REMARK SOURCE hebe.pdb HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 01-DEC-03 1VI7 COMPND HYPOTHETICAL PROTEIN YIGZ; COMPND 3 CHAIN: A; COMPND 4 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; SOURCE 3 ORGANISM_TAXID: 562; SOURCE 4 GENE: YIGZ, B3848; SOURCE 5 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 6 EXPRESSION_SYSTEM_TAXID: 562 AUTHOR STRUCTURAL GENOMIX >LEU.A 3 56.10 21.15 -10.73 56.07 19.72 -9.06 56.08 20.44 -9.90 3 0 1000.00 -999 ? >MET.A 4 56.53 24.50 -13.24 52.90 26.43 -12.53 54.71 25.46 -12.89 2 0 1000.00 -999 ? >GLU.A 5 58.18 28.89 -14.48 57.52 27.95 -16.27 57.85 28.42 -15.38 2 0 1000.00 -999 ? >SER.A 6 57.61 29.18 -9.93 57.79 31.56 -10.25 57.70 30.37 -10.09 2 0 1000.00 -999 ? >TRP^A 7 53.66 27.86 -5.67 56.23 25.05 -6.56 54.95 26.46 -6.12 3 0 1000.00 -999 ? >LEU^A 8 51.55 33.26 -6.23 51.90 35.01 -7.50 51.72 34.14 -6.86 3 0 1000.00 -999 ? >ILE^A 9 52.78 30.28 -1.60 53.64 30.28 -1.12 53.21 30.28 -1.36 3 0 1000.00 -999 ? >PRO^A 10 48.92 30.81 0.99 50.35 32.38 0.27 49.64 31.59 0.63 3 0 1000.00 -999 ? >ALA.A 11 52.20 35.56 2.51 52.60 36.83 1.76 52.40 36.19 2.14 2 0 1000.00 -999 ? >ALA.A 12 49.76 35.89 5.39 49.56 37.35 5.66 49.66 36.62 5.53 2 0 1000.00 -999 ? >PRO.A 13 47.64 34.68 8.91 47.37 34.42 6.68 47.51 34.55 7.80 3 0 1000.00 -999 ? >VAL^A 14 43.22 35.30 6.12 42.64 35.97 4.10 42.93 35.64 5.11 3 0 1000.00 -999 ? >THR^A 15 40.07 35.01 8.18 40.09 35.63 10.26 40.08 35.32 9.22 2 0 1000.00 -999 ? >VAL^A 16 36.63 36.17 7.06 36.15 36.57 4.95 36.39 36.37 6.00 3 0 1000.00 -999 ? >VAL^A 17 33.17 35.63 8.60 32.73 35.74 10.75 32.95 35.68 9.67 3 0 1000.00 -999 ? >GLU^A 18 28.85 35.83 4.71 28.61 34.76 2.94 28.73 35.29 3.83 2 0 1000.00 -999 ? >GLU^A 19 24.08 37.02 9.11 22.93 36.05 10.58 23.51 36.53 9.84 2 0 1000.00 -999 ? >ILE^A 20 24.29 32.19 5.34 24.60 31.74 3.94 24.44 31.97 4.64 3 0 1000.00 -999 ? >LYS.A 21 20.14 32.59 7.65 16.74 29.65 3.51 18.44 31.12 5.58 2 0 1000.00 -999 ? >LYS.A 22 21.16 33.29 11.25 15.62 34.93 13.68 18.39 34.11 12.47 2 0 1000.00 -999 ? >SER^A 23 24.07 30.82 10.99 22.58 29.22 9.93 23.32 30.02 10.46 2 0 1000.00 -999 ? >ARG^A 24 29.67 33.98 12.50 27.03 35.35 11.55 28.35 34.66 12.02 2 0 1000.00 -999 ? >PHE^A 25 28.68 29.70 7.00 26.37 28.25 6.50 27.52 28.97 6.75 3 0 1000.00 -999 ? >THR^A 27 36.48 30.88 6.51 36.07 30.84 4.41 36.27 30.86 5.46 2 0 1000.00 -999 ? >MET^A 28 40.16 30.81 7.43 39.53 30.33 11.54 39.85 30.57 9.48 2 0 1000.00 -999 ? >LEU^A 29 43.04 31.58 3.69 41.54 31.62 2.12 42.29 31.60 2.91 3 0 1000.00 -999 ? >ALA^A 30 46.73 30.23 5.62 46.64 29.48 6.97 46.68 29.85 6.30 2 0 1000.00 -999 ? >HIS^A 31 52.58 29.18 3.64 54.33 28.19 3.03 53.46 28.69 3.33 3 0 1000.00 -999 ? >THR.A 32 50.49 25.25 4.41 48.38 24.74 4.50 49.44 24.99 4.46 2 0 1000.00 -999 ? >ASP~A 33 54.82 24.02 2.43 55.96 22.89 1.03 55.39 23.46 1.73 2 0 1000.00 -999 ? >GLY~A 34 52.40 19.90 2.55 51.91 20.43 2.86 52.15 20.16 2.71 1 0 1000.00 -999 ? >VAL~A 35 49.75 17.70 4.08 48.92 15.91 3.16 49.34 16.80 3.62 3 0 1000.00 -999 ? >GLU~A 36 52.43 17.19 9.79 54.35 17.45 10.69 53.39 17.32 10.24 2 0 1000.00 -999 ? >ALA~A 37 50.90 21.60 7.42 51.64 22.39 6.37 51.27 21.99 6.90 2 0 1000.00 -999 ? >ALA~A 38 47.31 21.45 6.20 46.85 20.65 4.99 47.08 21.05 5.60 2 0 1000.00 -999 ? >LYS~A 39 46.35 19.11 9.03 43.26 16.69 8.96 44.81 17.90 8.99 2 0 1000.00 -999 ? >ALA~A 40 48.32 21.25 11.46 49.62 21.97 11.09 48.97 21.61 11.27 2 0 1000.00 -999 ? >PHE~A 41 45.60 25.88 9.69 44.47 26.42 7.24 45.03 26.15 8.47 3 0 1000.00 -999 ? >VAL~A 42 42.69 22.25 11.13 42.99 20.46 9.91 42.84 21.36 10.52 3 0 1000.00 -999 ? >GLU~A 43 44.35 19.67 16.45 43.96 20.41 18.41 44.16 20.04 17.43 2 0 1000.00 -999 ? >SER~A 44 43.65 24.95 15.77 45.20 25.81 14.05 44.43 25.38 14.91 2 0 1000.00 -999 ? >ALA~A 47 40.00 23.72 19.01 41.52 23.87 19.23 40.76 23.80 19.12 2 0 1000.00 -999 ? >GLU~A 48 40.00 29.76 18.23 39.70 31.05 16.60 39.85 30.41 17.41 2 0 1000.00 -999 ? >HIS~A 49 35.74 28.48 15.95 36.55 30.29 15.30 36.14 29.38 15.63 3 0 1000.00 -999 ? >PRO.A 50 35.19 24.71 21.60 34.53 24.30 19.49 34.86 24.50 20.54 3 0 1000.00 -999 ? >ASP.A 51 30.26 26.34 20.38 29.89 25.95 22.42 30.07 26.15 21.40 2 0 1000.00 -999 ? >ALA.A 52 30.57 25.07 15.84 31.55 25.84 14.98 31.06 25.45 15.41 2 0 1000.00 -999 ? >ARG.A 53 25.15 21.10 13.47 23.43 22.01 11.18 24.29 21.56 12.33 2 0 1000.00 -999 ? >HIS.A 54 28.85 21.03 9.97 27.10 19.89 10.22 27.98 20.46 10.09 3 0 1000.00 -999 ? >HIS.A 55 35.14 22.66 12.60 34.32 23.15 14.48 34.73 22.90 13.54 3 0 1000.00 -999 ? >CYH.A 56 34.91 21.70 6.36 32.11 22.02 6.21 33.51 21.86 6.28 2 0 1000.00 -999 ? >VAL^A 57 38.36 21.64 4.75 39.84 20.60 6.06 39.10 21.12 5.40 3 0 1000.00 -999 ? >ALA^A 58 40.20 21.75 1.39 39.28 22.59 0.51 39.74 22.17 0.95 2 0 1000.00 -999 ? >TRP^A 59 45.88 19.70 0.73 43.90 17.68 3.43 44.89 18.69 2.08 3 0 1000.00 -999 ? >VAL^A 60 46.39 22.19 -2.63 46.45 23.64 -4.35 46.42 22.91 -3.49 3 0 1000.00 -999 ? >ALA.A 61 50.04 21.73 -1.61 50.49 20.67 -0.74 50.27 21.20 -1.17 2 0 1000.00 -999 ? >GLY.A 62 50.83 23.67 -4.62 51.25 23.08 -4.37 51.04 23.38 -4.49 1 0 1000.00 -999 ? >ALA.A 63 52.95 22.64 -7.47 52.96 21.24 -7.97 52.95 21.94 -7.72 2 0 1000.00 -999 ? >PRO.A 64 50.46 26.31 -9.18 51.21 24.40 -8.22 50.84 25.36 -8.70 3 0 1000.00 -999 ? >ASP.A 65 46.81 23.95 -10.41 45.23 24.71 -9.24 46.02 24.33 -9.82 2 0 1000.00 -999 ? >ASP.A 66 51.65 21.38 -12.00 51.48 22.28 -13.91 51.57 21.83 -12.95 2 0 1000.00 -999 ? >SER.A 67 51.06 18.71 -8.48 52.11 17.93 -6.41 51.58 18.32 -7.44 2 0 1000.00 -999 ? >GLN.A 68 47.58 15.23 -8.54 48.77 15.77 -10.20 48.17 15.50 -9.37 2 0 1000.00 -999 ? >GLN.A 69 50.85 16.79 -2.89 52.63 17.91 -2.53 51.74 17.35 -2.71 2 0 1000.00 -999 ? >LEU.A 70 43.92 18.19 -4.69 44.63 19.18 -6.49 44.27 18.68 -5.59 3 0 1000.00 -999 ? >GLY^A 71 42.30 17.29 -0.53 42.05 18.05 -0.83 42.17 17.67 -0.68 1 0 1000.00 -999 ? >PHE^A 72 37.58 17.35 -1.00 36.80 15.18 -2.53 37.19 16.27 -1.76 3 0 1000.00 -999 ? >SER^A 73 36.23 17.07 3.56 36.15 16.05 5.76 36.19 16.56 4.66 2 0 1000.00 -999 ? >ASP.A 74 31.37 17.04 3.79 31.11 16.99 1.67 31.24 17.01 2.73 2 0 1000.00 -999 ? >ASP.A 75 33.53 17.83 8.77 33.09 18.25 10.77 33.31 18.04 9.77 2 0 1000.00 -999 ? >GLY.A 76 28.97 15.97 8.23 29.21 16.37 7.63 29.09 16.17 7.93 1 0 1000.00 -999 ? >GLU.A 77 28.19 20.89 6.13 26.30 21.55 6.77 27.25 21.22 6.45 2 0 1000.00 -999 ? >PRO.A 78 24.32 18.52 2.87 26.05 17.11 3.23 25.19 17.81 3.05 3 0 1000.00 -999 ? >ALA.A 79 28.33 14.99 0.32 28.18 13.56 -0.17 28.26 14.28 0.08 2 0 1000.00 -999 ? >GLY.A 80 29.95 17.19 -2.34 29.51 17.47 -1.75 29.73 17.33 -2.05 1 0 1000.00 -999 ? >THR.A 81 28.43 20.36 -0.85 26.48 20.73 0.06 27.46 20.55 -0.40 2 0 1000.00 -999 ? >ALA.A 82 31.08 21.64 1.57 30.84 21.48 3.07 30.96 21.56 2.32 2 0 1000.00 -999 ? >GLY~A 83 34.28 20.07 0.21 33.83 20.41 -0.38 34.06 20.24 -0.08 1 0 1000.00 -999 ? >PRO~A 85 31.18 22.75 -3.17 33.31 22.94 -3.83 32.24 22.85 -3.50 3 0 1000.00 -999 ? >MET~A 86 35.94 25.14 -1.75 36.11 24.50 2.37 36.02 24.82 0.31 2 0 1000.00 -999 ? >LEU~A 87 38.69 21.61 -3.59 40.39 21.04 -4.80 39.54 21.32 -4.19 3 0 1000.00 -999 ? >ALA~A 88 37.68 24.47 -6.93 36.40 24.18 -7.65 37.04 24.32 -7.29 2 0 1000.00 -999 ? >GLN~A 89 36.04 28.80 -4.49 35.29 29.97 -6.13 35.66 29.38 -5.31 2 0 1000.00 -999 ? >LEU~A 90 42.14 26.23 -3.41 41.63 26.49 -1.28 41.89 26.36 -2.34 3 0 1000.00 -999 ? >MET~A 91 42.22 25.51 -7.96 41.69 21.48 -8.47 41.95 23.49 -8.21 2 0 1000.00 -999 ? >GLY~A 92 40.67 28.62 -9.51 41.32 28.57 -8.99 41.00 28.60 -9.25 1 0 1000.00 -999 ? >SER~A 93 43.05 30.98 -7.70 43.21 29.90 -5.56 43.13 30.44 -6.63 2 0 1000.00 -999 ? >GLY~A 94 46.29 29.51 -9.04 46.18 29.79 -8.21 46.23 29.65 -8.63 1 0 1000.00 -999 ? >VAL.A 95 47.97 29.75 -5.65 47.55 31.37 -4.24 47.76 30.56 -4.95 3 0 1000.00 -999 ? >GLY.A 96 50.07 26.83 -4.47 49.89 27.47 -3.99 49.98 27.15 -4.23 1 0 1000.00 -999 ? >GLU.A 97 53.05 25.56 -1.51 54.96 26.31 -1.06 54.00 25.93 -1.28 2 0 1000.00 -999 ? >ILE^A 98 46.70 27.97 -0.03 45.69 28.75 -0.62 46.20 28.36 -0.33 3 0 1000.00 -999 ? >THR^A 99 44.57 25.22 2.85 45.09 23.60 4.20 44.83 24.41 3.52 2 0 1000.00 -999 ? >ALA^A 100 41.11 26.47 3.82 40.34 27.01 2.62 40.73 26.74 3.22 2 0 1000.00 -999 ? >VAL^A 101 38.66 25.86 6.63 39.15 24.78 8.47 38.91 25.32 7.55 3 0 1000.00 -999 ? >VAL.A 102 35.01 26.86 6.84 33.86 27.56 5.14 34.44 27.21 5.99 3 0 1000.00 -999 ? >VAL.A 103 33.62 26.71 10.42 34.87 27.09 12.20 34.24 26.90 11.31 3 0 1000.00 -999 ? >ARG^A 104 26.71 25.27 8.97 23.97 24.66 7.92 25.34 24.97 8.45 2 0 1000.00 -999 ? >TYR^A 105 29.42 28.86 15.21 31.77 29.12 16.70 30.60 28.99 15.95 3 0 1000.00 -999 ? >TYR.A 106 22.20 24.71 12.78 19.61 24.22 11.88 20.91 24.46 12.33 3 0 1000.00 -999 ? >GLY.A 107 21.69 29.08 13.37 21.39 28.40 13.25 21.54 28.74 13.31 1 0 1000.00 -999 ? >GLY.A 108 18.39 27.23 13.76 18.70 27.33 12.99 18.55 27.28 13.38 1 0 1000.00 -999 ? >ILE.A 109 16.65 28.72 9.64 17.15 29.47 8.43 16.90 29.10 9.03 3 0 1000.00 -999 ? >LEU.A 110 18.27 23.57 7.63 16.25 22.82 7.44 17.26 23.20 7.53 3 0 1000.00 -999 ? >LEU.A 111 20.11 27.13 3.62 21.80 28.08 4.63 20.95 27.61 4.12 3 0 1000.00 -999 ? >GLY~A 112 19.23 23.88 0.65 19.85 24.11 0.98 19.54 23.99 0.82 1 0 1000.00 -999 ? >THR~A 113 21.96 22.04 -1.23 22.02 20.82 -3.00 21.99 21.43 -2.11 2 0 1000.00 -999 ? >GLY~A 114 22.59 25.19 -3.24 22.57 25.05 -2.40 22.58 25.12 -2.82 1 0 1000.00 -999 ? >GLY~A 115 22.58 27.24 -0.04 23.09 26.66 -0.25 22.84 26.95 -0.14 1 0 1000.00 -999 ? >LEU~A 116 25.41 23.70 1.75 24.48 22.97 3.56 24.94 23.33 2.66 3 0 1000.00 -999 ? >VAL~A 117 27.50 25.40 -1.76 27.55 24.42 -3.70 27.52 24.91 -2.73 3 0 1000.00 -999 ? >LYS~A 118 27.33 29.19 -1.78 23.27 29.17 -5.47 25.30 29.18 -3.63 2 0 1000.00 -999 ? >ALA~A 119 28.29 29.23 1.89 27.42 28.73 3.02 27.86 28.98 2.46 2 0 1000.00 -999 ? >TYR~A 120 30.68 25.09 2.87 29.80 24.37 5.40 30.24 24.73 4.13 3 0 1000.00 -999 ? >GLY~A 121 32.55 27.64 -2.10 32.27 28.18 -1.46 32.41 27.91 -1.78 1 0 1000.00 -999 ? >GLY~A 122 31.61 31.30 -1.74 32.04 30.85 -1.24 31.83 31.08 -1.49 1 0 1000.00 -999 ? >GLY~A 123 33.27 31.50 1.68 33.61 31.33 0.91 33.44 31.42 1.30 1 0 1000.00 -999 ? >VAL~A 124 36.61 30.45 0.18 37.68 28.56 0.11 37.14 29.50 0.15 3 0 1000.00 -999 ? >ASN~A 125 34.56 32.90 -3.44 34.83 34.18 -5.08 34.69 33.54 -4.26 2 0 1000.00 -999 ? >GLN~A 126 33.08 36.19 0.21 33.04 37.54 -1.40 33.06 36.87 -0.60 2 0 1000.00 -999 ? >ALA~A 127 38.65 35.11 1.69 38.84 33.74 2.33 38.75 34.42 2.01 2 0 1000.00 -999 ? >LEU~A 128 40.22 33.65 -2.58 40.99 31.61 -2.53 40.61 32.63 -2.56 3 0 1000.00 -999 ? >ARG~A 129 36.03 39.19 -3.25 34.68 38.56 -5.94 35.36 38.87 -4.60 2 0 1000.00 -999 ? >GLN.A 130 39.67 40.13 1.78 38.56 40.54 3.53 39.12 40.33 2.65 2 0 1000.00 -999 ? >LEU.A 131 44.61 35.51 -0.30 46.02 33.88 0.13 45.32 34.69 -0.08 3 0 1000.00 -999 ? >THR.A 132 48.16 38.54 -0.14 48.49 39.61 1.71 48.33 39.07 0.79 2 0 1000.00 -999 ? >THR^A 133 50.76 36.49 -1.99 49.44 35.99 -3.67 50.10 36.24 -2.83 2 0 1000.00 -999 ? >GLN^A 134 54.88 35.10 -0.50 56.37 34.93 1.01 55.63 35.01 0.26 2 0 1000.00 -999 ? >ARG^A 135 57.74 34.51 -9.18 54.95 33.95 -10.37 56.34 34.23 -9.78 2 0 1000.00 -999 ? >LYS^A 136 58.30 31.10 -4.75 58.35 26.44 -3.17 58.32 28.77 -3.96 2 0 1000.00 -999 ? >THR.A 137 61.00 29.60 -6.96 61.84 30.53 -8.72 61.42 30.07 -7.84 2 0 1000.00 -999 ? >PRO.A 138 60.54 25.39 -7.50 61.48 26.71 -5.97 61.01 26.05 -6.73 3 0 1000.00 -999 ? >LEU.A 139 65.74 24.33 -3.79 66.20 25.73 -2.19 65.97 25.03 -2.99 3 0 1000.00 -999 ? >THR^A 140 66.83 22.64 -7.74 67.24 22.86 -9.83 67.03 22.75 -8.78 2 0 1000.00 -999 ? >GLU^A 141 66.41 18.73 -4.91 65.64 17.09 -3.82 66.03 17.91 -4.37 2 0 1000.00 -999 ? >TYR^A 142 72.35 20.08 -8.74 71.59 22.24 -10.29 71.97 21.16 -9.52 3 0 1000.00 -999 ? >THR^A 143 74.07 15.13 -6.44 73.40 13.19 -7.10 73.73 14.16 -6.77 2 0 1000.00 -999 ? >LEU^A 144 77.80 16.89 -4.93 79.55 18.18 -4.91 78.68 17.53 -4.92 3 0 1000.00 -999 ? >GLN^A 145 81.35 10.49 -4.78 81.14 8.76 -6.05 81.25 9.62 -5.42 2 0 1000.00 -999 ? >CYH^A 146 83.16 14.28 -2.30 81.91 15.55 -0.14 82.53 14.91 -1.22 2 0 1000.00 -999 ? >GLU.A 147 87.53 12.91 -1.39 89.29 11.78 -1.52 88.41 12.35 -1.46 2 0 1000.00 -999 ? >TYR.A 148 84.65 11.46 5.17 82.78 9.40 5.05 83.71 10.43 5.11 3 0 1000.00 -999 ? >HIS.A 149 89.89 16.02 2.60 90.32 16.10 0.52 90.10 16.06 1.56 3 0 1000.00 -999 ? >GLN~A 150 87.18 17.80 -0.19 87.09 16.95 -2.15 87.14 17.37 -1.17 2 0 1000.00 -999 ? >LEU~A 151 82.29 17.15 4.96 80.50 15.95 4.80 81.39 16.55 4.88 3 0 1000.00 -999 ? >THR~A 152 82.70 21.28 6.13 84.16 21.19 7.72 83.43 21.24 6.92 2 0 1000.00 -999 ? >GLY~A 153 84.20 23.23 3.20 83.48 22.83 3.30 83.84 23.03 3.25 1 0 1000.00 -999 ? >ILE~A 154 81.00 20.94 0.28 80.90 19.99 -0.74 80.95 20.47 -0.23 3 0 1000.00 -999 ? >GLU~A 155 78.29 20.89 5.11 78.49 20.13 7.07 78.39 20.51 6.09 2 0 1000.00 -999 ? >ALA~A 156 79.90 26.40 3.86 81.26 26.77 4.42 80.58 26.58 4.14 2 0 1000.00 -999 ? >LEU~A 157 80.96 26.38 -0.92 83.13 26.66 -1.07 82.05 26.52 -1.00 3 0 1000.00 -999 ? >LEU~A 158 76.24 24.32 0.43 75.05 22.77 -0.51 75.64 23.55 -0.04 3 0 1000.00 -999 ? >GLY~A 159 75.21 28.02 2.42 75.68 28.23 1.79 75.45 28.13 2.11 1 0 1000.00 -999 ? >GLN~A 160 79.21 31.51 1.62 81.14 30.69 1.33 80.18 31.10 1.48 2 0 1000.00 -999 ? >CYH~A 161 74.81 30.27 -2.35 77.04 29.83 -3.93 75.93 30.05 -3.14 2 0 1000.00 -999 ? >ASP.A 162 70.64 30.77 -1.26 70.99 32.81 -0.87 70.82 31.79 -1.06 2 0 1000.00 -999 ? >GLY.A 163 72.05 26.11 -0.83 72.01 26.44 -0.04 72.03 26.28 -0.43 1 0 1000.00 -999 ? >LYS^A 164 70.95 23.32 1.48 66.68 22.26 1.00 68.82 22.79 1.24 2 0 1000.00 -999 ? >ILE^A 165 73.65 19.66 2.77 74.45 19.31 3.83 74.05 19.49 3.30 3 0 1000.00 -999 ? >ILE^A 166 68.75 17.12 0.27 67.54 17.68 0.58 68.14 17.40 0.42 3 0 1000.00 -999 ? >ASN^A 167 69.64 13.09 2.33 69.50 12.39 0.32 69.57 12.74 1.32 2 0 1000.00 -999 ? >SER^A 168 74.11 12.50 3.25 74.99 14.44 4.45 74.55 13.47 3.85 2 0 1000.00 -999 ? >ASP^A 169 74.98 8.29 1.37 75.00 6.16 1.60 74.99 7.22 1.48 2 0 1000.00 -999 ? >TYR^A 170 78.46 10.00 6.20 77.52 12.57 6.70 77.99 11.29 6.45 3 0 1000.00 -999 ? >GLN.A 171 78.43 5.51 0.73 78.28 6.79 -0.95 78.35 6.15 -0.11 2 0 1000.00 -999 ? >ALA.A 172 84.02 5.17 1.41 84.64 4.28 0.38 84.33 4.73 0.90 2 0 1000.00 -999 ? >PHE.A 173 84.56 8.38 -2.10 86.97 7.58 -3.20 85.77 7.98 -2.65 3 0 1000.00 -999 ? >VAL^A 174 80.46 11.06 0.79 80.48 12.55 2.39 80.47 11.81 1.59 3 0 1000.00 -999 ? >LEU^A 175 76.78 9.81 -2.07 75.80 9.91 -4.00 76.29 9.86 -3.04 3 0 1000.00 -999 ? >LEU^A 176 76.43 15.43 -0.92 77.42 16.36 0.84 76.92 15.90 -0.04 3 0 1000.00 -999 ? >ARG^A 177 69.69 14.79 -4.18 66.99 13.27 -4.72 68.34 14.03 -4.45 2 0 1000.00 -999 ? >VAL^A 178 72.23 19.06 -2.56 74.30 19.53 -2.97 73.26 19.29 -2.77 3 0 1000.00 -999 ? >ALA^A 179 69.64 21.71 -3.34 68.31 21.50 -2.61 68.97 21.60 -2.97 2 0 1000.00 -999 ? >LEU^A 180 71.76 25.50 -4.51 73.13 24.64 -5.97 72.45 25.07 -5.24 3 0 1000.00 -999 ? >PRO.A 181 68.99 29.42 -4.46 68.99 27.70 -5.87 68.99 28.56 -5.17 3 0 1000.00 -999 ? >ALA.A 182 69.03 27.48 -10.13 67.97 27.03 -11.11 68.50 27.26 -10.62 2 0 1000.00 -999 ? >ALA.A 183 70.42 31.01 -10.47 69.92 32.25 -9.75 70.17 31.63 -10.11 2 0 1000.00 -999 ? >LYS~A 184 73.44 30.25 -8.32 72.93 34.06 -3.48 73.18 32.15 -5.90 2 0 1000.00 -999 ? >VAL~A 185 74.51 26.90 -9.80 73.78 25.86 -11.61 74.15 26.38 -10.71 3 0 1000.00 -999 ? >ALA~A 186 77.19 28.42 -12.04 76.88 29.36 -13.18 77.04 28.89 -12.61 2 0 1000.00 -999 ? >GLU~A 187 78.70 32.21 -7.31 77.53 33.10 -5.81 78.12 32.65 -6.56 2 0 1000.00 -999 ? >PHE~A 188 77.44 25.56 -5.66 77.79 23.50 -3.84 77.61 24.53 -4.75 3 0 1000.00 -999 ? >SER~A 189 80.21 25.25 -9.59 78.59 24.11 -11.05 79.40 24.68 -10.32 2 0 1000.00 -999 ? >ALA~A 190 82.93 27.89 -10.04 82.73 29.32 -10.47 82.83 28.60 -10.26 2 0 1000.00 -999 ? >LYS~A 191 83.36 28.30 -6.30 81.21 31.90 -2.53 82.29 30.10 -4.41 2 0 1000.00 -999 ? >LEU~A 192 82.22 23.62 -6.57 81.02 22.04 -5.70 81.62 22.83 -6.13 3 0 1000.00 -999 ? >ALA~A 193 85.95 23.98 -8.80 85.73 24.28 -10.27 85.84 24.13 -9.53 2 0 1000.00 -999 ? >ASP~A 194 88.20 28.08 -7.25 88.31 29.01 -9.17 88.25 28.54 -8.21 2 0 1000.00 -999 ? >PHE~A 195 86.48 23.81 -2.06 86.28 22.28 0.27 86.38 23.05 -0.90 3 0 1000.00 -999 ? >SER~A 196 88.92 21.45 -5.30 87.09 20.74 -6.66 88.01 21.10 -5.98 2 0 1000.00 -999 ? >ARG.A 197 94.58 22.29 -6.71 95.53 19.97 -4.89 95.06 21.13 -5.80 2 0 1000.00 -999 ? >GLY.A 198 88.30 21.13 -10.67 88.60 20.68 -10.18 88.45 20.91 -10.43 1 0 1000.00 -999 ? >SER.A 199 88.02 17.55 -9.45 88.85 17.38 -7.24 88.43 17.46 -8.34 2 0 1000.00 -999 ? >LEU.A 200 84.33 18.79 -6.68 84.61 18.52 -4.54 84.47 18.65 -5.61 3 0 1000.00 -999 ? >GLN.A 201 81.58 15.91 -12.48 81.88 14.25 -13.83 81.73 15.08 -13.16 2 0 1000.00 -999 ? >LEU.A 202 78.03 19.84 -9.29 76.48 21.00 -8.34 77.25 20.42 -8.81 3 0 1000.00 -999 ? >LEU^A 203 75.69 14.80 -11.18 77.29 13.68 -12.12 76.49 14.24 -11.65 3 0 1000.00 -999 ? >ALA^A 204 71.77 16.85 -11.91 71.33 17.62 -13.15 71.55 17.23 -12.53 2 0 1000.00 -999 ? >ILE.A 205 68.29 14.44 -9.47 67.48 14.90 -9.35 67.89 14.67 -9.41 3 0 1000.00 -999 ? >GLU.A 207 67.43 6.81 -11.49 68.64 5.58 -10.26 68.03 6.20 -10.88 2 0 1000.00 -999 ?