Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MMEVGILPVHVLYVFFIGAIILFMLLRKDTTFISLFGIFIISLWASHSLSASVSSLFHSFIYAAGELLPTIFIICFIVSMSDLLTKTGINEAMISPFASLVRGPVTAYWLIGGLMFAISLFFWPSPGVALIGAVLLPAAARAGLTPLAAAMAMNLFGHGFAL----SGDFVIQAAPKLTADAAGIP--VG-DVVSASIPLVLIMGVTTTTAAFIMIQRERKKQEHPTSFSPVLSG---EQDNSLY--LPKRLRSILAFLI-PLAFLADIACMLLFNL--QGND------------ATALIGGSAICILFTVHFFVYKHKGLEKITGYFIDGFKFGFKVFGPVIPIAAFFYLGDSGYESILGTSLPKGSHGIVNDLGIALSHMMPM---SKEL-AATALTAAGAITGLDGSGFSGISLAGSIAKLFSSALHADPAILTALGQISAIWVGGGTLVPWA--LIPAAAI-CK----VDPFELARKNFIPVAIGLLVTTLAAVMML 4R1I Chain:A ((80-500)) -----------------------------------------------------IKILTHTVKNFTGFAPLGTV-LVSLLGVGIAEKSGLISALMRLLLTKSPRK--LTTFMVVFTGILSNTA-SELGYVVLIPLSAVIFHSLGRHPLAGLAAAFAGV-SGGYSANLFLGTIDPLLAGITQQAAQIIHPDYVVGPEANWFFMAASTFVIALIGYFVTEKIVEPQLGPYQSDLSQEEKDIRHSNEITPLEYKGLIWAGVVFIALSALLAWSI--VPADGILRHPETGLVAGSPFLKSIVVFIFLLFALPGIVYGRITRSLRGEREVVNAMAESMSTLGLYLVI--IFFA----------AQFVAFF--NWTNIGQYIAVKGAVFLKEVGLAGSVLFIGFILICAFINLMIGSASAQWAVTAPIFVPMLMLAGYAPEVIQAAYRIGDSV--TNIITPMMSYFGLIMATVMKYKKDAGVGTLISMMLPYSAFFLIAWIALF----

General information: TITO was launched using: RESULT: Template: 4R1I.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 : 1810 -248798 -137.46 -649.60 target 2D structure prediction score : 0.61 Monomeric hydrophicity matching model chain A : 0.58 3D Compatibility (PKB) : -137.46 2D Compatibility (Sec. Struct. Predict.) : 0.61 1D Compatibility (Hydrophobicity) : 0.58 QMean score : 0.282

(partial model without unconserved sides chains): PDB file : Tito_4R1I.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4R1I-query.scw PDB file : Tito_Scwrl_4R1I.pdb: