Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MGRTSSSGLPKGTRARSGKIQINFKWNDKREWFTLDLIDTPANFIKAAKIREDFVNKAKYGILKIEDIKAVTAKPIKKADASQKTLPASNAPTFAHYAQEYLYNLSDHKQGTKKKYLSILERLWMPLFEDMPINTITSQMLRTAVNGR-EWSSAKTRNDALIPLRGVFELACDDEVIDKNPCDRLKNQKTQEDEPDPFNEMEKEIILNWLKEKYISD--YPTVYWYFVVAFWTGCRPSEIIALTWQDVDFLNKQIYINKGRVNGVQQETTKTNKARFVDLNDFAFEAFQQLRLLT---YLKYEHVFICDETGKEFTTQKSLSEKFVASLKANGIRYRP--AYNTRHTYATVCLMNGLNPVYVASQLGHSLVMLMMRYAKWINSDKNKEEIAKISNSAKIVPNKKGIKLSV 5JK0 Chain:A ((2-363)) --------MKHPLEELKDPTENLLLWIGR--FLRYKCTSLSNSQVKDQNKVFECLNELN---------QACSSSQLEKVCKKARNAGLLGINTYALPLLKFHEYFSKAR-----------------LIAFNSLKNIDEVMLAEFLSVYTGGLSLATKKNYRIALLGLFSYIDKQNQ-DENEKSYIYN-ITLKKLPTHLNNEELEKFLESIDKIEMSAKVRARNRLLIKIIVFTGMRSNEALQLKIKDFTLENGCYTILIK---------GKGDKYRAVMLKAFHIESLLKEWLIERELYPVKNDLLFCNQKGSALT-QAYLYKQVERIINFAGLRREKNGAHMLRHSFATLLYQKRHDLILVQEALGHASLNTSRIYTHF--DKQRLEEAASIWEEN-------------

General information: TITO was launched using: RESULT: Template: 5JK0.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 : 1297 -19840 -15.30 -58.52 target 2D structure prediction score : 0.53 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : -15.30 2D Compatibility (Sec. Struct. Predict.) : 0.53 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.329

(partial model without unconserved sides chains): PDB file : Tito_5JK0.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5JK0-query.scw PDB file : Tito_Scwrl_5JK0.pdb: