REMARK SOURCE hebe.pdb HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 21-MAY-01 1J8B COMPND YBAB; COMPND 3 CHAIN: A; COMPND 4 SYNONYM: HYPOTHETICAL PROTEIN HI0442; COMPND 5 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HAEMOPHILUS INFLUENZAE RD; SOURCE 3 ORGANISM_TAXID: 71421; SOURCE 4 STRAIN: KW20; SOURCE 5 GENE: HI0442; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: B834 (DE3); SOURCE 9 EXPRESSION_SYSTEM_VECTOR_TYPE: PET15B; SOURCE 10 EXPRESSION_SYSTEM_PLASMID: PET15B-HI0442 AUTHOR K.LIM,A.TEMPCYZK,J.TOEDT,J.F.PARSONS,A.HOWARD,E.EISENSTEIN, AUTHOR 2 O.HERZBERG,STRUCTURE 2 FUNCTION PROJECT (S2F) HET MSE A 11 8 HET MSE A 17 16 HET MSE A 21 8 HET MSE A 24 8 HET MSE A 62 8 HET MSE A 68 8 HET MSE A 92 8 >LEU.A 7 41.85 -4.52 18.12 41.45 -3.71 16.16 41.65 -4.11 17.14 3 0 1000.00 -999 ? >GLY.A 8 42.10 -5.73 22.20 41.56 -5.99 21.76 41.83 -5.86 21.98 1 0 1000.00 -999 ? >GLY~A 9 38.86 -7.71 22.30 38.86 -6.91 21.95 38.86 -7.31 22.12 1 0 1000.00 -999 ? >LEU~A 10 34.12 -7.79 21.53 33.85 -8.93 19.65 33.98 -8.36 20.59 3 0 1000.00 -999 ? >MET?A 11 34.48 -5.11 25.21 32.33 -4.45 27.61 33.41 -4.78 26.41 2 0 1000.00 -999 ? >LYS~A 12 37.63 -2.96 24.83 44.13 -2.59 25.15 40.88 -2.78 24.99 2 0 1000.00 -999 ? >GLN~A 13 37.67 -3.12 19.27 37.32 -4.35 17.61 37.50 -3.73 18.44 2 0 1000.00 -999 ? >ALA~A 14 33.15 -1.15 22.51 32.26 -2.21 23.16 32.71 -1.68 22.83 2 0 1000.00 -999 ? >GLN~A 15 36.09 0.72 27.50 34.70 -0.55 28.44 35.40 0.08 27.97 2 0 1000.00 -999 ? >GLN~A 16 38.81 1.57 23.14 40.45 0.75 22.05 39.63 1.16 22.59 2 0 1000.00 -999 ? >MET?A 17 33.88 3.59 20.66 32.47 1.60 17.37 33.18 2.60 19.01 2 0 1000.00 -999 ? >GLN~A 18 30.58 3.23 24.70 28.69 3.88 23.97 29.63 3.55 24.34 2 0 1000.00 -999 ? >GLU~A 19 36.19 6.04 26.58 37.77 4.58 26.82 36.98 5.31 26.70 2 0 1000.00 -999 ? >LYS~A 20 35.64 8.41 21.14 40.60 9.27 21.88 38.12 8.84 21.51 2 0 1000.00 -999 ? >MET?A 21 32.00 9.15 20.56 30.13 8.59 17.88 31.06 8.87 19.22 2 0 1000.00 -999 ? >GLN~A 22 31.98 11.81 26.24 32.00 11.11 28.26 31.99 11.46 27.25 2 0 1000.00 -999 ? >LYS~A 23 35.21 12.97 22.72 39.95 11.54 18.87 37.58 12.26 20.80 2 0 1000.00 -999 ? >MET?A 24 33.66 13.94 19.30 34.00 14.86 16.21 33.83 14.40 17.76 2 0 1000.00 -999 ? >GLN~A 25 28.33 14.36 21.32 27.07 13.08 22.39 27.70 13.72 21.86 2 0 1000.00 -999 ? >GLU~A 26 32.99 16.32 25.48 34.20 14.97 26.67 33.59 15.65 26.08 2 0 1000.00 -999 ? >GLU~A 27 36.30 18.45 18.37 37.09 17.04 17.10 36.70 17.75 17.74 2 0 1000.00 -999 ? >ILE~A 28 30.37 18.57 17.98 29.53 17.91 17.01 29.95 18.24 17.50 3 0 1000.00 -999 ? >ALA~A 29 30.29 21.44 21.44 29.99 20.82 22.78 30.14 21.13 22.11 2 0 1000.00 -999 ? >GLN.A 30 35.24 22.23 22.21 35.69 23.05 24.10 35.46 22.64 23.16 2 0 1000.00 -999 ? >LEU.A 31 31.68 24.66 16.73 32.95 23.50 15.34 32.32 24.08 16.03 3 0 1000.00 -999 ? >GLU^A 32 32.18 29.76 19.62 33.63 31.29 20.03 32.90 30.52 19.83 2 0 1000.00 -999 ? >VAL^A 33 27.26 30.02 16.65 25.79 28.47 17.14 26.53 29.25 16.89 3 0 1000.00 -999 ? >THR^A 34 26.09 33.64 16.65 27.31 35.36 16.24 26.70 34.50 16.45 2 0 1000.00 -999 ? >GLY^A 35 22.44 34.21 17.28 23.05 34.84 17.32 22.75 34.52 17.30 1 0 1000.00 -999 ? >GLU^A 36 20.65 37.55 13.93 18.68 38.39 13.49 19.67 37.97 13.71 2 0 1000.00 -999 ? >SER^A 37 17.63 39.54 17.01 17.86 40.70 19.06 17.74 40.12 18.04 2 0 1000.00 -999 ? >GLY.A 38 16.41 42.73 15.26 16.85 42.13 14.93 16.63 42.43 15.09 1 0 1000.00 -999 ? >ALA.A 39 18.06 41.95 11.96 17.41 42.86 10.89 17.74 42.40 11.43 2 0 1000.00 -999 ? >GLY.A 40 21.52 42.14 13.69 20.92 42.54 14.03 21.22 42.34 13.86 1 0 1000.00 -999 ? >LEU.A 41 19.23 45.23 16.67 18.49 47.07 15.86 18.86 46.15 16.26 3 0 1000.00 -999 ? >VAL^A 42 21.92 42.32 18.90 21.15 42.20 20.98 21.53 42.26 19.94 3 0 1000.00 -999 ? >LYS^A 43 24.33 39.49 18.03 25.33 42.97 14.08 24.83 41.23 16.06 2 0 1000.00 -999 ? >ILE^A 44 24.22 36.68 21.80 23.67 36.81 23.17 23.94 36.75 22.49 3 0 1000.00 -999 ? >THR^A 45 28.01 34.31 20.33 29.71 34.50 19.04 28.86 34.40 19.69 2 0 1000.00 -999 ? >ILE^A 46 26.43 30.74 22.90 24.98 30.77 22.95 25.71 30.75 22.93 3 0 1000.00 -999 ? >ASN^A 47 30.76 27.20 22.51 30.93 27.01 24.59 30.85 27.11 23.55 2 0 1000.00 -999 ? >GLY.A 48 27.70 24.09 22.32 27.93 24.52 22.92 27.82 24.30 22.62 1 0 1000.00 -999 ? >ALA.A 49 27.93 24.13 26.12 29.27 24.23 26.76 28.60 24.18 26.44 2 0 1000.00 -999 ? >HIS.A 50 23.78 26.28 25.61 22.67 25.13 24.25 23.22 25.70 24.93 3 0 1000.00 -999 ? >ASN.A 51 30.40 29.06 27.26 31.63 30.45 28.39 31.02 29.76 27.82 2 0 1000.00 -999 ? >CYH^A 52 28.42 33.16 26.04 27.34 35.54 25.82 27.88 34.35 25.93 2 0 1000.00 -999 ? >ARG^A 53 33.94 31.61 23.52 36.59 33.07 22.76 35.26 32.34 23.14 2 0 1000.00 -999 ? >ARG^A 54 33.14 37.46 20.12 32.41 36.26 17.35 32.78 36.86 18.73 2 0 1000.00 -999 ? >ILE^A 55 26.99 40.32 24.14 25.80 40.03 24.97 26.40 40.18 24.56 3 0 1000.00 -999 ? >ASP^A 56 28.10 42.71 18.91 28.48 44.47 17.84 28.29 43.59 18.37 2 0 1000.00 -999 ? >ILE^A 57 24.58 46.02 22.49 23.91 46.10 23.70 24.25 46.06 23.09 3 0 1000.00 -999 ? >ASP.A 58 22.84 48.13 17.51 22.85 49.62 16.09 22.85 48.87 16.80 2 0 1000.00 -999 ? >PRO~A 59 26.76 51.57 18.33 24.93 51.04 19.45 25.85 51.30 18.89 3 0 1000.00 -999 ? >SER~A 60 21.42 52.88 18.91 19.83 51.44 17.64 20.62 52.16 18.27 2 0 1000.00 -999 ? >LEU~A 61 19.99 49.08 21.48 18.90 47.81 20.05 19.44 48.44 20.76 3 0 1000.00 -999 ? >MET?A 62 21.85 52.35 24.39 24.05 50.08 25.47 22.95 51.21 24.93 2 0 1000.00 -999 ? >GLU~A 63 21.02 56.03 22.08 21.09 57.05 20.23 21.06 56.54 21.16 2 0 1000.00 -999 ? >ASP~A 64 15.22 53.90 23.28 15.14 55.62 22.11 15.18 54.76 22.69 2 0 1000.00 -999 ? >ASP~A 65 12.37 51.59 26.60 11.22 51.42 28.42 11.79 51.50 27.51 2 0 1000.00 -999 ? >LYS~A 66 15.97 49.56 28.54 15.52 47.47 33.85 15.75 48.52 31.20 2 0 1000.00 -999 ? >GLU~A 67 10.52 46.57 28.38 8.51 47.21 28.01 9.51 46.89 28.19 2 0 1000.00 -999 ? >MET?A 68 13.44 47.05 24.42 10.74 47.43 22.61 12.09 47.24 23.51 2 0 1000.00 -999 ? >LEU~A 69 18.24 47.11 25.43 20.36 46.72 25.19 19.30 46.92 25.31 3 0 1000.00 -999 ? >GLU~A 70 16.34 44.60 29.63 15.14 45.32 31.25 15.74 44.96 30.44 2 0 1000.00 -999 ? >ASP~A 71 12.55 42.83 24.41 11.10 43.22 25.91 11.82 43.02 25.16 2 0 1000.00 -999 ? >LEU~A 72 16.78 43.30 21.31 15.67 44.26 19.65 16.22 43.78 20.48 3 0 1000.00 -999 ? >ILE~A 73 19.62 40.98 25.55 20.52 41.45 26.41 20.07 41.21 25.98 3 0 1000.00 -999 ? >ALA~A 74 16.71 37.71 25.35 15.48 37.81 26.26 16.09 37.76 25.80 2 0 1000.00 -999 ? >ALA~A 75 15.59 37.08 21.71 14.88 38.13 20.81 15.24 37.60 21.26 2 0 1000.00 -999 ? >ALA~A 76 19.25 36.97 20.52 20.24 38.13 20.67 19.75 37.55 20.59 2 0 1000.00 -999 ? >PHE~A 77 21.17 35.26 25.46 23.34 36.42 26.87 22.26 35.84 26.17 3 0 1000.00 -999 ? >ASN~A 78 15.75 32.51 22.52 15.25 32.79 24.57 15.50 32.65 23.55 2 0 1000.00 -999 ? >ASP~A 79 18.28 33.70 17.83 18.66 33.30 15.78 18.47 33.50 16.80 2 0 1000.00 -999 ? >ALA~A 80 21.82 31.45 19.47 22.75 32.25 20.39 22.29 31.85 19.93 2 0 1000.00 -999 ? >VAL~A 81 20.62 28.51 21.54 19.98 28.13 23.62 20.30 28.32 22.58 3 0 1000.00 -999 ? >ARG~A 82 14.91 29.16 18.19 15.60 31.43 16.24 15.25 30.30 17.21 2 0 1000.00 -999 ? >ARG~A 83 22.03 31.17 14.87 21.80 32.81 12.29 21.92 31.99 13.58 2 0 1000.00 -999 ? >ALA~A 84 23.69 25.84 18.62 24.01 26.27 20.11 23.85 26.05 19.36 2 0 1000.00 -999 ? >GLU~A 85 19.95 23.47 21.00 18.12 23.80 22.02 19.03 23.63 21.51 2 0 1000.00 -999 ? >GLU~A 86 19.95 23.43 12.84 18.91 21.56 12.61 19.43 22.49 12.72 2 0 1000.00 -999 ? >LEU~A 87 25.67 23.79 15.13 27.93 23.79 15.49 26.80 23.79 15.31 3 0 1000.00 -999 ? >GLN~A 88 24.72 20.84 19.74 26.71 21.75 19.97 25.71 21.29 19.86 2 0 1000.00 -999 ? >LYS~A 89 22.66 17.67 15.38 17.30 16.37 14.60 19.98 17.02 14.99 2 0 1000.00 -999 ? >GLU~A 90 24.22 20.12 9.90 26.32 20.12 9.66 25.27 20.12 9.78 2 0 1000.00 -999 ? >LYS~A 91 27.64 18.18 12.65 30.36 22.37 10.14 29.00 20.28 11.40 2 0 1000.00 -999 ? >MET?A 92 27.10 14.85 14.45 28.42 12.71 16.69 27.76 13.78 15.57 2 0 1000.00 -999 ? >ALA~A 93 25.01 13.49 11.56 23.71 14.14 11.06 24.36 13.81 11.31 2 0 1000.00 -999 ? >SER~A 94 27.77 14.69 9.21 28.87 16.36 7.88 28.32 15.53 8.54 2 0 1000.00 -999 ? >VAL~A 95 30.63 13.17 11.15 31.85 13.66 12.94 31.24 13.42 12.04 3 0 1000.00 -999 ? >THR~A 96 28.81 9.82 11.35 27.52 9.86 13.13 28.17 9.84 12.24 2 0 1000.00 -999 ? >ALA.A 97 28.89 9.46 7.57 30.21 9.62 6.79 29.55 9.54 7.18 2 0 1000.00 -999 ? >GLY.A 98 26.47 6.57 7.58 26.07 7.20 7.93 26.27 6.88 7.75 1 0 1000.00 -999 ?