Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSLHAVSESNIKQIPDMDYYFISGGLPSNYGGLTKSLLLRSKLFGEECNQNTFFLTFRFDLELSSKIDELYSN-GKIDKKFTSVINLFDDFLSVRTNGKRSYEERIGLDQIKKQVGMGKFAKT-----LLRLFGKKNNEMSVVYYG--DGETIRYVDYWNDKNQLIKRE--EYTKNGNLVLVTHYDVQLNKMYLQEYINDQNQVYLDKLYVWNNEEKDVQLSHIIWYSLEGEIKVKDESELRQYWIEYLQKQNDKPKLFLVDSRPQDKHVFKVKKSPSSYYGAIIHNKHYGSNK----YQIKGRYKEVFSQMYNLDAV-FFI--TEEQL----EDFKLISGEQETFFFTP-HTIDKPLDPAVLNVPSEKYKAVIISRLASMKNLIHAVKAFSLVVKEIPEAKLDIFGSGEDFEKIKKEIEDTKLQNNVFLKGYTD-NPDSEFQKAWLTISTSHFEGFGLSNMEALSNGCPVVTYDYDYGARSLVTDGANGYV-------IEQYNIEKLGQAIISLMKDESTHQKFSEQAFKMAEKYSRPNYIENWAFALNQMIEVRIEREKFSKKVGKKDPSISSYTEDFDKTKIEIDIENFDHNDIKKIRLVGLDRKNKAEIISTNLQNDQLFVIDLEKDVNIEKIAANKTQVIDFYIVFNANGHIKTMRRLSSEETKLSGNSIDTNNGYRVEPYTTVKGNFSWRVTEIKES 5E9U Chain:A ((41-500)) -----------------------------------------------------------DMILADNIQHLTENIGFLDEEIIWLYNYFTDIKIAPTT--------VTLDQVLAQVA-GQPERSEKEGKIVRYFYPQDDQFITCYLRQEDQDFVEHVEYVS-RGRLIRKDYFSYVRYASEYFAPHNDA--ATLYQRRFYHEDGSVAYDML-IEDGQEKLYRFPDRIFYS---------KAELVRYFLQCLQLQADD--VVILDRETGIGQVV-FEESQKAKLGVVVHAEHFSENASSDDYILWNNFYDY--QFTNADKVDFFIVATEAQKRILEQQFQHYSDKQPQIATIPVGSLDQLTYP---KEPRKPYSMITASRLATEKHIDWLVAATVQAHAQLPELTLDIYGKGSEEDKLRRRIEEAGAQDYIRLKGHADLSQIYAGYELYLTASTS--EGFGLTLMEAVGSGLPLIGFDVRYGNQTFIDDGKNGYLLPVSSNHVEDQIIAAFVEKIIALFS-QGRQQEMSQHSYQVAENYLTSRVEAAWTQLLKEV-------------------------------------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 5E9U.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 : 1921 100361 52.24 233.40 target 2D structure prediction score : 0.55 Monomeric hydrophicity matching model chain A : 0.69 3D Compatibility (PKB) : 52.24 2D Compatibility (Sec. Struct. Predict.) : 0.55 1D Compatibility (Hydrophobicity) : 0.69 QMean score : 0.368

(partial model without unconserved sides chains): PDB file : Tito_5E9U.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5E9U-query.scw PDB file : Tito_Scwrl_5E9U.pdb: