Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTSSGPGPRFLLLLPLLLPPAASASDRPRGRDPVNPEKLLVITVATAETEGYLRFLRSAEFFNYTVRTLGLGEEWRGGDVARTVGGGQKVRWLKKEMEKYADREDMIIMFVDSYDVILAGSPTELLKKFVQSGSRLLFSAESFCWPEWGLAEQYPEVGTGKRFLNSGGFIGFATTIHQIVRQWKYKDDDDDQLFYTRLYLDPGLREKLSLNLDHKSRIFQNLNGALDEVVLKFDRNRVRIRNVAYDTLPIVVHGNGPTKLQLNYLGNYVPNGWTPEGGCGFCNQDRRTLPGGQPPPRVFLAVFVEQPTPFLPR-------FLQRLLLLDYPPD---RVTLFLHNNEVFHEPHIADSWPQLQDHFSAVKLVGPEEALSPGEARDMAMDLCRQDPECEFYFSLDADAVLTNLQTLRILIEENRKVIAPMLSRHGKLWSNFWGALSPDEYYARSEDYVELVQRKRVGVWNVPYISQAYVIRGDTLRMELPQRDVFSGSDTDPDMAFCKSFRDKGIFLHLSNQ--HEFGRLLAT-SRYDTEHL-HPDLW-----QIFDNPVDWKEQYIHENYSRALEGEGIV--------EQPCPDVYWFPLLSEQMCDELVAEMEHYGQWSGGRHEDSRLAGGYENVPTVDIHMK-QVGYEDQWLQLLRTYVGPMTESLFP------GYHTKARAVMNFVVRYRPDEQPSLRPHHDSSTFTLNVALNHKGLDYEGGGCRFLRYDCVISSPRKGWALLHPGRLTHYHEGLPTTWGTRYIMVSFVDP 5KOE Chain:A ((13-476)) ---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------DKLLGGLLASGFD-EDSCLSRYQSVHYRKPSPYKPSSYLISKLRNYEKLHKRCGPGTESYKKALKQLDQDGDGECKYVVWISFSG------LGNRILSLASVFLYALLTDRVLLVDRG--KDMDDLFCEPFLGMSWLLPLD----FPMTDQFDGLNQESSRCYGYMVKNQVIDLSHLYLHLVHD-YGDHDKMFFCEGDQTFIG--KVPWL----IVKTDN--YFVPSLWLIPGFDDELNKLF---PQKATVFHHLGRYLFHPTNQVWGLVTRYYEAYLSHADEKIGIQVRVFDEDPG-PFQHVMDQISSCTQKEKLLPEVDTLVENTPKHKAVLVTSLNAGYAENLKSMYWEYPTSTG---------------EIIGVHQPSQEGYMHNGKALAEMYLLSLTDNLVTSAWSTFGYVAQGLGGLKPWILYRPENRTTPDP---SCGRAMSMEPCFHSPPF---------YDC---KAKTGIDTGTLVPHVRHCEDIS--WGLKLV-------

General information: TITO was launched using: RESULT: Template: 5KOE.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 : 2215 -17686 -7.98 -42.93 target 2D structure prediction score : 0.56 Monomeric hydrophicity matching model chain A : 0.61 3D Compatibility (PKB) : -7.98 2D Compatibility (Sec. Struct. Predict.) : 0.56 1D Compatibility (Hydrophobicity) : 0.61 QMean score : 0.288

(partial model without unconserved sides chains): PDB file : Tito_5KOE.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5KOE-query.scw PDB file : Tito_Scwrl_5KOE.pdb: