Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRAKRPLRKSGPCFDLAGLMDHAAPELQVQQKNEQELNKFFIDVDDNTVSPMITTGPSFCATNTAGLSSNNSTVELTAREMAGTGSSASVEKRTMVSSQNEAKFIHVNDTNIFVLIDGISMFVEGKSTFTGTEDARLLVERLRQKKLARSVDTVQEAILNIQMSADHCDRKETAPVVSAVPSGSPVVPAEASPRQSTANTLPTSVPPLQSAVAPTALPVPLPPPQPVPIANPWASLFEDAKVPSGSPLFRSFKAKSLGSTSSHGFPPVHSTLLCESAETGATPSSPATTISPVTVTTPTSALSPTTGFNASSRLTHSVSFPSLRHQDSSSSLLSATSGAGHRHGGHASRGAAARRTKQISAEEIGHSNCSLDMDEVAVEAMIGKGTQGTVFRVRLD--GKLYALKCMNIDEAMNATNDVERQGYKKGLVKELTMITLQRSRPSPAYLMQMFNAVASLDAEKKQLSILMELMSFTVENIQQMVSRIPSEELMRVTQSTFRNYMSGDPSAKQSMKECCKDQLLYGSPRHALGRSTYKEPAAWEKNVKRETPMPEVLLSMLARDVLMGLNELHTDYS--IIHCDLKPANVMLCYDQQKFKLADFGCGSVMEDHQHVERRGIDLGTILYKAPERFVANILHRIADIDDGGTGEAVVFTAKADVWSLGIMLMELAAGIHPCDQFKSDFWNYSTMLK-LSKMVKPLNWSESFYDFILRSVCVDVSLRWSVQQLLKHPFIIKFNHVPREKLKLFVQRLEADSKTFHKRQQSELLKEQILLSTTRRHKDTFQLQSRKVWSTYTAYLKQAPPTKDQTMFPELRHT 5O2C Chain:A ((20-289)) --------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------TSPSGRFLKFDIELGRGAFKTVYKGLDTETWVEVAWCELQDRKLT--------KAEQQRFKEEAEMLKGLQ--H-P-NIVRFYDSWESILKGKKCIVLVTELMTSG-------------------------------------------------TLKTYLKR---------------FKVMKPKVLRSWCRQILKGLQFLHTR-TPPIIHRDLKCDNIFITGPTGSVKIGDLGLATLMRTS----FAKSVIGTPEFMAPEMYE------------------EHYDESVDVYAFGMCMLEMATSEYPYSECQNAAQIYRKVTSGIKPASFNKVTDPEVKEIIEGCIRQNKSERLSIRDLLNHAFFAEDT-------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 5O2C.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 : 1332 -13402 -10.06 -50.57 target 2D structure prediction score : 0.51 Monomeric hydrophicity matching model chain A : 0.60 3D Compatibility (PKB) : -10.06 2D Compatibility (Sec. Struct. Predict.) : 0.51 1D Compatibility (Hydrophobicity) : 0.60 QMean score : 0.327

(partial model without unconserved sides chains): PDB file : Tito_5O2C.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5O2C-query.scw PDB file : Tito_Scwrl_5O2C.pdb: