Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MPFHSTPNKGGTFDMTVKVGINGFGRIGRLAFRRIKE---VSDDIEVVAIND-LTSPTMLAQLLQFDSTHGTYPGTVTATEDSIVVDGEATRVYAEP-DASKIPWAKENGVDIVLECTGFYTSEEKAKAHLDAGVKRVVISAPA-GAMKTIVYNVNDDTLDEND-KIISAGSCTTNCLAPMAYFLNNEFGIEVGTMTTVHAYTSTQMLLDGPVKGGNLRAARSAADNTIPHSTGAAKAIGLVIPELQGKLQGHAQRVPVVDGSLTELVSVLKTKVTADQVNEAIKKHTVDNPS--FGYDDRQIVS-SDVIGTTQGSIFDPTQ-TEVTTAGDFQLVKTVAWYDNEYGFTCQMIRLLEKFANL 1HDG Chain:O ((1-332)) ----------------ARVAINGFGRIGRLVYRIIYERKNPD--IEVVAINDL-TDTKTLAHLLKYDSVHKKFPGKVEYTENSLIVDGKEIKVFAE-PDPSKLPWKDL-GVDFVIESTGVFRNREKAELHLQAGAKKVIITAPAKGEDITVVIGCNEDQLKPE-HTIISCASCTTNSIAPIVKVLHEKFGIVSGMLTTVHSYTNDQRVLDLP-HKDLRRARAA-AVNIIPTTTGAAKAVALVVPEVKGKLDGMAIRVPTPDGSITDLTVLVEKETTVEEVNAVMKEATEGRLKGIIGYNDEPIVSS-DIIGTTFSGIFDATITNV----IGGKLVKVASWYDNEYGYSNRVVDTLELLLKM

General information: TITO was launched using: RESULT: Template: 1HDG.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain O - contact count / total energy / energy per contact / energy per residue : 1870 22003 11.77 68.55 target 2D structure prediction score : 0.60 Monomeric hydrophicity matching model chain O : 0.82 3D Compatibility (PKB) : 11.77 2D Compatibility (Sec. Struct. Predict.) : 0.60 1D Compatibility (Hydrophobicity) : 0.82 QMean score : 0.533

(partial model without unconserved sides chains): PDB file : Tito_1HDG.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1HDG-query.scw PDB file : Tito_Scwrl_1HDG.pdb: