Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MVVAWHRPTKAVIHKKAITENVANEVAR-LPQGKELFAVVKANGYGHGAIETAEAAVAGGASGFCVSNLDEGVELREAGFTQPILILNMVPYDALTVAVAHDLSVTAGTREWLQAAAAVLEKSKLETPLSIHLKADTGMGRIGFCTPE-EVKEAAAFIKESRVLEWEGLFTHFSTADQADDTYWNLQKERFIEVLKKLPE--LP-RYVHVSNSATALWHDETIGNMIRYGVAMYGLNPSGHALPE-VYPLQPALELVSELIQVKKLPAG-EGIGYGETYITPEAEWIGTIPIGYADGWPRKMQGF-SLLVEGNYCETIGRVCMDQLMIRLPQ--EFPVGTKVTLIGKNADKEITMQDIADQLGTIHYEVACGLGQRIPREYQE 5IRP Chain:B ((3-380)) ---KLCREVWIEVNLDAVKKNL-RAIRRHIPHKSKIMAVVKANGYGHGSIEVARHALEHGASELAVASVEEGIVLRKAGITAPILVLGFTSLSCVKKSAAWNITLSAFQVDWMKEANEILEKEASANRLAIHINVDTGMGRLGVRT-KEELLEVVKALKASKFLRWTGIFTHFSTADEPDTTLTKLQHEKFISFLSFLKKQGIELPTVHMCNTAAAIAFPEFSADMIRLGIGLYGLYPSAYIKQLNLVKLEPALSLKARIAYVKTMRTEPRTVSYGATYIAEPNEVIATLPIGYADGYSRALSNRGFVLHRGKRVPVAGRVTMDMIMVSLGENGEGKQGDEVVIYGKQKGAEISVDEVAEMLNTINYEVVSTLSRRIPRFYIR

General information: TITO was launched using: RESULT: Template: 5IRP.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 2091 -41106 -19.66 -111.70 target 2D structure prediction score : 0.59 Monomeric hydrophicity matching model chain B : 0.81 3D Compatibility (PKB) : -19.66 2D Compatibility (Sec. Struct. Predict.) : 0.59 1D Compatibility (Hydrophobicity) : 0.81 QMean score : 0.535

(partial model without unconserved sides chains): PDB file : Tito_5IRP.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5IRP-query.scw PDB file : Tito_Scwrl_5IRP.pdb: