Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MFASILRELNYLR-SNKWDSCMVTL-IPAFIIFLFSSMFYAGKAEHLPIAIIDQDQSELSR-NIGKYLSLNHTVDVKTITTSSSEAERLLNETKIWGYIFIPDGAEKRFVKAQDAQISIAFNQSFFSVGNTISSAMLVSTLNALADYAGQNYLANNIPYLDVPTAHVKISTLYNPSMSYEFYLEPFMVPAVLHLLLCCCVAFAIGQEIKRGTLTQWVNRESFIQGLLAKNLLYSFIFCFWTWLWMFWLVEIRGWFVAGSLSFLLAAQFLLYFSYALISSTVILATKNLSKTFGFIAVYGGS-SLSFAGVTLPLNN-APIFTKFWSLIIPYTPYAKLQT-EQWVIGSPLFISMSPFLILIGYCLIYFFLSCLLLKKLVQGATP 4RWR Chain:A ((63-331)) VYREKQKKVESLPMEEYVTGVVASEMNASFEIEALKAQALAARTFVVQ------------RMLSGGKKNNADVTDTDQVYKSKEELKKQWG-----------NNYENNLKKIEEAVSKTA--GQVLTYEGKPISASFFSTSNGRTENA-ADYWGNDYPYLKSVDSPWDQA-------SPKFTSEQIFTVADFQKRLG-------VKVLADGKVGDIKGRT---EGKRVKDVAFQG-------------KTLTGRDVRDKLELRSS-----DFTWKQEGDKIVVTTKGFG--------HGVGMS------QYGANGMAAEGKKYTDIVAHYYKGVEIKTMNDY----------------------------------------

General information: TITO was launched using: RESULT: Template: 4RWR.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 : 3 629 209.67 2.41 target 2D structure prediction score : 0.33 Monomeric hydrophicity matching model chain A : 0.56 3D Compatibility (PKB) : 209.67 2D Compatibility (Sec. Struct. Predict.) : 0.33 1D Compatibility (Hydrophobicity) : 0.56 QMean score : ?

(partial model without unconserved sides chains): PDB file : Tito_4RWR.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4RWR-query.scw PDB file : Tito_Scwrl_4RWR.pdb: