Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTAHDQELRRRAYEEVEKKEPIANSDPHRQHFHIMPPVGLLNDPNGVIYWKGSYHVFFQWQPFQTGHG-AKFWGHYTTQDVVNWKREEIALAPSDWFDKNGCYSGSAVTKDDRL-YLFYTGNVRDQDGNRETYQCLA----VSDDGLS---FEKKGVVARLPEGYTAH-FRDPK-VW-EHEGTWYMVIGAQTENLKGQAVLFASDNLTEW-RFLGPITGAGFNGLDDFGYMWECPDLF-----SLQGSDVLIV--SPQGLEADGFRYQNVYQSG-YFVGRLDYNKPELKHGEFTELDQGFD---FYAPQTLEDD-QGRRILFAWMAVPDQDEGSHPTIDCHWIHCMTLPRQLTL--SGQKLIQQPLPELKAMRRNEKKIHINMHGSSGALPVEKPERTEILLEDIHTESGFSISIRGTATFSFHKDEGIVTLERKSFDGKRTEARHCRIKDLHTVHMFLDASSVEIFINNGEEVLSARYFPFPGNHEVTASATGKSEMNVGIWTLM 2AEZ Chain:A ((6-345)) --------------------------PYRTGYHFQPPSNWMNDPNGPMLYQGVYHFFYQYNPYAATFGDVIIWGHAVSYDLVNWIHLDPAIYPTQEADSKSCWSGSATILPGNIPAMLYTGS----DSKSRQVQDLAWPKNLSDPFLREWVKHPKNPLITPPEGVKDDCFRDPSTAWLGPDGVWRIVVGGDRDN-NGMAFLYQSTDFVNWKRYDQPLSSADATG------TWQCPDFYPVPLNSTNGLDTSVYGGSVRHVMKAGFEGHDWYTIGTYSPDRENFLPQNGLSLTGSTLDLRYDYGQFYASKSFFDDAKNRRVLWAW--VPETDSQAD-DIEKGWAGLQSFPRALWIDRNGKQLIQWPVEEIEELRQNQVNLQ------------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 2AEZ.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 : 1870 16697 8.93 53.35 target 2D structure prediction score : 0.59 Monomeric hydrophicity matching model chain A : 0.70 3D Compatibility (PKB) : 8.93 2D Compatibility (Sec. Struct. Predict.) : 0.59 1D Compatibility (Hydrophobicity) : 0.70 QMean score : 0.369

(partial model without unconserved sides chains): PDB file : Tito_2AEZ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2AEZ-query.scw PDB file : Tito_Scwrl_2AEZ.pdb: