Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ------------------------------------------------------------------------------------------------------------------------MCINF-------LVCASLSMFRTSV----SGARVPI------GAWPDRGGEVRDAVLSVFRRNEYMREIDTGAR-----VASPGTGCD----------GLVGTCPVDKPVDSVAVGVLARFLAQLTLVRKEALPALPAEWSRNERDSRAYLDTLVRHAKRRMLD-------PNWTAIGG--LFAVLGVPGDRLVRFAEQVPAMSRRPYGLLLTNLARDNVTI------LEGPKLAEAGL-----DWTSASYGDPLHGLAGHVVRMRYPQDQVNEVVQAWACEMRRIRPPAVSGL----DRDLPYYLD-FERIHAAYDDVIRAARSLGDSIENLALLAAASDIGTALKRAAGLLGMSEVPPEKEIADALFRWQAARLVRAAERVPDSLFRWRCDDRVPERDDFPSDLVRRALAVEGVAPADRVFRGTAHLNTVVQLENYPDPVVVRRETAAAPRREQGLLPEHAVLQVIERSGVQVRAPRILALGYDDRRRHVAIHTYEGPGGRSPQHPVDGLLPAEADELVDELAALAEVDHSS--LPSNEPEGGFYRWLAERLADFVA------------ALPDATLRAADQRGLPDGDLLRQILGRYKVSDRAPVLLHGDLNPWNLVRAGRQGGLTIIDWEMGMIGDPLYD---LVRHLHLTPTRTEMRVRMFDRWSKKLPAECVVGWEE-DWRVYRYIEQIRSAYVDLDRMTTGAALSTPN----VRRAVDAYEMTLSAATGSLGLRRRVVPKVPASLKVS------ 1LLW Chain:A ((439-1239)) DAQTVLQQQAAFGYTAEDVEMVVVPMASQGKEPTFCMGDDTPLAVLSHKPRLLYDYFKQRFAQVTNPPIDPLRENLVMSLAMFLGKRGNLLEPKAEKLRSPLVNEVELQAIKTGQLQVAEVSTLYDLDGVNSLEDALTNLVKTAIATVQAGAEILVLTDRPNGAILTENQSFIPPLLAVGAVHHHLIR--AGLRLKASLIVDTAQCWSTHHFACLVGYGASAICP------YLALESVRQWW------LDEKTQKLMENGRLDRIDLPTALKNYRQSVEAGLFKILSKMGISLLASYHGAQIFEAIGLGAELVEYA---FAGTTSRVGGLTIADVAGEVMVFHGMAFPEMAKKLENFGFVNYRPGGEYHMNSPEMSKSLHKAVAAYY------DHYELYRQYLKDRPVTALRDLLDFNADQPAISLEEVESVESIVKRFCTGGMSLG---------ALSREAHETLAIAMNRLGAKSNSG-----------EGGEDVVRYLTLDDVDSEGNSPTLPHLHG----------LQNGDTANSAIKQIASGRFGVTPEYLMSGKQLEIKMAQGAK-PGEGGQLPGKKVSEYIAML-RRSK------------------------PGVTLISPPPHHDIYSIEDLAQLIYDLHQINPEAQVSVKLVAEIGIGTIAAGVAKANADIIQISGHDGGTGASPLSSIKHAGSPWELGVTEVHRVLMENQLRDRVLLRADGGLK------TGWDVVMAAL------MG---AEEYGFGSIAMIAEGCIMARVCHTNNCPVGVATQQERLRQRFKGVPGQVVNFFYFIAEEVRSLLAHLGYRSLDDIIGRTDLLKVRSDVQLSKTQNLTLDC-LLNLPDTKQNRQWLNHEP

General information: TITO was launched using: RESULT: Template: 1LLW.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 : 2961 11980 4.05 20.65 target 2D structure prediction score : 0.62 Monomeric hydrophicity matching model chain A : 0.62 3D Compatibility (PKB) : 4.05 2D Compatibility (Sec. Struct. Predict.) : 0.62 1D Compatibility (Hydrophobicity) : 0.62 QMean score : 0.179

(partial model without unconserved sides chains): PDB file : Tito_1LLW.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1llw-query.scw PDB file : Tito_Scwrl_1LLW.pdb: