REMARK SOURCE hebe.pdb HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 30-MAY-04 1WK2 COMPND HYPOTHETICAL PROTEIN; COMPND 3 CHAIN: A; COMPND 4 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS THERMOPHILUS; SOURCE 3 ORGANISM_TAXID: 274; SOURCE 4 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 5 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 6 EXPRESSION_SYSTEM_STRAIN: B834(DE3); SOURCE 7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 8 EXPRESSION_SYSTEM_PLASMID: PET11A AUTHOR Y.AGARI,S.YOKOYAMA,S.KURAMITSU,RIKEN STRUCTURAL GENOMICS/PROTEOMICS AUTHOR 2 INITIATIVE (RSGI) HET MSE A 1 8 HET MSE A 112 8 >MET?A 1 17.50 47.22 -0.78 15.18 50.38 1.19 16.34 48.80 0.21 2 0 1000.00 -999 ? >GLU.A 2 14.61 46.88 -5.95 12.76 46.06 -5.35 13.68 46.47 -5.65 2 0 1000.00 -999 ? >ARG.A 3 13.92 42.92 -7.22 10.94 42.96 -7.93 12.43 42.94 -7.57 2 0 1000.00 -999 ? >PRO.A 4 16.67 38.97 -3.69 17.68 40.96 -3.69 17.17 39.97 -3.69 3 0 1000.00 -999 ? >LYS.A 5 21.73 39.75 -4.37 24.25 41.02 -6.69 22.99 40.39 -5.53 2 0 1000.00 -999 ? >LEU.A 6 22.42 37.01 -0.71 24.48 37.67 -0.49 23.45 37.34 -0.60 3 0 1000.00 -999 ? >GLY^A 7 19.09 34.02 -1.46 19.82 33.85 -1.10 19.46 33.94 -1.28 1 0 1000.00 -999 ? >LEU^A 8 17.79 32.06 2.62 18.09 31.15 4.55 17.94 31.60 3.59 3 0 1000.00 -999 ? >ILE^A 9 18.28 26.77 0.26 18.88 26.76 -0.35 18.58 26.77 -0.04 3 0 1000.00 -999 ? >VAL.A 10 14.14 27.16 2.39 13.28 28.84 3.43 13.71 28.00 2.91 3 0 1000.00 -999 ? >ARG.A 11 14.83 21.72 3.16 14.08 21.08 0.26 14.45 21.40 1.71 2 0 1000.00 -999 ? >GLU.A 12 8.04 24.20 -0.87 7.21 26.14 -0.74 7.62 25.17 -0.80 2 0 1000.00 -999 ? >PRO~A 13 5.25 23.58 5.18 6.44 23.98 3.34 5.84 23.78 4.26 3 0 1000.00 -999 ? >TYR~A 14 9.01 25.79 6.67 8.17 23.64 8.24 8.59 24.71 7.46 3 0 1000.00 -999 ? >ALA~A 15 9.41 28.86 1.72 10.02 28.12 0.54 9.72 28.49 1.13 2 0 1000.00 -999 ? >SER~A 16 5.84 29.38 0.48 5.25 27.70 -1.18 5.54 28.54 -0.35 2 0 1000.00 -999 ? >LEU~A 17 4.66 29.66 5.22 3.33 28.14 6.00 4.00 28.90 5.61 3 0 1000.00 -999 ? >ILE~A 18 8.88 32.78 3.92 10.19 32.82 4.40 9.53 32.80 4.16 3 0 1000.00 -999 ? >VAL~A 19 6.82 34.60 0.53 7.74 33.29 -1.00 7.28 33.94 -0.23 3 0 1000.00 -999 ? >ASP~A 20 2.15 33.38 0.97 2.44 32.26 -0.80 2.30 32.82 0.09 2 0 1000.00 -999 ? >GLY.A 21 3.54 36.65 4.22 3.32 35.90 4.24 3.43 36.27 4.23 1 0 1000.00 -999 ? >ARG.A 22 -0.23 31.69 4.59 -1.84 29.32 5.70 -1.04 30.51 5.15 2 0 1000.00 -999 ? >LYS.A 23 5.63 33.22 8.27 9.17 29.60 10.00 7.40 31.41 9.13 2 0 1000.00 -999 ? >VAL.A 24 7.66 36.06 9.78 6.13 37.22 10.78 6.90 36.64 10.28 3 0 1000.00 -999 ? >TRP^A 25 9.79 36.44 13.78 10.28 35.77 17.62 10.03 36.11 15.70 3 0 1000.00 -999 ? >GLU^A 26 14.35 31.05 8.28 13.48 29.22 7.65 13.91 30.13 7.97 2 0 1000.00 -999 ? >ILE^A 27 13.62 28.38 13.33 13.43 28.98 14.67 13.52 28.68 14.00 3 0 1000.00 -999 ? >ARG^A 28 18.31 28.95 9.05 17.65 28.18 6.15 17.98 28.57 7.60 2 0 1000.00 -999 ? >ARG.A 29 20.98 23.69 13.40 21.05 22.18 16.06 21.01 22.93 14.73 2 0 1000.00 -999 ? >ARG.A 30 25.84 28.53 13.58 28.25 29.78 15.00 27.04 29.15 14.29 2 0 1000.00 -999 ? >LYS.A 31 22.65 34.21 13.70 24.37 37.49 18.24 23.51 35.85 15.97 2 0 1000.00 -999 ? >THR.A 32 23.68 36.32 10.73 22.47 36.34 8.97 23.08 36.33 9.85 2 0 1000.00 -999 ? >ARG.A 33 26.85 42.20 12.34 28.96 41.15 14.31 27.91 41.67 13.32 2 0 1000.00 -999 ? >HIS.A 34 21.58 39.39 4.75 20.67 40.11 3.00 21.13 39.75 3.87 3 0 1000.00 -999 ? >ARG.A 35 19.28 43.30 9.43 20.84 41.77 11.59 20.06 42.53 10.51 2 0 1000.00 -999 ? >GLY^A 36 17.76 43.88 3.80 17.77 43.10 4.01 17.76 43.49 3.90 1 0 1000.00 -999 ? >PRO^A 37 16.43 44.10 -0.31 16.69 42.48 1.20 16.56 43.29 0.45 3 0 1000.00 -999 ? >LEU^A 38 16.68 37.67 2.45 17.71 35.96 3.27 17.19 36.82 2.86 3 0 1000.00 -999 ? >GLY^A 39 15.66 36.00 -1.86 15.88 35.76 -1.08 15.77 35.88 -1.47 1 0 1000.00 -999 ? >ILE^A 40 12.28 32.90 -0.48 12.39 32.73 0.97 12.34 32.82 0.25 3 0 1000.00 -999 ? >VAL^A 41 15.01 29.81 -2.92 16.82 29.91 -4.17 15.91 29.86 -3.54 3 0 1000.00 -999 ? >SER^A 42 13.15 26.47 -2.83 11.39 25.33 -1.57 12.27 25.90 -2.20 2 0 1000.00 -999 ? >GLY.A 43 13.19 23.47 -5.17 13.59 24.20 -5.21 13.39 23.84 -5.19 1 0 1000.00 -999 ? >GLY.A 44 15.79 25.22 -7.30 15.11 25.53 -7.09 15.45 25.37 -7.20 1 0 1000.00 -999 ? >ARG^A 45 11.20 25.98 -9.48 11.33 25.55 -12.51 11.26 25.76 -11.00 2 0 1000.00 -999 ? >LEU^A 46 14.56 32.97 -7.27 15.52 34.55 -6.17 15.04 33.76 -6.72 3 0 1000.00 -999 ? >ILE^A 47 9.22 31.19 -5.00 10.01 31.00 -4.28 9.61 31.10 -4.64 3 0 1000.00 -999 ? >GLY^A 48 10.11 35.61 -3.92 10.83 35.23 -3.75 10.47 35.42 -3.84 1 0 1000.00 -999 ? >GLN^A 49 11.73 40.00 -2.19 12.77 41.57 -3.16 12.25 40.79 -2.67 2 0 1000.00 -999 ? >ALA^A 50 11.67 39.07 2.23 11.46 37.94 3.23 11.57 38.51 2.73 2 0 1000.00 -999 ? >ASP^A 51 12.98 43.16 4.26 12.86 44.08 2.37 12.92 43.62 3.31 2 0 1000.00 -999 ? >LEU^A 52 17.09 39.68 6.57 17.80 38.09 7.84 17.45 38.88 7.21 3 0 1000.00 -999 ? >VAL^A 53 15.34 43.23 9.42 13.20 43.65 9.35 14.27 43.44 9.38 3 0 1000.00 -999 ? >GLY^A 54 16.70 41.79 12.67 16.42 41.14 12.18 16.56 41.47 12.43 1 0 1000.00 -999 ? >VAL.A 55 17.58 38.52 14.43 19.14 37.33 13.43 18.36 37.93 13.93 3 0 1000.00 -999 ? >PRO.A 86 20.77 23.95 20.15 19.19 25.39 20.82 19.98 24.67 20.49 3 0 1000.00 -999 ? >LEU.A 87 16.46 27.39 17.62 15.95 25.35 17.14 16.20 26.37 17.38 3 0 1000.00 -999 ? >TYR^A 88 20.11 32.06 16.86 22.43 32.05 18.44 21.27 32.06 17.65 3 0 1000.00 -999 ? >ALA^A 89 14.77 33.42 14.81 13.51 33.67 15.63 14.14 33.55 15.22 2 0 1000.00 -999 ? >TRP^A 90 18.03 33.84 11.68 20.00 33.31 8.32 19.02 33.57 10.00 3 0 1000.00 -999 ? >VAL^A 91 12.88 38.22 11.42 12.21 39.50 13.04 12.54 38.86 12.23 3 0 1000.00 -999 ? >LEU^A 92 11.09 37.63 7.12 12.64 36.18 6.69 11.86 36.90 6.91 3 0 1000.00 -999 ? >GLU^A 93 9.71 43.22 8.94 9.51 45.20 9.68 9.61 44.21 9.31 2 0 1000.00 -999 ? >ASN^A 94 8.53 44.03 3.09 9.02 45.34 4.72 8.78 44.69 3.90 2 0 1000.00 -999 ? >ALA^A 95 7.66 39.37 2.02 7.64 38.04 2.76 7.65 38.71 2.39 2 0 1000.00 -999 ? >PHE^A 96 7.13 40.64 -2.82 9.28 41.79 -4.21 8.20 41.22 -3.51 3 0 1000.00 -999 ? >ARG^A 97 3.73 33.18 -5.15 4.46 30.56 -3.78 4.09 31.87 -4.46 2 0 1000.00 -999 ? >TYR^A 98 9.76 37.20 -7.39 11.96 38.15 -5.94 10.86 37.68 -6.67 3 0 1000.00 -999 ? >GLU^A 99 5.37 37.99 -12.01 4.99 39.22 -13.64 5.18 38.61 -12.83 2 0 1000.00 -999 ? >LYS^A 100 6.73 34.02 -11.93 5.51 32.40 -16.91 6.12 33.21 -14.42 2 0 1000.00 -999 ? >PRO^A 101 8.07 30.02 -10.87 8.79 32.11 -10.56 8.43 31.07 -10.71 3 0 1000.00 -999 ? >LEU^A 102 13.65 34.03 -10.87 12.98 36.01 -11.52 13.31 35.02 -11.19 3 0 1000.00 -999 ? >HIS^A 103 15.21 27.60 -12.96 15.17 25.58 -12.41 15.19 26.59 -12.68 3 0 1000.00 -999 ? >VAL.A 104 18.71 29.16 -10.47 18.91 29.74 -8.36 18.81 29.45 -9.41 3 0 1000.00 -999 ? >PRO.A 105 22.92 27.21 -10.93 21.24 28.62 -11.22 22.08 27.92 -11.07 3 0 1000.00 -999 ? >MET?A 112 27.18 29.69 -3.05 24.30 27.91 -3.00 25.74 28.80 -3.03 2 0 1000.00 -999 ? >PHE.A 113 28.93 34.18 -2.22 29.72 35.16 -4.72 29.32 34.67 -3.47 3 0 1000.00 -999 ? >VAL.A 114 29.81 31.59 2.95 31.35 30.30 3.82 30.58 30.94 3.38 3 0 1000.00 -999 ? >ASP.A 115 26.78 33.85 6.00 26.18 35.45 7.26 26.48 34.65 6.63 2 0 1000.00 -999 ? >LEU.A 116 32.28 36.12 6.41 33.51 34.74 5.26 32.89 35.43 5.84 3 0 1000.00 -999 ? >SER.A 117 28.84 38.34 8.93 26.54 37.57 8.79 27.69 37.96 8.86 2 0 1000.00 -999 ? >GLU.A 118 26.90 35.56 12.59 26.39 37.36 13.59 26.64 36.46 13.09 2 0 1000.00 -999 ? >VAL.A 119 33.09 36.01 11.91 34.43 35.48 10.27 33.76 35.75 11.09 3 0 1000.00 -999 ? >ARG.A 120 34.01 34.90 17.58 34.57 36.67 20.02 34.29 35.79 18.80 2 0 1000.00 -999 ?