPIVNSALQARAIALYTQCPAEQVALQKRVVCWSLVRLFNDYLYLTSNGLKVDKLAHFEETTAMLLNAAS 5IGS Chain:A ((33-233)) ---------------------GLDYRIVIATVDDGRRWVLRIPRRAEVSAKVEPEARVLAMLKNRLPFAVPDWRVANAELVAYPMLEDSTAMVIQP---GSSTPDWVVPQDSEVFAESFATALAALHAV----------PISAAVD-AGML------IRTPTQARQKVADDVDRVRREFVVNDKRLHRWQRWLDDDSSWPDFSVVVHGDLYVGHVLIDNTERVSGMIDWSEARVDDPAIDMA-----------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 5IGS.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 : 472 -4320 -9.15 -24.97 target 2D structure prediction score : 0.54 Monomeric hydrophicity matching model chain A : 0.64 3D Compatibility (PKB) : -9.15 2D Compatibility (Sec. Struct. Predict.) : 0.54 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.222

(partial model without unconserved sides chains): PDB file : Tito_5IGS.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5igs-query.scw PDB file : Tito_Scwrl_5IGS.pdb: