Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ------------------MGLFTLKEV---------SHYLIENKNMAWSITMCLVAVLLTIF-----ILNLILGLLVHFFDY-------SEPIWWHALSPYFIALLLFIMVWS---VVTELYILRKGGHSLAKQ--LKARRLVKGESTPEEHAALKITEHLAQTFSLN-----------------VPTLYVLPDEVGVNALTAGFHSNDIVIILTWG----ALQNLDEL-----ELYGLLGHEFNQILSG-------EAVENTKLKILYSG-------LTTFSQWGSKLAKQGFKRYSPGYKHKF-----ETVFVAVGG-----------VIWLAGSLGVLITRFIKYLTLSG--RTFRNDQKTMRLLKNST--NAQTLLRIYVHHSGSQIHSAYSESIAHMCFANSLSPQSWMNIHPSI-----RERIYELNPTLLQD--LQLENLKKL--------------RNRPLFILFHVLEESE-TEIYTPWSSPQPLPLLRLSPISFALN-----DAIKPLSSDI-------RRNKKRPELIQ---------RALQTATGSREVMVAILMI------------------------RQYREFIPQDAPV--SHAIVDALLNLDGRIHIQIFHDACKNIGHMP-------ASIARQFLTKLALIIQEDGEIGLLDALLLERVKYELNLMPLHLPTAFEEVKPQIVRLIDA----LLHVQQI----NSPNQLEVRKRILRSLLNPDEMHIYDEISDEP--LDLAEILNDIAGLLLRDR-LSILAIVEMC-LWSDRIITQDELDVLELLYWRFGFESDEIVEQMQKKNSVMII---------------------------- 3UGM Chain:A ((169-1048)) KPKVRELVAHIVALSQHPAALGTVAVTYQHIITALATHEDIVGVGKQWSGARALEALLTDAGELRGPPLQLDTGQLVKIAKRGGVTAMEAVHASRNALTPLNLTPAQVVAIASNNGGKQALETVQRLLPVLCQAHGLTPAQVVAIASHDGGKQALETMQRLLPVLCQAHGLPPDQVVAIASNIGGKQALETVQRLLPVLCQAHGLTPDQVVAIASHGGGKQALETVQRLLPVLCQAHGLTPDQVVAIASHDGGKQALETVQRLLPVLCQAHGLTPDQVVAIASNGGGKQALETVQRLLPVLCQAHGLTPDQVVAIASNGGKQALETVQRLLPVLCQAHGLTPDQVVAIASHDGGKQALETVQRLLPVLCQTHGLTPAQVVAIASHDGGKQALETVQQLLPVLCQAHGLTPDQVVAIASNIGGKQALATVQRLLPVLCQAHGLTPDQVVAIASNGGGKQALETVQRLLPVLCQAHGLTPDQVVAIASNGGGKQALETVQRLLPVLCQAHGLTQVQVVAIASNIGGKQALETVQRLLPVLCQAHGLTPAQVVAIASHDGGKQALETVQRLLPVLCQAHGLTPDQVVAIASNGGGKQALETVQRLLPGLTQEQVVAIASNNGGKQALETVQRLLPVLCQAHGLTPDQVVAIASNGGGKQALETVQRLLPVLCQAHGLTPAQVVAIASNIGGKQALETVQRLLPVLCQDHGLTLAQVVAIASNIGGKQALETVQRLLPVLCQGLTQDQVVAIASNIGGKQALETVQRLLPVLCQDHGLTPDQVVAIASNIGGKQALETVQRLLPVLCQDHGLTLDQVVAIASNGGKQALETVQRLLPVLCQDHGLTPDQVVAIASNSG

General information: TITO was launched using: RESULT: Template: 3UGM.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 : 3307 -74962 -22.67 -118.24 target 2D structure prediction score : 0.50 Monomeric hydrophicity matching model chain A : 0.65 3D Compatibility (PKB) : -22.67 2D Compatibility (Sec. Struct. Predict.) : 0.50 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.238

(partial model without unconserved sides chains): PDB file : Tito_3UGM.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3UGM-query.scw PDB file : Tito_Scwrl_3UGM.pdb: