Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MAETHTAIVFFAGDRAYKVKKAVDLGFVDYTDRQARRAACVREVALNRRFAPDVYLGVGEVVAPDAEVSEPLVVMRRMPAGRRLSALVRAGADVDEVLRAVARRLAAWHATAPRGRDVDEQGTRDALASRWEASFEQVRATTEGGSGFDGVPEVQRLVRR--YLAGREALFDSRIEQRRVVDGHGDLLAEDIFCLDDGPRVLDCLEFDDHLRYVDGLDDAAFLAMDLEQLGAPAAAARFLARYGEYSGDPAPPSLWHHYVAYRAFVRAKVSLIQAEQGAPGVRSAARRLVSTTLRHLRTSAV---GLTLVGGLPGSGKSTLSGALADRLGVTLLSSDRLRKELAGIPPESPAPAAYEEGLYTPEWTARTYDILLDRAAALL-SRGESVVLDATWSAAELRAAAGRVAERTCADLVALHCQVPDEVAAARLSTRSPGPSDADLGVADALAAREPPWPDAVVVDTSGPLESAVSRALAAVRPWGTDQAPVFRRPSAEPDQDRGAGSSLP 4MND Chain:A ((40-457)) ---LMKAVILAAGLGGGVPKPLVRVGGCE------------------------IILRTMKLLSPH--VSEFIIVASRY--ADDIDAFLKDKGFNYKIVR----------------HDRPEKGNGYSLLVAKNHVEDRFILTM--GDHVYSQQFIEKAVRGEGVIADREPRFVDIGEATKIRVEDG-----RVAKIGKDLREFDCVDTG-FFVLDDSIFEHAEKLRDREEIPLSEIVKLARLPVTYVDGE-----LWMDVDTKEDVRRANRALVSAAVGDGFISRKINRKISTRISAAIVNKVNPNQMTLISFLVGAFSALASFFSIPLAGLLYQFSSILDGCDGEIARASLKMS--KKGGYVDSILDRFVDFLFLAIIALLYPKTATVAMFAIFGSVMVSYTSEKYKAEFGESI--------------RVLNYIPGKRDERIFLIMIFCLLSAISLQWIFWMFLFVAAISLTRVVVTLLAVLVS-----------------------

General information: TITO was launched using: RESULT: Template: 4MND.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 : 2079 -88083 -42.37 -219.11 target 2D structure prediction score : 0.46 Monomeric hydrophicity matching model chain A : 0.67 3D Compatibility (PKB) : -42.37 2D Compatibility (Sec. Struct. Predict.) : 0.46 1D Compatibility (Hydrophobicity) : 0.67 QMean score : 0.137

(partial model without unconserved sides chains): PDB file : Tito_4MND.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4mnd-query.scw PDB file : Tito_Scwrl_4MND.pdb: