Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MREPDFLNHFLKKGYFKKHAKAVLALSGGLDSMFLFKVLSTYQKE-LEIELILAHVNHKQRIESDWEEKELRKLAAEAELPIYISNFS----GEFSEARARNFRYDFFQEVMKKTGATALVTAHHADDQVETIFMRLIRGTRLRYLSGIKEKQVVGEIEIIRPFLHFQKKDF------PSIFHFEDTSNQENHYFRNRIRNSYLPELEKENPRFRDAILGIGNEILDYDLAIAELSN-NINV-------EDLQQLFSYSESTQRVLLQTYLNRFP-DLNLTKAQFAEVQQIL-K-FK-SQYRHPIKNGYELIKEYQQFQICKISPQADEKEDELVLHYQNQ-VA-YQ--GYLFSFGLPLEGELIQQIP-VSRETSIHIRHRKTGDVLIK-N-GHRKKLRRLFIDLKIPMEKRNSALIIEQFGEIVSILGIATNNLSKKTKNDIMNTVLYIEKIDR 1NI5 Chain:A ((2-416)) --------TLTLNRQLLTSRQILVAFSGGLDSTVLLHQLVQWRTENPGVALRAIHVHHGLSANADAWVTHCENVCQQWQVPLVVERVQLAQEGLGIEAQARQARYQAFARTLL--PGEVLVTAQHLDDQCETFLLALKRGSGPAGLSAMAEVSEFAGTRLIRPLLARTRGELVQWARQYDLRWIEDESNQDDSYDRNFLRLRVVPLLQQRWPHFAEATARSAALCAEQESLLDELLADDLAHCQSPQGTLQIVPMLAMSDARRAAII-RRWLAGQNAPMPSRDALVRIWQEVALAREDASPCLRLGA-FEIRRYQSQLWWIKSVTGQ--SENIVPWQTWLQPLELPAGLGSV-----QLN--AGGDIRPPRADEAVSVRFKAPGL-LHIVGRNGGRKLKKIWQELGVPPWLRDTTPLLFYGETLIAAAGVFVTQEGV------------------

General information: TITO was launched using: RESULT: Template: 1NI5.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 : 1569 -25569 -16.30 -66.41 target 2D structure prediction score : 0.59 Monomeric hydrophicity matching model chain A : 0.68 3D Compatibility (PKB) : -16.30 2D Compatibility (Sec. Struct. Predict.) : 0.59 1D Compatibility (Hydrophobicity) : 0.68 QMean score : 0.398

(partial model without unconserved sides chains): PDB file : Tito_1NI5.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1NI5-query.scw PDB file : Tito_Scwrl_1NI5.pdb: