REMARK SOURCE hebe.pdb HEADER UNKNOWN FUNCTION 09-JUN-03 1PM3 COMPND MTH1895; COMPND 3 CHAIN: A, B; COMPND 4 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: METHANOTHERMOBACTER SOURCE 3 THERMAUTOTROPHICUS; SOURCE 4 ORGANISM_TAXID: 145262; SOURCE 5 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 6 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 8 EXPRESSION_SYSTEM_PLASMID: PET AUTHOR H.YE,C.STEEGBORN,H.WU,NORTHEAST STRUCTURAL GENOMICS AUTHOR 2 CONSORTIUM (NESG) >HIS.A 0 71.73 24.55 -14.94 69.74 24.50 -15.59 70.73 24.53 -15.26 3 0 1000.00 -999 ? >MET^A 1 76.57 24.91 -11.04 78.59 28.12 -9.24 77.58 26.51 -10.14 2 0 1000.00 -999 ? >ARG^A 2 79.41 19.92 -11.67 80.62 18.09 -13.87 80.01 19.00 -12.77 2 0 1000.00 -999 ? >ILE.A 3 78.68 22.20 -5.00 78.02 22.68 -4.86 78.35 22.44 -4.93 3 0 1000.00 -999 ? >VAL.A 4 82.87 21.23 -5.74 83.72 19.30 -5.21 83.29 20.27 -5.48 3 0 1000.00 -999 ? >GLU.A 5 84.97 20.01 -10.24 83.71 18.71 -11.29 84.34 19.36 -10.76 2 0 1000.00 -999 ? >GLU.A 6 81.98 25.23 -11.52 80.30 25.61 -12.72 81.14 25.42 -12.12 2 0 1000.00 -999 ? >MET.A 7 80.98 27.27 -6.45 77.85 27.45 -4.34 79.41 27.36 -5.39 2 0 1000.00 -999 ? >VAL.A 8 83.52 26.22 -3.86 83.63 24.29 -2.84 83.58 25.25 -3.35 3 0 1000.00 -999 ? >GLY.A 9 86.70 27.92 -2.83 85.96 28.32 -3.14 86.33 28.12 -2.99 1 0 1000.00 -999 ? >LYS.A 10 84.92 30.94 -4.27 81.53 30.45 -9.05 83.22 30.70 -6.66 2 0 1000.00 -999 ? >GLU^A 11 87.68 34.74 -2.96 89.18 36.28 -3.04 88.43 35.51 -3.00 2 0 1000.00 -999 ? >VAL^A 12 82.22 35.79 -0.86 80.69 34.68 0.17 81.46 35.24 -0.35 3 0 1000.00 -999 ? >LEU^A 13 82.50 40.44 -1.86 84.41 40.26 -2.76 83.45 40.35 -2.31 3 0 1000.00 -999 ? >ASP.A 14 79.91 42.02 2.96 81.41 43.54 3.14 80.66 42.78 3.05 2 0 1000.00 -999 ? >SER.A 15 78.07 44.74 0.10 76.77 45.60 1.94 77.42 45.17 1.02 2 0 1000.00 -999 ? >SER.A 16 81.13 46.70 1.24 80.33 47.45 3.37 80.73 47.08 2.30 2 0 1000.00 -999 ? >ALA.A 17 83.41 44.90 -1.20 84.02 46.06 -1.97 83.71 45.48 -1.58 2 0 1000.00 -999 ? >LYS.A 18 85.02 43.16 1.75 85.75 41.12 6.84 85.38 42.14 4.30 2 0 1000.00 -999 ? >VAL^A 19 85.80 39.42 1.56 87.11 38.33 0.27 86.46 38.88 0.91 3 0 1000.00 -999 ? >ILE^A 20 82.57 37.15 4.30 81.23 37.35 4.83 81.90 37.25 4.57 3 0 1000.00 -999 ? >GLY^A 21 85.81 34.28 3.27 85.33 34.54 2.64 85.57 34.41 2.95 1 0 1000.00 -999 ? >LYS^A 22 85.65 31.41 0.78 91.32 31.16 -1.94 88.49 31.28 -0.58 2 0 1000.00 -999 ? >VAL^A 23 83.04 28.72 0.20 81.37 28.61 -1.17 82.20 28.66 -0.48 3 0 1000.00 -999 ? >LYS^A 24 83.81 25.71 2.37 85.45 24.90 8.44 84.63 25.31 5.40 2 0 1000.00 -999 ? >ASP^A 25 80.50 22.72 2.96 79.73 20.86 2.32 80.11 21.79 2.64 2 0 1000.00 -999 ? >VAL^A 26 76.90 24.38 1.34 76.25 24.96 -0.61 76.57 24.67 0.37 3 0 1000.00 -999 ? >GLU^A 27 75.11 24.12 6.27 74.39 24.14 8.26 74.75 24.13 7.27 2 0 1000.00 -999 ? >VAL^A 28 71.25 22.00 2.24 71.36 20.98 0.35 71.30 21.49 1.29 3 0 1000.00 -999 ? >ASP^A 29 66.64 22.40 3.72 65.06 21.72 4.96 65.85 22.06 4.34 2 0 1000.00 -999 ? >ILE.A 30 67.17 16.73 4.85 67.04 16.96 5.63 67.11 16.84 5.24 3 0 1000.00 -999 ? >GLU.A 31 62.56 18.92 5.45 61.92 16.98 5.95 62.24 17.95 5.70 2 0 1000.00 -999 ? >SER.A 32 63.03 20.74 0.20 64.00 22.68 1.29 63.51 21.71 0.75 2 0 1000.00 -999 ? >GLN.A 33 66.82 18.32 -3.50 66.21 19.36 -5.26 66.52 18.84 -4.38 2 0 1000.00 -999 ? >ALA^A 34 67.11 23.03 -1.33 65.93 24.01 -1.27 66.52 23.52 -1.30 2 0 1000.00 -999 ? >ILE^A 35 70.95 26.02 -1.40 72.31 26.34 -1.94 71.63 26.18 -1.67 3 0 1000.00 -999 ? >GLU^A 36 68.30 27.13 4.83 67.12 25.86 6.02 67.71 26.49 5.42 2 0 1000.00 -999 ? >SER^A 37 73.19 28.55 3.48 73.06 27.38 5.60 73.13 27.97 4.54 2 0 1000.00 -999 ? >LEU^A 38 77.37 29.88 1.60 76.21 30.52 -0.10 76.79 30.20 0.75 3 0 1000.00 -999 ? >VAL^A 39 79.48 27.72 4.98 79.02 25.67 5.44 79.25 26.70 5.21 3 0 1000.00 -999 ? >LEU^A 40 82.38 31.49 4.45 81.10 32.44 3.01 81.74 31.96 3.73 3 0 1000.00 -999 ? >GLY^A 41 86.08 29.52 5.72 85.93 30.25 5.46 86.00 29.89 5.59 1 0 1000.00 -999 ? >LYS.A 42 88.39 31.90 7.74 92.32 33.57 11.95 90.36 32.74 9.85 2 0 1000.00 -999 ? >GLY.A 43 91.72 30.05 6.90 91.64 29.98 7.62 91.68 30.01 7.26 1 0 1000.00 -999 ? >GLY.A 44 93.92 29.47 9.83 93.32 29.39 10.12 93.62 29.43 9.97 1 0 1000.00 -999 ? >GLY.A 54 86.58 28.80 11.90 85.69 28.71 11.73 86.14 28.76 11.81 1 0 1000.00 -999 ? >GLU^A 55 82.24 26.73 9.00 81.57 24.86 9.63 81.90 25.80 9.31 2 0 1000.00 -999 ? >THR^A 56 80.90 31.33 8.94 81.57 33.36 8.78 81.24 32.34 8.86 2 0 1000.00 -999 ? >ILE^A 57 76.55 29.37 8.92 75.90 28.05 9.15 76.23 28.71 9.04 3 0 1000.00 -999 ? >VAL^A 58 75.72 32.77 5.65 76.78 34.41 4.72 76.25 33.59 5.18 3 0 1000.00 -999 ? >PRO^A 59 71.71 33.63 6.65 72.66 32.58 4.97 72.18 33.10 5.81 3 0 1000.00 -999 ? >TYR.A 60 71.47 30.46 -1.20 71.99 30.35 -3.96 71.73 30.41 -2.58 3 0 1000.00 -999 ? >GLU.A 61 67.22 33.13 2.27 68.56 31.90 3.37 67.89 32.51 2.82 2 0 1000.00 -999 ? >MET.A 62 71.82 36.92 1.33 72.38 38.22 4.62 72.10 37.57 2.98 2 0 1000.00 -999 ? >VAL^A 63 73.60 35.98 -1.89 74.54 34.21 -2.63 74.07 35.09 -2.26 3 0 1000.00 -999 ? >LYS^A 64 72.99 38.69 -4.49 75.39 43.94 -4.62 74.19 41.32 -4.55 2 0 1000.00 -999 ? >LYS^A 65 75.10 37.45 -7.42 74.08 37.94 -12.82 74.59 37.70 -10.12 2 0 1000.00 -999 ? >ILE^A 66 76.60 33.05 -7.93 76.51 31.85 -7.07 76.56 32.45 -7.50 3 0 1000.00 -999 ? >GLY.A 67 79.87 34.77 -10.88 80.19 34.57 -10.08 80.03 34.67 -10.48 1 0 1000.00 -999 ? >ASP.A 68 84.58 35.74 -11.03 84.69 35.59 -13.11 84.64 35.66 -12.07 2 0 1000.00 -999 ? >LYS.A 69 82.94 35.93 -6.91 87.82 36.04 -6.76 85.38 35.98 -6.83 2 0 1000.00 -999 ? >ILE^A 70 79.56 34.48 -3.85 79.03 33.29 -3.48 79.29 33.89 -3.67 3 0 1000.00 -999 ? >LEU^A 71 78.05 40.02 -5.03 79.72 40.81 -6.13 78.88 40.42 -5.58 3 0 1000.00 -999 ? >LEU^A 72 76.48 39.10 0.56 76.53 37.15 1.41 76.51 38.12 0.99 3 0 1000.00 -999 ? >LYS.A 73 73.37 41.98 -0.82 68.45 38.86 -1.86 70.91 40.42 -1.34 2 0 1000.00 -999 ? >GLY.A 74 73.29 45.20 1.18 72.66 44.65 1.14 72.98 44.92 1.16 1 0 1000.00 -999 ? >PRO.A 75 72.35 47.75 4.59 71.59 45.88 3.70 71.97 46.82 4.15 3 0 1000.00 -999 ? >GLU.A 76 70.07 49.50 0.55 72.04 49.00 1.19 71.05 49.25 0.87 2 0 1000.00 -999 ? >GLU.A 77 71.10 46.15 -1.80 72.86 45.54 -2.79 71.98 45.84 -2.30 2 0 1000.00 -999 ? >HIS.B 0 67.98 20.15 8.16 66.66 20.14 9.79 67.32 20.14 8.98 3 0 1000.00 -999 ? >MET^B 1 72.74 18.31 5.68 72.59 14.79 3.21 72.67 16.55 4.45 2 0 1000.00 -999 ? >ARG^B 2 79.25 21.39 5.83 79.38 23.21 8.27 79.32 22.30 7.05 2 0 1000.00 -999 ? >ILE.B 3 76.60 19.50 -0.27 75.99 19.60 -1.65 76.29 19.55 -0.96 3 0 1000.00 -999 ? >VAL.B 4 80.59 18.33 0.26 82.16 19.65 -0.50 81.37 18.99 -0.12 3 0 1000.00 -999 ? >GLU.B 5 81.15 16.92 6.32 80.75 18.07 8.04 80.95 17.49 7.18 2 0 1000.00 -999 ? >GLU.B 6 76.83 15.61 5.49 75.62 15.64 7.19 76.23 15.62 6.34 2 0 1000.00 -999 ? >MET.B 7 77.59 13.48 0.49 74.06 15.14 -0.96 75.82 14.31 -0.23 2 0 1000.00 -999 ? >VAL.B 8 80.53 13.95 -1.79 81.24 15.66 -2.94 80.89 14.80 -2.37 3 0 1000.00 -999 ? >GLY.B 9 82.60 10.79 -1.87 81.75 10.67 -1.91 82.17 10.73 -1.89 1 0 1000.00 -999 ? >LYS.B 10 79.83 8.41 -0.81 76.63 10.34 4.29 78.23 9.38 1.74 2 0 1000.00 -999 ? >GLU^B 11 81.04 3.83 -2.79 81.53 1.76 -2.67 81.28 2.80 -2.73 2 0 1000.00 -999 ? >VAL^B 12 75.78 5.43 -4.84 75.04 6.39 -6.62 75.41 5.91 -5.73 3 0 1000.00 -999 ? >LEU^B 13 73.89 1.21 -3.91 75.61 0.41 -2.94 74.75 0.81 -3.43 3 0 1000.00 -999 ? >ASP.B 14 71.68 -0.23 -8.09 70.81 -0.45 -9.91 71.24 -0.34 -9.00 2 0 1000.00 -999 ? >SER.B 15 67.90 -0.40 -6.55 65.74 -1.34 -6.79 66.82 -0.87 -6.67 2 0 1000.00 -999 ? >SER.B 16 69.65 -3.76 -7.14 68.67 -4.53 -9.22 69.16 -4.15 -8.18 2 0 1000.00 -999 ? >ALA.B 17 72.24 -2.93 -4.51 72.24 -4.05 -3.48 72.24 -3.49 -4.00 2 0 1000.00 -999 ? >LYS.B 18 74.75 -2.20 -7.29 76.15 -5.45 -11.74 75.45 -3.83 -9.51 2 0 1000.00 -999 ? >VAL^B 19 77.59 0.33 -7.30 79.35 0.43 -6.07 78.47 0.38 -6.69 3 0 1000.00 -999 ? >ILE^B 20 75.86 3.92 -10.05 74.54 4.25 -10.35 75.20 4.09 -10.20 3 0 1000.00 -999 ? >GLY^B 21 80.03 5.03 -8.81 79.42 5.05 -8.23 79.72 5.04 -8.52 1 0 1000.00 -999 ? >LYS^B 22 81.02 7.59 -6.18 83.96 5.48 -2.30 82.49 6.54 -4.24 2 0 1000.00 -999 ? >VAL^B 23 79.74 11.17 -5.96 77.96 12.03 -5.02 78.85 11.60 -5.49 3 0 1000.00 -999 ? >LYS^B 24 82.60 13.36 -7.27 83.03 12.77 -11.59 82.81 13.07 -9.43 2 0 1000.00 -999 ? >ASP^B 25 80.97 17.24 -8.51 80.89 19.34 -8.22 80.93 18.29 -8.36 2 0 1000.00 -999 ? >VAL^B 26 76.81 17.63 -7.27 75.52 17.11 -5.63 76.17 17.37 -6.45 3 0 1000.00 -999 ? >GLU^B 27 76.15 19.41 -11.64 75.74 18.98 -13.67 75.95 19.19 -12.66 2 0 1000.00 -999 ? >VAL^B 28 72.67 22.76 -8.17 72.73 23.21 -6.07 72.70 22.99 -7.12 3 0 1000.00 -999 ? >ASP^B 29 68.80 24.75 -10.32 67.96 26.27 -11.52 68.38 25.51 -10.92 2 0 1000.00 -999 ? >ILE.B 30 72.86 28.95 -8.87 74.22 29.44 -8.59 73.54 29.19 -8.73 3 0 1000.00 -999 ? >GLU.B 31 68.75 30.59 -11.68 67.86 31.64 -13.30 68.30 31.11 -12.49 2 0 1000.00 -999 ? >SER.B 32 65.55 27.51 -7.89 65.95 25.34 -8.97 65.75 26.43 -8.43 2 0 1000.00 -999 ? >GLN.B 33 68.04 28.76 -3.78 67.26 29.83 -2.13 67.65 29.30 -2.96 2 0 1000.00 -999 ? >ALA^B 34 67.68 22.91 -5.91 66.50 22.61 -6.80 67.09 22.76 -6.36 2 0 1000.00 -999 ? >ILE^B 35 70.47 19.07 -5.02 71.11 18.69 -3.80 70.79 18.88 -4.41 3 0 1000.00 -999 ? >GLU^B 36 70.50 20.90 -11.30 68.68 20.85 -12.36 69.59 20.87 -11.83 2 0 1000.00 -999 ? >SER^B 37 72.03 15.59 -9.87 72.91 16.02 -12.08 72.47 15.81 -10.98 2 0 1000.00 -999 ? >LEU^B 38 74.99 12.54 -7.74 73.46 12.53 -6.21 74.22 12.54 -6.97 3 0 1000.00 -999 ? >VAL^B 39 78.18 13.57 -10.72 79.05 15.15 -11.90 78.62 14.36 -11.31 3 0 1000.00 -999 ? >LEU^B 40 78.86 8.87 -10.55 77.15 8.79 -9.24 78.00 8.83 -9.89 3 0 1000.00 -999 ? >GLY^B 41 83.38 9.29 -10.88 82.74 8.77 -11.05 83.06 9.03 -10.96 1 0 1000.00 -999 ? >LYS.B 42 83.18 6.40 -13.30 87.92 7.07 -17.37 85.55 6.73 -15.33 2 0 1000.00 -999 ? >GLY.B 43 81.70 2.96 -13.10 82.23 3.20 -12.52 81.96 3.08 -12.81 1 0 1000.00 -999 ? >GLY.B 54 84.28 9.83 -17.78 84.58 10.07 -17.06 84.43 9.95 -17.42 1 0 1000.00 -999 ? >GLU.B 55 82.47 13.22 -14.96 82.24 15.32 -14.81 82.35 14.27 -14.89 2 0 1000.00 -999 ? >THR^B 56 77.86 9.73 -14.93 77.30 7.67 -14.60 77.58 8.70 -14.77 2 0 1000.00 -999 ? >ILE^B 57 74.92 13.32 -14.98 75.10 14.75 -15.21 75.01 14.04 -15.10 3 0 1000.00 -999 ? >VAL^B 58 72.53 10.61 -11.75 72.75 8.96 -10.38 72.64 9.79 -11.06 3 0 1000.00 -999 ? >PRO^B 59 68.82 11.85 -13.65 69.86 12.23 -11.76 69.34 12.04 -12.70 3 0 1000.00 -999 ? >TYR.B 60 69.52 15.04 -5.80 69.21 14.99 -3.00 69.36 15.01 -4.40 3 0 1000.00 -999 ? >GLU.B 61 63.49 13.12 -9.75 62.31 11.94 -8.48 62.90 12.53 -9.12 2 0 1000.00 -999 ? >MET.B 62 65.93 9.22 -7.45 67.26 7.99 -11.16 66.60 8.60 -9.31 2 0 1000.00 -999 ? >VAL.B 63 68.05 9.14 -4.22 69.72 10.39 -3.45 68.89 9.77 -3.84 3 0 1000.00 -999 ? >LYS.B 64 66.13 7.16 -1.57 62.89 2.08 -3.77 64.51 4.62 -2.67 2 0 1000.00 -999 ? >LYS^B 65 68.59 7.57 1.33 67.06 6.02 7.04 67.82 6.80 4.19 2 0 1000.00 -999 ? >ILE^B 66 72.15 10.43 2.44 73.01 10.62 1.20 72.58 10.52 1.82 3 0 1000.00 -999 ? >GLY.B 67 73.94 6.95 5.10 74.37 7.14 4.29 74.16 7.04 4.70 1 0 1000.00 -999 ? >ASP.B 68 78.08 4.37 5.49 78.22 4.57 7.60 78.15 4.47 6.55 2 0 1000.00 -999 ? >LYS.B 69 76.14 4.98 1.25 80.86 2.02 0.80 78.50 3.50 1.03 2 0 1000.00 -999 ? >ILE^B 70 73.98 7.52 -2.10 74.14 8.94 -2.41 74.06 8.23 -2.26 3 0 1000.00 -999 ? >LEU^B 71 69.77 3.48 -0.99 70.85 2.64 0.72 70.31 3.06 -0.13 3 0 1000.00 -999 ? >LEU.B 72 69.03 5.33 -6.41 70.83 6.44 -6.60 69.93 5.89 -6.51 3 0 1000.00 -999 ? >LYS.B 73 65.63 3.82 -7.52 67.89 2.59 -12.97 66.76 3.20 -10.25 2 0 1000.00 -999 ? >GLY.B 74 62.52 1.70 -7.03 62.45 2.10 -7.71 62.48 1.90 -7.37 1 0 1000.00 -999 ? >PRO.B 75 58.34 0.64 -6.14 59.57 0.91 -7.97 58.96 0.78 -7.06 3 0 1000.00 -999 ? >GLU.B 76 59.54 5.40 -7.42 59.32 3.87 -5.97 59.43 4.64 -6.69 2 0 1000.00 -999 ?