Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MVMSDNTKYIFLSPHLDDAIFSCGDYISKLTSEGEIVLVITIFSGYPLSQQLQPSAKQFHKLCNLGKYPIEERKKEDRLACERLQCD-FRHLSYYECLYRKDRNGNFLYRHIYSELKNEDTLKNDIIKELLMHLDDKCVVYCPLSLGDHVDHVFVNSIGRALEFM-RYKVIYYEDFPYVSDSSMVSYM-GKTKELKMYQEELDEKHYIDRISSILCYKSQILIIWKS----VEKLLNNIKELYLRNGA-AYSIRFWIKK 1UAN Chain:A ((1-216)) -----MLDLLVVAPHPDDGELGCGGTLARAKAEGLSTGILDLTRGEMGSKG-----------------TPEEREKEVAEASRILGLDFRGNLGFPDGGLAD-----------------VPEQRLKLAQ--ALRRLRPRVVFAPLEADRHPDHTAASRLAVAAVHLAGLRKAPLEGEPFRVERLFFYPGNHPF--APSFLVKIS-AFIDQWEAAVLAYRSQFT-----VGPKGVEARKAMRRYWGNYLGVDYAEPFVSP-

General information: TITO was launched using: RESULT: Template: 1UAN.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 : 1069 -42449 -39.71 -211.19 target 2D structure prediction score : 0.62 Monomeric hydrophicity matching model chain A : 0.65 3D Compatibility (PKB) : -39.71 2D Compatibility (Sec. Struct. Predict.) : 0.62 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.390

(partial model without unconserved sides chains): PDB file : Tito_1UAN.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1UAN-query.scw PDB file : Tito_Scwrl_1UAN.pdb: