Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MPSITKQIMSGAKWTSISTMCITIIQIVQFALLGNMMTLTEFGLVGMITTVTVFAQIVLDMGFGAALIQR----D-DATERQ----LSTLYWLNIMTGVLLFVLLYVSSPVIAGFYQ-REE----LVFLVRILAIMFLIAPIGQQYQYMLQKQLHFNTLSKIEIFSNVLSFGYLAIAVF-----MMDAILAYVISQVLLQSSKGILYWAVYRKKW-----H---PAFVFDLRGMKDFFSFGAFQLSSRLVNRLGANIDMILIGRFIGAEALGIYNLAYQIVTIPVLKINPIVTRVAFPIFAKNKY--ENSVIREGFLNMTKMLALVSFPLLIGLVSVSDAFITAVFGEK---WLAAVPILNVLAIVGILRVLMNPNGSVLLAKGRADLAFYWDSGVLL-LYGLSLFAAVQT--GSLLTVAWVYAIISVVNFLIGRWLLAYVIKLNLSAYFQSIMKPFLITAAMGIIAFGVSLSTEHFSMQAEMRLAISVAAGALCYLFLLVKAYPQTKSKLLRKGRLS 5C6P Chain:A ((11-445)) --KEIRLLTALALPMLLAQVAQVGIGFVDTVMAGG-AGKEDLAAVALGSSAFATVY-ITFMGIMAALNPMIAQLYGAGKTGEAGETGRQGIWFGLILGIFGMILMWAAITPFRNWLTLSDYVEGTMAQYMLFTSLAMPAAMVHRALHAYASSLNRPRLIMLVSFAAFVLNVPLNYIFVYGKFGMPALGGAGCGVATMAVFWFSALALWIYIAKEKFFRPFGLTAKFGKPDWAVFKQIWKIGAPIGLSYFLEASAFSFIVFLIAPF-GEDYVAAQQVGISLSGILYM-IPQSVGSAGTVRIGFSLGRREFSRARYISGVSLVSGWVLAVITVLSLVLFRSPLASM-YNDDPAVLSIASTVLLFAGLFQPADFTQCIASYALRGYKVTKVPMFIHAAAFWGCGLLPGYLLAYRFDMGIYGFWTALIASLTIAAVALVWCLEKYS----------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 5C6P.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 : 1935 -276322 -142.80 -690.81 target 2D structure prediction score : 0.44 Monomeric hydrophicity matching model chain A : 0.62 3D Compatibility (PKB) : -142.80 2D Compatibility (Sec. Struct. Predict.) : 0.44 1D Compatibility (Hydrophobicity) : 0.62 QMean score : 0.227

(partial model without unconserved sides chains): PDB file : Tito_5C6P.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5C6P-query.scw PDB file : Tito_Scwrl_5C6P.pdb: