Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence -MISLESLEENFRFLTLEVANQARATRDILGKPEKELVERLIARDDYIDNLKTIIENKCFSRI--HAEEGAEQSESNRIRAIH---IIC----VNLERIADHCVNIVRQIKHF-------SDPTFLHRYEFHSMFNLIQSGLDMILPVQRSQKVAQALTICKIEHELDNQYKERFDQ-----IQDEMRAQ--HNADVGDLITALFIFRYLERIGDALLNVGEAFIFAFLGEKIKIHQFQALQETL-SQAGYEGSLSEIDFESIWGGRSGCRIRRVK----NTNPDPSKEVIFKEGQKEKIQQERDNIDR-WSDLFPGIAP-----HVVGYNEGGN----YASMLVEFLPGCTLDEVVLTTEPEQVRNALFVFEQTLVDVWEDT---IDP---QDHPSPGFIKQLSGRLDKIQQVHPGILTPH--KRIGRI---TIPSLRKRLEQGTALEQAVQA----PFTVLL--------HGDCNLNNVVYDFEEQRIRFIDLY--RSRQADYIQDVSVFLVSNFRMPIFEPSLRARLNWTIRHFYHFARGFAAKHGDT-----TFSFRLALGLCRSFLTSTRFELDTEFAYEMAERGG------------YLLDRLLE--HGSK--HQEEFTFPEAVLYY 1R42 Chain:A ((19-615)) STIE-EQAKTFLDKFNHEAEDLFYQSSLASWNYNTNITEENVQNMNNAGDKWSAFLKEQSTLAQMYPLQEIQNLTVKLQLQALQQNGSSVLSEDKSKRLNTILNTMSTIYSTGKVCNPDNPQECLLLEPGLNEIMANSLD-YNERLWAWESWRSEVGKQLRPLYEEYVVLKNEMARANHYEDYGDYWRGDYEVNGVDGYDYSRGQLIEDVEHTFEEIKPLYEHLHAYV---------RAKLMNAYPSYISPIGCLPAHLLGDMWGRFWTNLYSLTVPFGQKPNIDVTDAMVDQAWDAQRIFKEAEKFFVSVG--LPNMTQGFWENSMLTDPGNVQKAVCHPTAW-DLGKG----DFRILMCTKVTMDDFLTAHHEMGHIQYDMAYAAQPFLLRNGANEGFHEAVGEIMSLSAA------TPKHLKSIGLLSPDFQEDNETEINF--LLKQALTIVGTLPFTYMLEKWRWMVFKGEIPKDQWMKKWWEMKREIVGVVEPVPHDETYCDPASLFHVSN-----DYSFIRYYTRTLYQFQFQEALCQAAKHEGPLHKCDISNSTEAGQKLFNML-RLGKSEPWTLALENVVGAKNMNVRPLLNYFEPLFTWLKDQNKNSFVGWSTDWS-PYAD---

General information: TITO was launched using: RESULT: Template: 1R42.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 : 2210 85724 38.79 167.43 target 2D structure prediction score : 0.65 Monomeric hydrophicity matching model chain A : 0.61 3D Compatibility (PKB) : 38.79 2D Compatibility (Sec. Struct. Predict.) : 0.65 1D Compatibility (Hydrophobicity) : 0.61 QMean score : 0.299

(partial model without unconserved sides chains): PDB file : Tito_1R42.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1r42-query.scw PDB file : Tito_Scwrl_1R42.pdb: