Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTDKFSRWSTLFSQNLSRDWKKILIWLVGVTAFSGGF-VPAFEELTSGQGLAGLYETLQNPAMIAMVGPTPAS-------NAAEYTLGAMYANEMLLFCSLFAAVISVLHVVSQTRKKEELGLIELIRSFRVGRQANSLAVIAESILINLLLAISISCTMIFFQADSITAEGAWLFGLSVGSMGILGSAVALFAAQLMPSSASSNGLSLAFLGGL-YL-LRAITDVADSSLSMWNPLGWSYLTYPFTTNNWIPLLYLFLFSLILIISSFVLEEHRDLNTGYI-PEREGKPYAKRSLLSLRGLLFYLNKGMTI-SWLITFGLMGAAYGSIYGNMQQFLESNDLMKQMFIQSGVSIEKNFTSTIMVVLICLAAILPIASINRLFTEETHGRMNQLFATKISRNQLYWTNMLLAILF-AILAILISSGALGLSALASMKDAKDMDLLMFLKAGFNFLPAVLVFIG-ISGFLFGWL-PRIGKLAYIYLAYSFALNYFGGIL-DLPEWFSKTAVPSWVPRMPNDSFDLSVFLTLSCISLALFVLGSIGYRRRDLLEG 2PH5 Chain:A ((6-474)) --------------NTKKILFKNRFVILGFGCVGQALMPLIFEKFDIKPSQVTIIAAEGTKVDVAQQYGVSFKLQQITPQNYLEVIGSTLEENDFLIDVSIGISSLALIILCNQKG----------ALYINAATEPWKERRTNYSLREEVLRLKDKTQKTALITH-----------GANPGLVSHFIKEALLNIAKDNGLTINRPKNAAEWANLAMTLGIKVIHVAEQDSQVTYPPKS--------------PGEFVNTWS----ANGLILEGLQPAEIGWGTHEAHWPHDAYSHSNGPQCAIYLSRPSAGVMVRSWT-----PTLGAFHGFLITHAETISLTNFLTLKNG----SELLYRPTVHYAYNPCPDARLSIFELKSNE----WKPQNKNRLILNEIIDGCDELGVLLMGN-----QRGAYWYGSTLSIQEARQI-------APYNNATSLQVVASMISGIIWAIEHPDEGIVEPEEVDHQYIIDIAKPYLGKVGGYYTDWTPLKNRGELYPEEVDLSDPWQFFNIRVNLE---------------

General information: TITO was launched using: RESULT: Template: 2PH5.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 : 2638 -101398 -38.44 -228.89 target 2D structure prediction score : 0.43 Monomeric hydrophicity matching model chain A : 0.62 3D Compatibility (PKB) : -38.44 2D Compatibility (Sec. Struct. Predict.) : 0.43 1D Compatibility (Hydrophobicity) : 0.62 QMean score : 0.229

(partial model without unconserved sides chains): PDB file : Tito_2PH5.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2PH5-query.scw PDB file : Tito_Scwrl_2PH5.pdb: