Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MANLKEIRAKVASIKSTQKITRAMQMVAASKMRRAQERMAQGRPYADNMRRVIAHLVQANPEYKHRYMVDRPVKRVGYIIVSSDRGLAGGLNINLFKKVVQHVKAQQEQSIEVQFALIGQKAVSFFK--N-YGGKVLGATTQI-GDAPSLEQLTGSVQVMLDAFDKGELDRIYLVSNGFVNAMTQKPKVEQLVPLAPAEEGDDLNRTYGWDYIYEPEAEELLNGLLVRYIESMVYQGVIENVACEQSARMVAMKAATDNAGQLIKDLQLIYNKLRQAAITQEISEIVGGAAAV 2XND Chain:G ((1-272)) -ATLKDITRRLKSIKNIQKITKSMKMVAAAKYARAERELKPARVYGVGSLALYEKADIK-----TP---E------LIIGVSSDRGLCGAIHSSVAKQMKSEAANL----KEVKIIGVGDKIRSILHRTHSDQFLV--TFKEVGRRPPTFGDASVIALELLNS--GYEFDEGSIIFNRFRSVISYKTEEKPIFSLDTISS-------AESMSIYDDIDADVLRNYQEYSLANIIYYSLKESTTSEQSARMTAMDNASKNASEMIDKLTLTFNRTRQAVITKELIEIISGAAAL

General information: TITO was launched using: RESULT: Template: 2XND.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain G - contact count / total energy / energy per contact / energy per residue : 1093 -39371 -36.02 -152.01 target 2D structure prediction score : 0.73 Monomeric hydrophicity matching model chain G : 0.75 3D Compatibility (PKB) : -36.02 2D Compatibility (Sec. Struct. Predict.) : 0.73 1D Compatibility (Hydrophobicity) : 0.75 QMean score : 0.427

(partial model without unconserved sides chains): PDB file : Tito_2XND.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2XND-query.scw PDB file : Tito_Scwrl_2XND.pdb: