Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSTKPLSILQPGTGLFNTHVTLEDVNKAIKEQMSTESELT--AESKMEVIGEGNGFSSCVILITCHWTIPS-SHLPKKLILKIVSFVHVQGLLNKSNEEGNSVMSPEEEAHVHAHFEKSCQKGHNLEVEFCEAFGHLEGLLLPKVFFSQKFEEDNPNKGFVGMEFVEGSVVRHCYENVTVDELQPILKALARLQALSLSTESCRNLDNGEAFEESLMDMLSEDGLKGIF-DQSRNIDQKLSEKVERIEQNHKEILNLETVLNLNKVVGIDQKVICHGDLWAANILWTQT--DGGFIADKVLDYQESHMGNPAEDLVRLLVSTISG---------------ADRQSHWEHILEQFYTYFTDEIGS---NNAPYTLEQLKTSFKLYFPVGALTLISLFGPAVDMKLQGMESGKAENYRRIVIEKVDCLLDDVLNFHDFNKKFTGKN 5FTG Chain:A ((7-340)) -------------------RTRRRAYLWCKEFLPGAWRGLREDEFHISVIRG--GLSNMLFQCSLPDTTATLGDEPRKVLLRLYG-------------------------------E-----AMVLESVMFAILAER-SLG-PKLYGIFP--------QGRLEQFIPSRRLDTEE-LSLPDISAEIAEKMATFHGMKMPFNKEPKWL-----FGTMEKYLK--EVLRIKFTEESRI-KKLHKLLSY---NLPLELE-NLRSLLES-TP-SPVVFCHNDCQEGNILLLEGRENSEKQKLMLIDFEYSSYNYRGFDIGNHFCEWMYDYSYEKYPFFRANIRKYPTKKQQLHFISSYLPAFQNDFENLSTEEKSIIKEEMLLEVNRFALASHFL-----------------------------------------------------

General information: TITO was launched using: RESULT: Template: 5FTG.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 : 1080 -2587 -2.39 -9.08 target 2D structure prediction score : 0.54 Monomeric hydrophicity matching model chain A : 0.63 3D Compatibility (PKB) : -2.39 2D Compatibility (Sec. Struct. Predict.) : 0.54 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.315

(partial model without unconserved sides chains): PDB file : Tito_5FTG.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5ftg-query.scw PDB file : Tito_Scwrl_5FTG.pdb: