Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTIMFVRKRNSALFTVILLGSILSGCQVVNVKQQALNVTIANERNSILTQGKLSEASLNVLSMSGQEAKACTDSPDTCVNQLKNLPQILDEQLLSAASEMYLAKAMALSDSSECKISRFTKHKPTEEQKVIQNKYDECLDQQLSLLDKSIRYSYAY-LFSTKRQPTDRIFDNRQVQIRDFYNQAIAKMVSVYDLRYPQKNVVEPQIHIGKSVYSIDFEFHRQLSGQKLEKLISSYNLNFSGLRTINRRDGFGSEFVAVFPSSGKEDI-NEYILDPLNYSYKNGVNPNIHHARYLAATIVAEPKHAKTIQEIINDPEFVIRV----YDPYRTDNINVAGKQYPLATNFSAPYGLWLAENNLGVAAYLSLIDRDQHLTMPHLYMLEPYNPNKKIIVLVHGLASSPEAWIALTNDVMGDTVLRDNYQVWQVFYSTNMPILESRFQIYALLKQAFGSLNPSDPAAHDAVLVGHSMGGIISRLLVSDADITKPALEMMTIRQQNRFKKHPMVT---ERLQMHSISNFDRTIFL---ASPHRGTDYADRWFTLAARKIIRLPGAFLSAVTTSLTTENLDIKDFLNNIDNGLIQNGPSDLSHQSKFMELTENINPHQGLIFHSIMGNITKSDDPNVITDGIV--PYKSAHLEGAKSEKV-LPGGHSIQLTPQAVLELRRILREHLVEHGLYKP 4C3X Chain:A ((23-530)) --------DWTSECDVLVVGSGGGALTGAYTAAAQGLTTIVLEKTDRF--GGTSAYSGASIWLPGTQVQERAGLPDS-----------------TENARTYLRALLG------------------DAESERQDAYVETAPAVVALLEQNPNIEFEFRAFPDYYKAEGRMDTGRSINPLDLDPADI-----------------------GDLAGKVRPELDQDRTGQDHAP------------GPMIGGRALIGRLLAAVQSTGKAELRTESVLTSLIVEDG----------RVVGAEVESG----GETQRIKANRGVLMAAGGIEGNAEMREQAGTPGKAIWSMGPFGANTGDAISAGIAVGGATALL---DQAWFCPGVE-----QPDGSAAFMV-GVRGG------LVVDSAGERYLNESL-------------------PYDQFGRAMDAHDDNGSAVPSFMIFDSREGGGLPAICIPNTA-PAKHLEAGTWVGADTLEELAAKTGLPADALRSTVEKFNDAAKLGVDEEFHRGEDPYDAFFC----------------------PPNGGANAALTAIENGPFYAARIVLSDLGT-----------KGGLVTDVNGRVLRADGSAID--GLYAAGNTSASLSGRFYPGPGVPLGTAMVFSYRAAQDMAK--------------

General information: TITO was launched using: RESULT: Template: 4C3X.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 : 3222 42775 13.28 86.76 target 2D structure prediction score : 0.46 Monomeric hydrophicity matching model chain A : 0.65 3D Compatibility (PKB) : 13.28 2D Compatibility (Sec. Struct. Predict.) : 0.46 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.181

(partial model without unconserved sides chains): PDB file : Tito_4C3X.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4C3X-query.scw PDB file : Tito_Scwrl_4C3X.pdb: