Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTIDWQKEVEARKEDLLEDLKNLLRVNSERDDSKVTPDAPFGPGPRDALKHMLAYGERDGFKVKNV--DNYAGHI-DLGEGDETLGIFGHMDVVPAG--DGWDTDPYEPVIKDGKIFARGSSDDKGPSMAAYYAMKIIKELDLKLSKKVRFVVGSDEESGW-GDMAYYFEH----EEEPDFGFSPDAEFP------IINGEKGNVSLALRFKGDNAGDYVLKSFVSGLRENMVPGTATAALQVPSADAAIAMEEAFYQFIEANPVSGTIEADNTYVKIELVGKGAHGASPQSGINAGSFLALFLDNYEFLGSAKQFIHVAAAYVHEDFYGEKLGVAYEDEKMGKLTMNAGLFAFEE---NGTEEANFINMNFRFPKGVTVDGLQSDIEQTVGQEGATVTRG--ARVMEPHYVPMDDPLVATLLQVYEDHTGEKGYEQIIGGGTYGRLLK----RGVAYGAMFPGYTDTMHQANEFMSLDDLFRATAIYADAIYRLAK 4PQA Chain:A ((2-376)) -----------TETQSLELAKELISRPSVTPD------------DRDCQKLLAERLHKIGFAAEELHFGDTKNIWLRRGTKAPVVCFAGHTDVVPTGPVEKWDSPPFEPAERDGRLYGRGAADMKTSIACFVTACERFVAKHPNHQGSIALLITSDEEGDALDGTTKVVDVLKARDELIDYCIVGEPTAVDKLGDMIKN---------------------------------------------------------------------GRRGSLSGNLTVKGKQGHIAYPHLAINPVHTFAPALLELTQE-----VWD---E---------------GNEYFPPTSFQISNINGGTGATNVIPGELNVKFNFRFSTESTEAGLKQRVHAILDKHGVQYD-LQWSCSGQPFLTQ-AGKLTDVARAAIAETCGIEAELSTTGGTSDGRFIKAIAQELIELGPSNA----TIHQINENVRLNDIPKLSAVYEGILARLL-

General information: TITO was launched using: RESULT: Template: 4PQA.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 : 1885 67001 35.54 191.43 target 2D structure prediction score : 0.67 Monomeric hydrophicity matching model chain A : 0.65 3D Compatibility (PKB) : 35.54 2D Compatibility (Sec. Struct. Predict.) : 0.67 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.511

(partial model without unconserved sides chains): PDB file : Tito_4PQA.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4PQA-query.scw PDB file : Tito_Scwrl_4PQA.pdb: