REMARK SOURCE hebe.pdb HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 17-MAY-04 1WDJ COMPND HYPOTHETICAL PROTEIN TT1808; COMPND 3 CHAIN: A, B, C; 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_VECTOR_TYPE: PLASMID; SOURCE 7 EXPRESSION_SYSTEM_PLASMID: PET11A AUTHOR M.IDAKA,T.WADA,K.MURAYAMA,T.TERADA,S.KURAMITSU,M.SHIROUZU, AUTHOR 2 S.YOKOYAMA,RIKEN STRUCTURAL GENOMICS/PROTEOMICS INITIATIVE AUTHOR 3 (RSGI) >PRO.A 2 24.12 65.62 28.31 24.00 66.22 26.17 24.06 65.92 27.24 3 0 1000.00 -999 ? >LEU^A 3 28.39 69.43 25.90 28.15 70.44 24.01 28.27 69.93 24.95 3 0 1000.00 -999 ? >VAL^A 4 30.15 66.31 28.76 30.05 64.16 28.92 30.10 65.24 28.84 3 0 1000.00 -999 ? >LEU^A 5 32.51 69.72 31.09 31.97 71.21 29.63 32.24 70.47 30.36 3 0 1000.00 -999 ? >ASP.A 6 36.12 65.01 31.55 36.10 63.12 32.50 36.11 64.07 32.03 2 0 1000.00 -999 ? >LEU.A 7 36.01 68.06 36.48 34.68 69.73 36.09 35.34 68.89 36.28 3 0 1000.00 -999 ? >ALA.A 8 39.44 65.24 37.52 40.95 65.42 37.49 40.19 65.33 37.51 2 0 1000.00 -999 ? >ARG.A 9 37.35 69.26 42.76 37.54 72.12 41.63 37.45 70.69 42.19 2 0 1000.00 -999 ? >PRO.A 10 33.88 63.77 42.05 34.05 65.63 40.84 33.97 64.70 41.45 3 0 1000.00 -999 ? >VAL.A 11 31.63 68.98 40.10 29.98 69.68 38.83 30.80 69.33 39.46 3 0 1000.00 -999 ? >SER~A 12 30.09 70.46 43.27 31.05 72.61 43.77 30.57 71.53 43.52 2 0 1000.00 -999 ? >GLU~A 13 25.33 69.98 45.38 24.57 69.58 47.28 24.95 69.78 46.33 2 0 1000.00 -999 ? >GLU~A 14 29.82 76.85 45.53 28.35 78.23 46.15 29.09 77.54 45.84 2 0 1000.00 -999 ? >GLU~A 15 32.20 74.37 41.40 33.56 72.78 41.56 32.88 73.57 41.48 2 0 1000.00 -999 ? >LEU~A 16 25.61 72.69 39.94 25.69 70.68 39.18 25.65 71.69 39.56 3 0 1000.00 -999 ? >ARG~A 17 23.69 78.94 44.22 25.09 79.98 46.74 24.39 79.46 45.48 2 0 1000.00 -999 ? >ARG~A 18 30.91 80.53 40.58 33.36 82.35 40.74 32.14 81.44 40.66 2 0 1000.00 -999 ? >LEU~A 19 27.85 76.34 35.99 29.89 75.59 35.74 28.87 75.97 35.86 3 0 1000.00 -999 ? >SER~A 20 23.69 78.13 36.09 22.59 76.17 36.99 23.14 77.15 36.54 2 0 1000.00 -999 ? >GLU~A 21 23.87 81.58 39.77 24.41 82.53 41.57 24.14 82.06 40.67 2 0 1000.00 -999 ? >LEU~A 22 28.27 82.00 34.92 29.77 83.03 36.06 29.02 82.51 35.49 3 0 1000.00 -999 ? >ASN~A 23 25.72 79.40 31.52 27.85 79.56 31.61 26.79 79.48 31.57 2 0 1000.00 -999 ? >PRO.A 24 22.05 83.89 32.13 22.07 81.69 31.62 22.06 82.79 31.88 3 0 1000.00 -999 ? >GLY.A 25 19.60 79.30 29.09 20.12 79.00 29.64 19.86 79.15 29.37 1 0 1000.00 -999 ? >TYR^A 26 23.80 77.05 28.58 24.52 78.09 26.10 24.16 77.57 27.34 3 0 1000.00 -999 ? >GLN^A 27 19.66 71.28 32.64 18.08 70.05 32.00 18.87 70.67 32.32 2 0 1000.00 -999 ? >TRP^A 28 24.46 75.24 33.75 28.04 74.93 32.15 26.25 75.08 32.95 3 0 1000.00 -999 ? >GLU^A 29 21.45 67.98 34.66 20.40 66.76 33.26 20.92 67.37 33.96 2 0 1000.00 -999 ? >ARG^A 30 28.01 66.02 40.95 27.10 66.18 43.89 27.56 66.10 42.42 2 0 1000.00 -999 ? >SER.A 31 26.41 62.59 36.15 28.66 61.97 35.50 27.53 62.28 35.83 2 0 1000.00 -999 ? >PRO.A 32 24.87 58.63 37.04 26.48 59.96 37.84 25.68 59.29 37.44 3 0 1000.00 -999 ? >GLU.A 33 30.66 57.57 36.03 28.68 57.45 35.29 29.67 57.51 35.66 2 0 1000.00 -999 ? >GLY.A 34 30.47 63.01 38.81 30.47 62.86 38.05 30.47 62.93 38.43 1 0 1000.00 -999 ? >ARG.A 35 32.68 62.17 33.03 34.49 59.98 31.90 33.59 61.07 32.46 2 0 1000.00 -999 ? >LEU^A 36 30.09 69.14 33.97 29.55 71.08 34.69 29.82 70.11 34.33 3 0 1000.00 -999 ? >TRP^A 37 27.10 64.70 31.49 24.43 61.98 32.54 25.77 63.34 32.02 3 0 1000.00 -999 ? >VAL^A 38 25.38 70.77 29.84 26.79 72.41 30.06 26.09 71.59 29.95 3 0 1000.00 -999 ? >SER^A 39 22.49 71.27 27.46 20.88 69.93 28.71 21.69 70.60 28.09 2 0 1000.00 -999 ? >PRO^A 40 21.59 73.79 23.99 21.23 73.82 26.19 21.41 73.80 25.09 3 0 1000.00 -999 ? >THR.A 41 17.16 75.13 26.36 15.97 74.73 28.09 16.56 74.93 27.23 2 0 1000.00 -999 ? >GLY~A 42 15.98 76.89 23.23 15.47 76.51 23.76 15.72 76.70 23.49 1 0 1000.00 -999 ? >GLY~A 43 12.55 78.24 22.38 12.79 77.48 22.34 12.67 77.86 22.36 1 0 1000.00 -999 ? >GLU~A 44 11.18 74.76 18.60 9.09 74.93 18.34 10.13 74.84 18.47 2 0 1000.00 -999 ? >SER~A 45 12.28 73.02 24.15 14.42 71.92 23.83 13.35 72.47 23.99 2 0 1000.00 -999 ? >GLY~A 46 11.05 75.74 26.47 10.63 75.37 25.92 10.84 75.55 26.19 1 0 1000.00 -999 ? >ARG~A 47 7.05 76.03 21.25 6.14 73.40 19.99 6.60 74.72 20.62 2 0 1000.00 -999 ? >ARG~A 48 8.54 70.24 22.08 9.33 70.60 19.18 8.93 70.42 20.63 2 0 1000.00 -999 ? >SER~A 49 8.48 71.61 28.73 10.39 73.15 28.93 9.44 72.38 28.83 2 0 1000.00 -999 ? >LEU~A 50 6.18 75.89 29.24 4.39 76.79 30.14 5.28 76.34 29.69 3 0 1000.00 -999 ? >GLN~A 51 1.87 71.70 26.28 -0.04 72.35 27.00 0.92 72.03 26.64 2 0 1000.00 -999 ? >LEU~A 52 5.40 68.66 29.51 5.83 66.67 30.26 5.61 67.67 29.88 3 0 1000.00 -999 ? >ALA~A 53 4.64 71.08 33.25 5.71 72.13 33.62 5.17 71.60 33.43 2 0 1000.00 -999 ? >TYR~A 54 -0.51 73.90 31.33 -3.28 74.14 31.01 -1.90 74.02 31.17 3 0 1000.00 -999 ? >GLN~A 55 -0.86 69.25 29.82 -0.80 67.84 28.22 -0.83 68.54 29.02 2 0 1000.00 -999 ? >LEU~A 56 2.66 67.91 35.47 3.53 66.29 36.61 3.10 67.10 36.04 3 0 1000.00 -999 ? >ALA~A 57 0.40 71.20 37.42 0.95 72.60 37.14 0.67 71.90 37.28 2 0 1000.00 -999 ? >ARG~A 58 -5.67 71.73 33.23 -5.33 70.63 30.39 -5.50 71.18 31.81 2 0 1000.00 -999 ? >TRP~A 59 -4.15 64.42 37.45 -1.17 63.49 39.86 -2.66 63.95 38.66 3 0 1000.00 -999 ? >ASN~A 60 -0.46 68.68 40.80 0.17 68.54 42.83 -0.14 68.61 41.82 2 0 1000.00 -999 ? >GLU~A 61 -4.86 73.84 41.29 -5.16 75.62 40.14 -5.01 74.73 40.72 2 0 1000.00 -999 ? >GLU~A 62 -7.07 68.09 38.80 -8.13 67.53 37.04 -7.60 67.81 37.92 2 0 1000.00 -999 ? >ARG~A 63 -6.48 63.41 41.44 -8.09 61.07 40.34 -7.29 62.24 40.89 2 0 1000.00 -999 ? >GLY~A 64 -3.37 67.89 45.56 -3.31 67.18 45.26 -3.34 67.53 45.41 1 0 1000.00 -999 ? >LEU.A 65 -1.42 63.48 45.10 -3.02 62.03 45.27 -2.22 62.76 45.18 3 0 1000.00 -999 ? >GLY^A 66 2.02 66.44 45.72 1.54 66.97 45.43 1.78 66.70 45.58 1 0 1000.00 -999 ? >VAL^A 67 4.32 69.13 44.40 5.46 70.20 45.94 4.89 69.66 45.17 3 0 1000.00 -999 ? >VAL^A 68 5.26 69.93 40.79 3.87 69.62 39.09 4.56 69.77 39.94 3 0 1000.00 -999 ? >PHE^A 69 9.67 70.59 41.76 9.34 70.03 44.47 9.50 70.31 43.11 3 0 1000.00 -999 ? >ASP.A 70 9.25 74.56 35.94 10.56 75.92 36.89 9.90 75.24 36.42 2 0 1000.00 -999 ? >SER.A 71 12.42 72.24 34.14 12.28 73.71 32.24 12.35 72.98 33.19 2 0 1000.00 -999 ? >SER.A 72 15.02 74.42 35.87 13.96 76.26 37.09 14.49 75.34 36.48 2 0 1000.00 -999 ? >THR.A 73 14.96 72.27 38.98 13.34 72.22 40.42 14.15 72.25 39.70 2 0 1000.00 -999 ? >GLY.A 74 17.77 69.83 39.73 17.21 70.00 40.36 17.49 69.91 40.04 1 0 1000.00 -999 ? >PHE^A 75 14.80 66.66 41.75 12.40 68.11 41.61 13.60 67.38 41.68 3 0 1000.00 -999 ? >LYS^A 76 20.08 65.07 43.99 23.89 66.41 48.82 21.98 65.74 46.40 2 0 1000.00 -999 ? >PHE.A 77 18.51 61.32 41.47 16.50 62.59 39.97 17.50 61.95 40.72 3 0 1000.00 -999 ? >PRO.A 78 18.93 57.73 45.94 20.76 58.89 45.41 19.85 58.31 45.67 3 0 1000.00 -999 ? >ASP.A 79 24.00 57.00 42.12 23.02 58.13 40.62 23.51 57.57 41.37 2 0 1000.00 -999 ? >GLY.A 80 25.15 61.38 43.74 24.66 61.19 43.16 24.91 61.28 43.45 1 0 1000.00 -999 ? >SER.A 81 23.99 62.53 40.32 22.21 61.09 39.55 23.10 61.81 39.93 2 0 1000.00 -999 ? >ILE^A 82 22.85 67.14 40.64 23.03 68.16 41.72 22.94 67.65 41.18 3 0 1000.00 -999 ? >LEU^A 83 19.20 64.23 36.90 20.56 62.64 36.32 19.88 63.43 36.61 3 0 1000.00 -999 ? >SER.A 84 17.12 68.14 35.96 16.72 70.49 35.40 16.92 69.31 35.68 2 0 1000.00 -999 ? >PRO.A 85 13.17 66.13 36.23 14.57 66.89 34.64 13.87 66.51 35.44 3 0 1000.00 -999 ? >ASP.A 86 11.14 68.61 30.73 12.72 68.79 29.32 11.93 68.70 30.03 2 0 1000.00 -999 ? >ALA^A 87 9.00 68.19 34.84 7.62 68.16 34.15 8.31 68.18 34.50 2 0 1000.00 -999 ? >ALA^A 88 8.82 66.30 38.12 10.19 66.42 38.87 9.50 66.36 38.49 2 0 1000.00 -999 ? >PHE^A 89 3.92 64.28 41.21 2.02 63.78 43.22 2.97 64.03 42.22 3 0 1000.00 -999 ? >VAL^A 90 7.03 64.67 44.35 8.91 65.38 45.26 7.97 65.02 44.81 3 0 1000.00 -999 ? >GLU^A 91 4.29 60.91 46.15 3.72 58.97 46.77 4.01 59.94 46.46 2 0 1000.00 -999 ? >ARG~A 92 0.33 67.67 50.23 -2.15 69.47 50.14 -0.91 68.57 50.19 2 0 1000.00 -999 ? >GLY~A 93 4.95 63.34 52.32 5.33 63.71 51.69 5.14 63.52 52.00 1 0 1000.00 -999 ? >ALA~A 94 8.34 63.03 50.64 8.54 62.40 49.25 8.44 62.71 49.94 2 0 1000.00 -999 ? >TRP~A 95 7.32 70.10 49.58 10.68 70.80 47.66 9.00 70.45 48.62 3 0 1000.00 -999 ? >GLU~A 96 5.06 68.15 53.59 5.41 70.21 53.15 5.23 69.18 53.37 2 0 1000.00 -999 ? >ALA~A 97 10.18 65.36 55.13 10.36 63.92 54.69 10.27 64.64 54.92 2 0 1000.00 -999 ? >LEU.A 98 13.05 68.06 52.31 13.75 66.83 50.70 13.40 67.45 51.51 3 0 1000.00 -999 ? >SER~A 99 14.47 70.51 55.77 16.88 70.79 55.40 15.68 70.65 55.58 2 0 1000.00 -999 ? >GLU~A 100 13.58 76.56 54.88 13.79 78.21 56.19 13.69 77.38 55.53 2 0 1000.00 -999 ? >ALA~A 101 17.66 73.92 53.38 18.86 73.67 54.28 18.26 73.79 53.83 2 0 1000.00 -999 ? >GLU~A 102 17.67 68.89 53.18 17.08 67.07 54.06 17.38 67.98 53.62 2 0 1000.00 -999 ? >ARG~A 103 11.00 72.13 52.06 8.87 71.21 54.07 9.93 71.67 53.07 2 0 1000.00 -999 ? >GLU~A 104 16.42 77.76 49.47 14.55 78.65 49.04 15.48 78.20 49.26 2 0 1000.00 -999 ? >GLY~A 105 18.90 73.56 47.34 18.08 73.22 47.31 18.49 73.39 47.33 1 0 1000.00 -999 ? >PHE.A 106 20.68 70.96 43.46 22.10 72.82 41.92 21.40 71.89 42.69 3 0 1000.00 -999 ? >PRO.A 107 14.57 69.67 45.70 16.52 68.80 46.36 15.54 69.23 46.03 3 0 1000.00 -999 ? >PRO.A 108 17.70 65.99 50.16 17.54 65.73 47.95 17.62 65.86 49.06 3 0 1000.00 -999 ? >LEU.A 109 14.05 62.96 47.54 12.69 64.59 47.12 13.37 63.77 47.33 3 0 1000.00 -999 ? >ALA.A 110 14.04 60.77 43.65 14.35 59.27 43.42 14.19 60.02 43.54 2 0 1000.00 -999 ? >PRO.A 111 12.10 64.10 41.50 11.49 62.19 42.52 11.80 63.15 42.01 3 0 1000.00 -999 ? >LYS.A 112 7.99 59.74 42.14 2.17 57.48 43.25 5.08 58.61 42.69 2 0 1000.00 -999 ? >ALA^A 113 7.61 60.77 38.46 6.15 60.92 38.02 6.88 60.84 38.24 2 0 1000.00 -999 ? >VAL^A 114 9.91 62.58 36.04 11.82 61.75 36.68 10.86 62.16 36.36 3 0 1000.00 -999 ? >PHE^A 115 6.90 64.08 32.87 4.57 63.04 34.02 5.73 63.56 33.45 3 0 1000.00 -999 ? >GLU^A 116 13.96 63.32 31.01 15.29 64.97 31.28 14.63 64.15 31.15 2 0 1000.00 -999 ? >VAL^A 117 11.23 66.01 26.38 9.61 67.35 25.99 10.42 66.68 26.19 3 0 1000.00 -999 ? >ARG.A 118 14.60 63.14 20.59 15.82 63.22 17.81 15.21 63.18 19.20 2 0 1000.00 -999 ? >SER.A 119 15.13 68.42 22.13 17.34 68.88 22.93 16.24 68.65 22.53 2 0 1000.00 -999 ? >ALA.A 120 16.49 68.57 18.56 16.31 69.74 17.58 16.40 69.16 18.07 2 0 1000.00 -999 ? >SER.A 121 20.13 68.53 19.73 20.31 70.21 21.51 20.22 69.37 20.62 2 0 1000.00 -999 ? >GLN.A 122 18.89 64.12 23.88 19.64 64.45 25.85 19.26 64.28 24.86 2 0 1000.00 -999 ? >ASP~A 123 21.58 61.00 20.67 21.51 59.15 19.59 21.55 60.08 20.13 2 0 1000.00 -999 ? >PRO~A 124 16.67 59.86 19.19 17.81 59.87 21.10 17.24 59.87 20.14 3 0 1000.00 -999 ? >GLU~A 125 20.26 54.30 22.61 18.33 53.45 22.28 19.29 53.88 22.45 2 0 1000.00 -999 ? >GLU~A 126 23.39 59.86 24.70 24.40 61.54 23.93 23.90 60.70 24.32 2 0 1000.00 -999 ? >LEU~A 127 16.89 60.99 25.93 16.23 62.91 26.65 16.56 61.95 26.29 3 0 1000.00 -999 ? >ARG~A 128 14.65 54.92 24.07 14.74 51.92 24.68 14.70 53.42 24.38 2 0 1000.00 -999 ? >ALA~A 129 19.62 55.71 29.01 21.05 55.84 28.49 20.33 55.77 28.75 2 0 1000.00 -999 ? >LYS~A 130 19.01 58.71 31.29 18.39 64.99 32.31 18.70 61.85 31.80 2 0 1000.00 -999 ? >MET~A 131 15.62 57.12 32.04 13.89 59.53 30.72 14.76 58.33 31.38 2 0 1000.00 -999 ? >GLY~A 132 17.44 54.04 33.37 17.55 54.85 33.60 17.50 54.44 33.49 1 0 1000.00 -999 ? >ILE~A 133 20.35 57.47 35.30 21.62 58.17 35.24 20.98 57.82 35.27 3 0 1000.00 -999 ? >TYR~A 134 15.38 59.82 35.78 15.80 62.49 35.01 15.59 61.16 35.39 3 0 1000.00 -999 ? >LEU~A 135 14.24 53.39 36.50 12.40 53.70 35.36 13.32 53.55 35.93 3 0 1000.00 -999 ? >ARG~A 136 21.41 53.36 37.94 24.00 54.96 37.39 22.70 54.16 37.67 2 0 1000.00 -999 ? >ASN~A 137 18.29 57.12 41.24 20.40 57.14 40.98 19.34 57.13 41.11 2 0 1000.00 -999 ? >GLY.A 138 14.18 55.26 42.76 14.18 55.57 42.07 14.18 55.42 42.42 1 0 1000.00 -999 ? >VAL.A 139 11.93 57.14 40.34 12.26 58.73 38.90 12.10 57.93 39.62 3 0 1000.00 -999 ? >LEU.A 140 7.55 55.11 40.99 7.91 54.26 42.97 7.73 54.69 41.98 3 0 1000.00 -999 ? >LEU^A 141 6.14 57.20 36.69 4.71 57.22 35.06 5.42 57.21 35.88 3 0 1000.00 -999 ? >GLY^A 142 9.72 58.11 33.84 8.96 57.71 33.58 9.34 57.91 33.71 1 0 1000.00 -999 ? >VAL^A 143 8.11 59.62 30.75 5.98 60.13 30.76 7.05 59.88 30.75 3 0 1000.00 -999 ? >LEU^A 144 11.28 59.39 27.28 13.03 59.73 26.02 12.16 59.56 26.65 3 0 1000.00 -999 ? >VAL^A 145 8.44 62.50 24.95 6.67 63.79 25.18 7.55 63.15 25.06 3 0 1000.00 -999 ? >ASP^A 146 10.56 61.46 20.82 11.84 61.96 19.21 11.20 61.71 20.01 2 0 1000.00 -999 ? >PRO.A 147 9.72 66.98 20.47 8.58 65.10 20.06 9.15 66.04 20.27 3 0 1000.00 -999 ? >TYR.A 148 12.06 66.33 16.87 12.67 68.88 17.84 12.36 67.60 17.36 3 0 1000.00 -999 ? >ALA.A 149 8.98 61.16 16.16 9.75 60.02 16.80 9.36 60.59 16.48 2 0 1000.00 -999 ? >ARG.A 150 3.67 64.18 15.28 2.64 66.54 13.62 3.16 65.36 14.45 2 0 1000.00 -999 ? >ALA^A 151 6.08 59.25 20.18 7.03 58.16 19.65 6.56 58.70 19.91 2 0 1000.00 -999 ? >VAL^A 152 6.20 58.78 23.92 4.49 59.01 25.30 5.35 58.90 24.61 3 0 1000.00 -999 ? >GLU^A 153 9.78 54.37 25.88 11.40 53.69 24.68 10.59 54.03 25.28 2 0 1000.00 -999 ? >VAL^A 154 6.84 55.17 29.52 4.81 55.42 30.23 5.83 55.30 29.87 3 0 1000.00 -999 ? >PHE^A 155 11.43 54.37 30.59 12.47 54.70 27.99 11.95 54.54 29.29 3 0 1000.00 -999 ? >ARG.A 156 4.46 51.72 35.07 2.40 53.21 33.32 3.43 52.47 34.19 2 0 1000.00 -999 ? >PRO.A 157 10.06 51.58 39.05 10.11 50.32 37.22 10.09 50.95 38.13 3 0 1000.00 -999 ? >GLY.A 158 10.43 46.15 36.73 10.16 46.71 36.23 10.30 46.43 36.48 1 0 1000.00 -999 ? >LYS.A 159 8.47 46.63 33.53 3.67 48.38 37.05 6.07 47.51 35.29 2 0 1000.00 -999 ? >PRO.A 160 8.34 44.46 29.80 8.98 46.48 30.49 8.66 45.47 30.14 3 0 1000.00 -999 ? >PRO.A 161 11.48 49.73 27.69 9.56 49.57 28.76 10.52 49.65 28.22 3 0 1000.00 -999 ? >LEU^A 162 4.86 51.27 27.47 2.97 50.42 26.87 3.92 50.84 27.17 3 0 1000.00 -999 ? >ARG^A 163 9.31 53.39 20.72 9.02 55.39 18.44 9.16 54.39 19.58 2 0 1000.00 -999 ? >LEU^A 164 2.39 55.13 22.90 1.84 53.92 24.63 2.11 54.53 23.76 3 0 1000.00 -999 ? >GLU^A 165 5.34 54.95 17.73 6.18 53.86 16.13 5.76 54.40 16.93 2 0 1000.00 -999 ? >GLY.A 166 0.87 58.81 17.08 0.83 58.46 17.79 0.85 58.63 17.43 1 0 1000.00 -999 ? >VAL.A 167 -1.36 58.60 20.14 -0.49 57.13 21.49 -0.92 57.87 20.81 3 0 1000.00 -999 ? >GLU.A 168 -5.34 63.16 21.35 -6.97 63.67 20.09 -6.16 63.41 20.72 2 0 1000.00 -999 ? >ARG^A 169 -6.84 61.68 26.47 -9.02 62.92 28.22 -7.93 62.30 27.35 2 0 1000.00 -999 ? >VAL^A 170 -1.40 58.54 27.51 0.76 58.53 27.82 -0.32 58.53 27.66 3 0 1000.00 -999 ? >SER^A 171 -2.74 57.38 30.88 -3.93 55.89 32.40 -3.33 56.64 31.64 2 0 1000.00 -999 ? >LEU.A 172 0.76 58.85 33.72 2.13 59.45 32.13 1.45 59.15 32.93 3 0 1000.00 -999 ? >ASP.A 173 -3.70 55.32 35.89 -5.03 56.87 36.39 -4.36 56.10 36.14 2 0 1000.00 -999 ? >PRO.A 174 -0.76 52.41 39.26 -1.44 54.24 38.19 -1.10 53.32 38.72 3 0 1000.00 -999 ? >GLU.A 175 3.57 55.03 38.76 2.71 53.64 37.43 3.14 54.33 38.09 2 0 1000.00 -999 ? >LEU.A 176 0.33 60.50 37.74 2.30 61.43 37.77 1.31 60.97 37.75 3 0 1000.00 -999 ? >PRO.A 177 -3.19 58.31 41.78 -3.24 58.91 39.64 -3.22 58.61 40.71 3 0 1000.00 -999 ? >GLY.A 178 -6.30 60.03 36.91 -5.55 60.12 36.88 -5.92 60.08 36.90 1 0 1000.00 -999 ? >PHE.A 179 -1.58 63.34 34.65 -0.14 65.14 33.02 -0.86 64.24 33.84 3 0 1000.00 -999 ? >ALA^A 180 -3.52 61.55 31.20 -4.84 61.26 30.50 -4.18 61.40 30.85 2 0 1000.00 -999 ? >LEU^A 181 0.67 63.01 29.33 2.43 64.24 28.96 1.55 63.62 29.14 3 0 1000.00 -999 ? >SER^A 182 -2.11 65.06 26.11 -3.43 66.71 24.89 -2.77 65.88 25.50 2 0 1000.00 -999 ? >LEU.A 183 0.98 63.42 22.80 1.80 61.78 23.97 1.39 62.60 23.38 3 0 1000.00 -999 ? >PRO~A 184 -2.36 65.70 20.16 -0.43 66.51 20.95 -1.39 66.11 20.55 3 0 1000.00 -999 ? >PRO~A 185 -1.82 69.55 23.69 -0.07 69.51 22.31 -0.94 69.53 23.00 3 0 1000.00 -999 ? >LEU~A 186 4.24 67.78 23.67 3.19 68.06 25.54 3.72 67.92 24.61 3 0 1000.00 -999 ? >TRP~A 187 1.75 66.05 17.89 4.00 63.88 20.29 2.88 64.96 19.09 3 0 1000.00 -999 ? >LEU.B 36 19.83 78.67 54.52 17.82 78.78 53.73 18.82 78.72 54.13 3 0 1000.00 -999 ? >TRP.B 37 25.23 77.50 49.42 23.81 75.14 46.62 24.52 76.32 48.02 3 0 1000.00 -999 ? >VAL.B 38 19.88 78.79 48.15 18.09 80.01 48.60 18.98 79.40 48.38 3 0 1000.00 -999 ? >SER.B 39 19.85 77.92 44.46 20.72 76.48 42.70 20.28 77.20 43.58 2 0 1000.00 -999 ? >PRO.B 40 19.59 81.09 41.58 18.35 79.32 42.09 18.97 80.21 41.83 3 0 1000.00 -999 ? >THR.B 41 17.77 75.99 40.24 19.66 75.93 39.12 18.71 75.96 39.68 2 0 1000.00 -999 ? >GLY~B 42 16.74 74.45 43.59 16.16 74.77 43.08 16.45 74.61 43.34 1 0 1000.00 -999 ? >GLY~B 43 13.41 73.03 44.78 13.61 73.77 44.81 13.51 73.40 44.79 1 0 1000.00 -999 ? >GLU~B 44 11.77 76.14 48.83 9.69 76.15 49.19 10.73 76.14 49.01 2 0 1000.00 -999 ? >SER~B 45 12.49 78.32 43.35 14.63 79.46 43.79 13.56 78.89 43.57 2 0 1000.00 -999 ? >GLY~B 46 11.36 75.56 40.97 10.94 75.87 41.61 11.15 75.72 41.29 1 0 1000.00 -999 ? >ARG~B 47 6.59 74.31 46.37 6.03 77.07 47.56 6.31 75.69 46.96 2 0 1000.00 -999 ? >ARG~B 48 8.09 81.04 45.72 9.51 80.38 48.33 8.80 80.71 47.02 2 0 1000.00 -999 ? >SER~B 49 8.25 79.44 39.12 10.24 78.08 38.61 9.24 78.76 38.87 2 0 1000.00 -999 ? >LEU~B 50 6.24 74.96 38.50 4.96 73.27 37.98 5.60 74.12 38.24 3 0 1000.00 -999 ? >GLN~B 51 1.88 78.11 42.24 0.88 76.24 41.95 1.38 77.18 42.10 2 0 1000.00 -999 ? >LEU~B 52 4.73 82.12 38.35 5.10 84.04 37.43 4.91 83.08 37.89 3 0 1000.00 -999 ? >ALA~B 53 4.17 79.56 34.81 5.37 78.65 34.44 4.77 79.11 34.63 2 0 1000.00 -999 ? >TYR~B 54 -0.50 76.04 36.82 -3.19 75.32 37.05 -1.85 75.68 36.94 3 0 1000.00 -999 ? >GLN~B 55 -1.49 80.88 38.16 -1.48 82.38 39.66 -1.48 81.63 38.91 2 0 1000.00 -999 ? >LEU~B 56 1.77 82.44 32.42 2.65 83.93 31.08 2.21 83.19 31.75 3 0 1000.00 -999 ? >ALA~B 57 -0.03 78.79 30.65 0.73 77.50 30.89 0.35 78.15 30.77 2 0 1000.00 -999 ? >ARG~B 58 -5.74 77.75 35.11 -5.40 79.26 37.79 -5.57 78.50 36.45 2 0 1000.00 -999 ? >TRP~B 59 -5.34 84.85 30.00 -2.23 86.08 27.90 -3.79 85.47 28.95 3 0 1000.00 -999 ? >ASN~B 60 -1.14 81.06 27.07 -0.58 81.40 25.03 -0.86 81.23 26.05 2 0 1000.00 -999 ? >GLU~B 61 -5.52 75.62 27.19 -5.31 73.70 28.10 -5.41 74.66 27.64 2 0 1000.00 -999 ? >GLU~B 62 -8.85 78.93 28.91 -9.70 77.16 28.08 -9.27 78.04 28.50 2 0 1000.00 -999 ? >ARG~B 63 -8.75 84.51 26.07 -8.94 87.57 25.89 -8.84 86.04 25.98 2 0 1000.00 -999 ? >GLY~B 64 -3.83 81.53 22.50 -4.02 82.25 22.69 -3.93 81.89 22.60 1 0 1000.00 -999 ? >LEU.B 65 -2.87 86.26 22.79 -4.84 87.16 22.89 -3.86 86.71 22.84 3 0 1000.00 -999 ? >GLY^B 66 1.03 83.89 22.04 0.59 83.28 22.34 0.81 83.58 22.19 1 0 1000.00 -999 ? >VAL^B 67 3.50 81.29 23.18 4.64 80.20 21.67 4.07 80.75 22.43 3 0 1000.00 -999 ? >VAL^B 68 4.56 80.78 26.80 3.26 81.20 28.49 3.91 80.99 27.64 3 0 1000.00 -999 ? >PHE^B 69 8.88 80.37 25.71 8.26 80.95 23.04 8.57 80.66 24.37 3 0 1000.00 -999 ? >ASP^B 70 9.21 76.55 31.52 10.77 75.36 30.71 9.99 75.96 31.11 2 0 1000.00 -999 ? >SER.B 71 12.14 79.02 33.49 11.93 77.26 35.11 12.03 78.14 34.30 2 0 1000.00 -999 ? >SER.B 72 14.74 77.09 31.46 14.68 74.78 32.27 14.71 75.94 31.87 2 0 1000.00 -999 ? >THR.B 73 14.33 78.99 28.21 12.56 79.11 26.98 13.44 79.05 27.59 2 0 1000.00 -999 ? >GLY.B 74 17.07 81.31 27.10 16.38 81.15 26.56 16.72 81.23 26.83 1 0 1000.00 -999 ? >PHE^B 75 13.80 84.49 25.50 11.39 83.10 25.90 12.59 83.80 25.70 3 0 1000.00 -999 ? >LYS^B 76 18.82 86.28 22.84 23.04 87.52 18.33 20.93 86.90 20.59 2 0 1000.00 -999 ? >PHE.B 77 16.98 90.01 25.79 14.77 88.89 27.14 15.88 89.45 26.47 3 0 1000.00 -999 ? >PRO.B 78 16.40 93.15 21.23 18.46 92.36 21.59 17.43 92.75 21.41 3 0 1000.00 -999 ? >ASP.B 79 21.60 94.53 24.65 21.39 93.06 26.14 21.49 93.79 25.40 2 0 1000.00 -999 ? >GLY.B 80 23.32 90.59 22.38 22.86 90.61 22.98 23.09 90.60 22.68 1 0 1000.00 -999 ? >SER.B 81 23.02 88.89 25.78 21.85 90.46 27.23 22.44 89.67 26.50 2 0 1000.00 -999 ? >ILE^B 82 21.77 84.28 26.63 21.28 83.67 25.40 21.52 83.98 26.02 3 0 1000.00 -999 ? >LEU^B 83 18.08 87.43 29.69 19.21 89.22 30.10 18.65 88.32 29.90 3 0 1000.00 -999 ? >SER.B 84 16.32 83.47 31.09 16.08 81.09 31.60 16.20 82.28 31.35 2 0 1000.00 -999 ? >PRO.B 85 12.25 85.14 31.14 13.80 84.53 32.62 13.02 84.83 31.88 3 0 1000.00 -999 ? >ASP.B 86 10.66 82.59 36.70 12.26 82.46 38.07 11.46 82.52 37.39 2 0 1000.00 -999 ? >ALA^B 87 8.43 82.60 32.60 7.07 82.50 33.31 7.75 82.55 32.95 2 0 1000.00 -999 ? >ALA^B 88 7.89 84.42 29.32 9.23 84.47 28.54 8.56 84.45 28.93 2 0 1000.00 -999 ? >PHE^B 89 2.83 86.17 26.37 0.87 86.64 24.40 1.85 86.40 25.38 3 0 1000.00 -999 ? >VAL^B 90 5.84 86.05 23.24 7.72 85.62 22.25 6.78 85.83 22.75 3 0 1000.00 -999 ? >GLU^B 91 2.63 90.02 21.43 3.14 91.96 20.71 2.89 90.99 21.07 2 0 1000.00 -999 ? >ARG~B 92 -1.24 83.59 16.69 -0.51 81.08 18.25 -0.88 82.34 17.47 2 0 1000.00 -999 ? >GLY~B 93 2.93 87.58 15.55 3.38 87.29 16.13 3.16 87.43 15.84 1 0 1000.00 -999 ? >ALA~B 94 6.48 87.94 16.83 6.86 88.51 18.20 6.67 88.22 17.51 2 0 1000.00 -999 ? >TRP~B 95 5.76 80.82 17.83 9.28 80.19 19.50 7.52 80.51 18.66 3 0 1000.00 -999 ? >GLU~B 96 2.98 83.20 14.15 1.06 83.42 13.29 2.02 83.31 13.72 2 0 1000.00 -999 ? >ALA~B 97 8.09 85.72 12.20 8.27 87.18 12.56 8.18 86.45 12.38 2 0 1000.00 -999 ? >LEU.B 98 10.94 82.97 14.93 11.69 84.33 16.42 11.32 83.65 15.67 3 0 1000.00 -999 ? >SER~B 99 12.41 80.63 11.39 14.82 80.69 11.52 13.61 80.66 11.46 2 0 1000.00 -999 ? >GLU~B 100 12.95 74.49 12.43 12.64 72.75 11.25 12.80 73.62 11.84 2 0 1000.00 -999 ? >ALA~B 101 16.22 77.52 13.49 17.33 77.89 12.50 16.77 77.71 12.99 2 0 1000.00 -999 ? >GLU~B 102 15.87 82.66 13.86 15.20 84.37 12.82 15.53 83.52 13.34 2 0 1000.00 -999 ? >ARG~B 103 9.28 78.71 15.63 6.65 79.29 14.20 7.97 79.00 14.92 2 0 1000.00 -999 ? >GLU~B 104 14.68 74.14 16.39 13.93 72.64 17.71 14.31 73.39 17.05 2 0 1000.00 -999 ? >GLY~B 105 17.77 78.20 19.54 16.96 78.44 19.59 17.37 78.32 19.57 1 0 1000.00 -999 ? >PHE.B 106 19.52 80.69 23.60 20.94 78.91 25.24 20.23 79.80 24.42 3 0 1000.00 -999 ? >PRO.B 107 13.28 81.62 21.44 15.17 82.61 20.75 14.22 82.12 21.09 3 0 1000.00 -999 ? >PRO.B 108 15.91 85.52 16.82 15.96 85.72 19.06 15.93 85.62 17.94 3 0 1000.00 -999 ? >LEU.B 109 12.40 88.37 19.76 11.27 86.52 19.99 11.84 87.45 19.88 3 0 1000.00 -999 ? >ALA.B 110 12.61 90.44 23.70 12.77 91.96 23.92 12.69 91.20 23.81 2 0 1000.00 -999 ? >PRO.B 111 10.97 86.98 25.83 10.19 88.84 24.88 10.58 87.91 25.36 3 0 1000.00 -999 ? >LYS.B 112 6.47 90.93 25.30 0.55 92.63 23.89 3.51 91.78 24.59 2 0 1000.00 -999 ? >ALA^B 113 6.23 89.93 28.97 4.81 89.57 29.39 5.52 89.75 29.18 2 0 1000.00 -999 ? >VAL^B 114 8.75 88.44 31.40 10.57 89.48 30.70 9.66 88.96 31.05 3 0 1000.00 -999 ? >PHE^B 115 5.89 86.60 34.57 3.41 87.37 33.47 4.65 86.98 34.02 3 0 1000.00 -999 ? >GLU^B 116 12.74 88.21 36.35 14.12 86.68 35.80 13.43 87.45 36.08 2 0 1000.00 -999 ? >VAL^B 117 10.30 85.15 41.00 8.82 83.57 41.39 9.56 84.36 41.19 3 0 1000.00 -999 ? >ARG.B 118 13.69 88.52 46.53 14.73 88.94 49.38 14.21 88.73 47.96 2 0 1000.00 -999 ? >SER.B 119 14.59 83.36 45.34 16.46 82.55 43.98 15.52 82.95 44.66 2 0 1000.00 -999 ? >ALA.B 120 16.31 83.88 48.71 16.30 82.82 49.80 16.31 83.35 49.26 2 0 1000.00 -999 ? >SER.B 121 19.65 83.66 46.85 21.23 82.65 45.27 20.44 83.16 46.06 2 0 1000.00 -999 ? >GLN.B 122 18.42 85.76 43.03 17.10 85.55 41.37 17.76 85.66 42.20 2 0 1000.00 -999 ? >ASP~B 123 20.05 91.43 46.99 21.02 92.29 45.36 20.54 91.86 46.18 2 0 1000.00 -999 ? >PRO~B 124 15.13 92.44 47.71 16.38 92.39 45.88 15.76 92.41 46.80 3 0 1000.00 -999 ? >GLU~B 125 18.13 97.60 45.51 16.43 98.56 44.66 17.28 98.08 45.08 2 0 1000.00 -999 ? >GLU~B 126 21.14 91.17 41.10 21.96 89.37 41.87 21.55 90.27 41.48 2 0 1000.00 -999 ? >LEU~B 127 15.35 90.96 40.77 15.32 88.81 40.60 15.34 89.88 40.69 3 0 1000.00 -999 ? >ARG~B 128 13.36 97.48 42.89 13.38 97.23 45.96 13.37 97.36 44.42 2 0 1000.00 -999 ? >ALA~B 129 18.14 96.27 38.07 19.59 96.10 38.58 18.86 96.18 38.33 2 0 1000.00 -999 ? >LYS~B 130 17.49 93.29 35.76 17.24 87.00 34.87 17.36 90.14 35.32 2 0 1000.00 -999 ? >MET~B 131 13.92 94.45 35.12 12.32 91.93 36.52 13.12 93.19 35.82 2 0 1000.00 -999 ? >GLY~B 132 15.48 97.68 33.85 15.61 96.88 33.59 15.55 97.28 33.72 1 0 1000.00 -999 ? >ILE~B 133 18.66 94.57 31.84 20.03 94.03 31.87 19.35 94.30 31.86 3 0 1000.00 -999 ? >TYR~B 134 13.97 91.72 31.42 14.62 89.10 32.18 14.29 90.41 31.80 3 0 1000.00 -999 ? >LEU~B 135 12.20 98.13 30.51 10.21 97.87 31.32 11.20 98.00 30.92 3 0 1000.00 -999 ? >ARG~B 136 18.57 100.35 30.01 19.64 99.47 32.75 19.11 99.91 31.38 2 0 1000.00 -999 ? >ASN~B 137 16.28 94.39 25.89 18.40 94.39 25.87 17.34 94.39 25.88 2 0 1000.00 -999 ? >GLY.B 138 12.06 96.06 24.53 12.14 95.70 25.21 12.10 95.88 24.87 1 0 1000.00 -999 ? >VAL.B 139 10.19 93.89 27.03 10.69 92.41 28.55 10.44 93.15 27.79 3 0 1000.00 -999 ? >LEU.B 140 5.68 95.45 26.33 5.89 96.35 24.36 5.78 95.90 25.34 3 0 1000.00 -999 ? >LEU^B 141 4.44 93.37 30.65 3.02 93.14 32.25 3.73 93.26 31.45 3 0 1000.00 -999 ? >GLY^B 142 8.11 92.90 33.54 7.33 93.21 33.77 7.72 93.05 33.66 1 0 1000.00 -999 ? >VAL^B 143 6.61 91.26 36.63 4.54 90.54 36.63 5.57 90.90 36.63 3 0 1000.00 -999 ? >LEU^B 144 9.77 91.79 40.04 11.64 91.48 41.06 10.71 91.63 40.55 3 0 1000.00 -999 ? >VAL^B 145 7.26 88.55 42.49 5.60 87.13 42.27 6.43 87.84 42.38 3 0 1000.00 -999 ? >ASP^B 146 9.37 89.86 46.51 10.98 89.64 47.85 10.17 89.75 47.18 2 0 1000.00 -999 ? >PRO.B 147 8.65 84.27 46.09 7.97 85.95 47.40 8.31 85.11 46.74 3 0 1000.00 -999 ? >TYR.B 148 11.64 85.43 50.40 12.48 83.02 49.23 12.06 84.22 49.82 3 0 1000.00 -999 ? >ALA.B 149 8.31 90.27 51.06 8.89 91.41 50.26 8.60 90.84 50.66 2 0 1000.00 -999 ? >ARG.B 150 3.51 86.63 52.30 2.90 84.32 54.21 3.21 85.48 53.26 2 0 1000.00 -999 ? >ALA^B 151 4.77 91.72 47.13 5.54 92.97 47.53 5.15 92.35 47.33 2 0 1000.00 -999 ? >VAL^B 152 4.88 92.08 43.40 3.11 91.70 42.15 4.00 91.89 42.78 3 0 1000.00 -999 ? >GLU^B 153 8.01 95.95 42.89 10.00 96.17 43.55 9.00 96.06 43.22 2 0 1000.00 -999 ? >VAL^B 154 5.15 95.59 37.75 3.10 95.10 37.18 4.12 95.35 37.47 3 0 1000.00 -999 ? >PHE^B 155 9.65 96.77 36.61 10.88 96.79 39.13 10.26 96.78 37.87 3 0 1000.00 -999 ? >ARG.B 156 2.49 98.59 32.10 0.45 96.87 33.64 1.47 97.73 32.87 2 0 1000.00 -999 ? >PRO.B 157 7.48 100.14 27.93 7.88 100.79 30.02 7.68 100.46 28.98 3 0 1000.00 -999 ? >GLY.B 158 7.52 105.06 30.06 7.31 104.43 30.60 7.41 104.74 30.33 1 0 1000.00 -999 ? >LYS.B 159 5.85 104.53 33.43 0.13 101.74 33.76 2.99 103.14 33.59 2 0 1000.00 -999 ? >PRO.B 160 6.23 106.51 37.20 6.70 104.47 36.44 6.46 105.49 36.82 3 0 1000.00 -999 ? >PRO.B 161 9.40 101.64 39.66 7.53 101.54 38.44 8.46 101.59 39.05 3 0 1000.00 -999 ? >LEU^B 162 2.99 99.46 39.60 0.92 99.36 40.15 1.95 99.41 39.87 3 0 1000.00 -999 ? >ARG^B 163 6.92 97.61 46.83 8.25 95.27 48.29 7.59 96.44 47.56 2 0 1000.00 -999 ? >LEU^B 164 0.49 95.29 44.31 -0.42 96.48 42.73 0.03 95.88 43.52 3 0 1000.00 -999 ? >GLU^B 165 3.11 94.08 50.38 4.59 95.25 51.31 3.85 94.67 50.85 2 0 1000.00 -999 ? >GLY.B 166 -1.78 92.62 50.23 -1.66 92.56 49.43 -1.72 92.59 49.83 1 0 1000.00 -999 ? >VAL.B 167 -3.53 92.05 46.90 -2.69 93.44 45.44 -3.11 92.75 46.17 3 0 1000.00 -999 ? >GLU.B 168 -6.24 86.56 45.68 -8.25 86.00 45.38 -7.24 86.28 45.53 2 0 1000.00 -999 ? >ARG^B 169 -8.00 87.01 41.34 -8.61 86.01 38.50 -8.30 86.51 39.92 2 0 1000.00 -999 ? >VAL^B 170 -3.10 91.58 39.87 -1.15 92.39 40.44 -2.12 91.98 40.16 3 0 1000.00 -999 ? >SER^B 171 -4.51 92.45 36.44 -5.73 93.71 34.77 -5.12 93.08 35.61 2 0 1000.00 -999 ? >LEU.B 172 -0.91 91.18 33.70 0.53 90.85 35.29 -0.19 91.02 34.50 3 0 1000.00 -999 ? >ASP.B 173 -5.52 94.28 31.21 -6.67 93.07 29.93 -6.09 93.67 30.57 2 0 1000.00 -999 ? >PRO.B 174 -2.65 97.52 28.17 -3.34 95.66 29.19 -3.00 96.59 28.68 3 0 1000.00 -999 ? >GLU.B 175 1.67 95.13 28.37 0.95 96.53 29.81 1.31 95.83 29.09 2 0 1000.00 -999 ? >LEU.B 176 -1.09 89.45 29.63 1.02 88.86 29.57 -0.03 89.15 29.60 3 0 1000.00 -999 ? >PRO.B 177 -4.98 90.35 25.56 -4.86 90.55 27.79 -4.92 90.45 26.67 3 0 1000.00 -999 ? >GLY.B 178 -7.85 88.96 30.42 -7.06 89.03 30.55 -7.45 89.00 30.49 1 0 1000.00 -999 ? >PHE.B 179 -2.66 86.56 32.87 -1.00 85.07 34.59 -1.83 85.81 33.73 3 0 1000.00 -999 ? >ALA^B 180 -4.70 88.29 36.22 -6.03 88.57 36.90 -5.36 88.43 36.56 2 0 1000.00 -999 ? >LEU^B 181 -0.49 87.35 38.33 1.34 86.30 38.79 0.42 86.82 38.56 3 0 1000.00 -999 ? >SER^B 182 -3.10 85.14 41.58 -4.38 83.59 42.93 -3.74 84.36 42.25 2 0 1000.00 -999 ? >LEU.B 183 -0.26 87.22 44.86 0.58 88.91 43.79 0.16 88.07 44.32 3 0 1000.00 -999 ? >PRO~B 184 -3.20 84.79 47.63 -1.29 84.06 46.75 -2.25 84.42 47.19 3 0 1000.00 -999 ? >PRO~B 185 -2.24 80.77 44.11 -0.55 81.03 45.52 -1.40 80.90 44.81 3 0 1000.00 -999 ? >LEU~B 186 3.54 83.15 44.03 3.21 83.19 41.90 3.37 83.17 42.96 3 0 1000.00 -999 ? >TRP~B 187 1.26 84.74 49.79 3.20 86.91 47.15 2.23 85.82 48.47 3 0 1000.00 -999 ? >PRO.C 2 29.23 80.32 19.22 27.22 79.62 18.63 28.22 79.97 18.92 3 0 1000.00 -999 ? >LEU^C 3 26.71 76.25 22.92 24.95 75.06 22.66 25.83 75.66 22.79 3 0 1000.00 -999 ? >VAL^C 4 28.63 80.15 24.63 28.90 82.27 24.28 28.77 81.21 24.46 3 0 1000.00 -999 ? >LEU^C 5 30.12 77.17 27.95 28.72 75.53 27.78 29.42 76.35 27.86 3 0 1000.00 -999 ? >ASP.C 6 30.77 81.83 31.44 32.17 83.02 32.53 31.47 82.42 31.99 2 0 1000.00 -999 ? >LEU.C 7 34.35 77.20 32.57 33.99 76.01 30.77 34.17 76.61 31.67 3 0 1000.00 -999 ? >ALA.C 8 33.95 81.13 35.46 33.47 80.54 36.82 33.71 80.83 36.14 2 0 1000.00 -999 ? >ARG.C 9 39.12 77.63 35.57 38.60 75.27 33.66 38.86 76.45 34.62 2 0 1000.00 -999 ? >PRO.C 10 40.42 82.97 31.79 39.22 81.08 31.83 39.82 82.02 31.81 3 0 1000.00 -999 ? >VAL.C 11 39.32 77.47 29.56 38.44 76.61 27.75 38.88 77.04 28.66 3 0 1000.00 -999 ? >SER~C 12 42.85 76.18 28.91 43.29 73.98 29.88 43.07 75.08 29.40 2 0 1000.00 -999 ? >GLU~C 13 45.96 74.66 23.78 47.92 75.26 23.29 46.94 74.96 23.54 2 0 1000.00 -999 ? >GLU~C 14 45.46 69.92 29.05 46.67 69.91 30.81 46.07 69.92 29.93 2 0 1000.00 -999 ? >GLU~C 15 40.81 72.32 30.53 40.13 73.76 31.89 40.47 73.04 31.21 2 0 1000.00 -999 ? >LEU~C 16 40.45 73.64 23.83 39.24 75.18 22.91 39.85 74.41 23.37 3 0 1000.00 -999 ? >ARG~C 17 45.28 69.61 22.47 48.01 70.56 21.42 46.64 70.08 21.94 2 0 1000.00 -999 ? >ARG~C 18 40.07 66.50 29.72 39.92 65.29 32.54 40.00 65.90 31.13 2 0 1000.00 -999 ? >LEU~C 19 36.16 70.01 25.58 35.40 70.65 27.49 35.78 70.33 26.53 3 0 1000.00 -999 ? >SER~C 20 36.89 67.99 21.59 38.04 69.89 20.60 37.47 68.94 21.09 2 0 1000.00 -999 ? >GLU~C 21 40.36 64.59 22.86 41.91 63.99 24.19 41.13 64.29 23.52 2 0 1000.00 -999 ? >LEU~C 22 34.75 64.14 26.02 36.13 63.91 27.65 35.44 64.02 26.84 3 0 1000.00 -999 ? >ASN~C 23 31.96 66.76 22.87 31.55 66.53 24.97 31.76 66.65 23.92 2 0 1000.00 -999 ? >PRO.C 24 32.79 62.46 19.39 33.44 64.59 19.36 33.11 63.52 19.37 3 0 1000.00 -999 ? >GLY.C 25 30.60 65.84 16.78 30.98 66.26 17.33 30.79 66.05 17.06 1 0 1000.00 -999 ? >TYR^C 26 29.41 69.17 19.55 26.90 68.07 20.00 28.15 68.62 19.78 3 0 1000.00 -999 ? >GLN^C 27 34.71 74.12 15.94 34.48 75.38 14.26 34.59 74.75 15.10 2 0 1000.00 -999 ? >TRP^C 28 34.68 70.58 20.88 32.64 71.05 24.22 33.66 70.82 22.55 3 0 1000.00 -999 ? >GLU^C 29 36.12 77.64 17.81 35.06 78.96 16.53 35.59 78.30 17.17 2 0 1000.00 -999 ? >ARG^C 30 40.78 80.09 25.66 43.83 79.79 25.47 42.30 79.94 25.56 2 0 1000.00 -999 ? >SER.C 31 36.58 83.37 22.75 35.35 84.00 24.74 35.97 83.68 23.74 2 0 1000.00 -999 ? >PRO.C 32 37.79 87.27 21.33 38.25 86.01 23.13 38.02 86.64 22.23 3 0 1000.00 -999 ? >GLU.C 33 35.49 88.34 26.54 35.12 88.29 24.44 35.31 88.32 25.49 2 0 1000.00 -999 ? >GLY.C 34 38.16 82.94 27.58 37.41 83.11 27.34 37.78 83.02 27.46 1 0 1000.00 -999 ? >ARG.C 35 31.65 83.93 27.91 32.05 86.79 29.00 31.85 85.36 28.45 2 0 1000.00 -999 ? >LEU^C 36 33.54 77.05 26.17 34.85 75.44 26.70 34.20 76.24 26.44 3 0 1000.00 -999 ? >TRP^C 37 31.97 81.42 22.32 33.67 84.00 19.88 32.82 82.71 21.10 3 0 1000.00 -999 ? >VAL^C 38 30.76 75.15 20.96 30.55 73.63 22.49 30.65 74.39 21.73 3 0 1000.00 -999 ? >SER^C 39 29.46 74.59 17.42 30.25 76.80 16.69 29.86 75.70 17.06 2 0 1000.00 -999 ? >PRO^C 40 25.83 72.89 16.08 27.96 72.30 15.94 26.90 72.60 16.01 3 0 1000.00 -999 ? >THR.C 41 29.87 69.60 13.20 31.80 68.56 13.36 30.83 69.08 13.28 2 0 1000.00 -999 ? >GLY~C 42 28.74 67.55 10.19 28.54 68.26 10.25 28.64 67.91 10.22 1 0 1000.00 -999 ? >GLY~C 43 25.51 67.65 8.27 26.31 67.75 8.00 25.91 67.70 8.13 1 0 1000.00 -999 ? >GLU~C 44 24.32 70.85 3.07 24.85 69.45 1.56 24.59 70.15 2.32 2 0 1000.00 -999 ? >SER~C 45 27.50 72.32 6.80 26.06 73.56 8.30 26.78 72.94 7.55 2 0 1000.00 -999 ? >GLY~C 46 30.39 69.88 7.24 29.93 70.07 6.55 30.16 69.98 6.90 1 0 1000.00 -999 ? >ARG~C 47 27.78 68.42 0.69 27.57 71.10 -0.75 27.68 69.76 -0.03 2 0 1000.00 -999 ? >ARG~C 48 27.00 74.72 2.79 24.09 73.96 3.38 25.54 74.34 3.08 2 0 1000.00 -999 ? >SER~C 49 33.39 73.08 4.68 32.69 73.45 6.94 33.04 73.27 5.81 2 0 1000.00 -999 ? >LEU~C 50 34.66 68.73 2.90 35.49 67.37 4.37 35.08 68.05 3.64 3 0 1000.00 -999 ? >GLN~C 51 32.50 72.77 -2.19 33.33 71.96 -3.96 32.91 72.36 -3.07 2 0 1000.00 -999 ? >LEU~C 52 35.07 75.87 1.32 35.42 77.98 1.40 35.25 76.93 1.36 3 0 1000.00 -999 ? >ALA~C 53 38.86 73.57 1.60 39.04 72.63 2.79 38.95 73.10 2.19 2 0 1000.00 -999 ? >TYR~C 54 38.20 69.90 -3.40 38.53 69.02 -6.06 38.36 69.46 -4.73 3 0 1000.00 -999 ? >GLN~C 55 36.23 74.90 -4.52 34.70 76.37 -4.74 35.47 75.64 -4.63 2 0 1000.00 -999 ? >LEU~C 56 41.21 76.48 -0.40 41.42 78.46 0.42 41.32 77.47 0.01 3 0 1000.00 -999 ? >ALA~C 57 43.70 73.09 -1.88 43.42 71.73 -1.22 43.56 72.41 -1.55 2 0 1000.00 -999 ? >ARG~C 58 40.35 72.00 -8.07 40.09 73.75 -10.55 40.22 72.88 -9.31 2 0 1000.00 -999 ? >TRP~C 59 44.46 79.59 -6.80 46.03 80.74 -3.37 45.25 80.17 -5.08 3 0 1000.00 -999 ? >ASN~C 60 47.12 75.78 -2.32 48.99 75.97 -1.30 48.06 75.88 -1.81 2 0 1000.00 -999 ? >GLU~C 61 48.24 70.47 -6.49 49.74 69.71 -5.19 48.99 70.09 -5.84 2 0 1000.00 -999 ? >GLU~C 62 47.74 76.30 -10.76 45.97 77.18 -11.54 46.85 76.74 -11.15 2 0 1000.00 -999 ? >ARG~C 63 48.78 80.12 -8.96 48.83 83.10 -9.68 48.80 81.61 -9.32 2 0 1000.00 -999 ? >GLY~C 64 52.29 76.68 -4.24 52.00 77.39 -4.29 52.14 77.03 -4.27 1 0 1000.00 -999 ? >LEU.C 65 51.40 81.09 -2.52 51.64 82.26 -4.32 51.52 81.68 -3.42 3 0 1000.00 -999 ? >GLY^C 66 51.12 78.28 1.13 50.91 77.74 0.63 51.01 78.01 0.88 1 0 1000.00 -999 ? >VAL^C 67 49.19 75.85 3.27 50.31 74.89 4.88 49.75 75.37 4.07 3 0 1000.00 -999 ? >VAL^C 68 45.48 75.10 3.21 44.28 74.99 1.43 44.88 75.05 2.32 3 0 1000.00 -999 ? >PHE^C 69 45.17 75.02 7.77 47.90 75.34 8.20 46.54 75.18 7.98 3 0 1000.00 -999 ? >ASP^C 70 39.68 71.02 6.29 40.69 69.72 7.63 40.19 70.37 6.96 2 0 1000.00 -999 ? >SER.C 71 37.52 73.19 9.31 35.77 71.57 9.23 36.64 72.38 9.27 2 0 1000.00 -999 ? >SER.C 72 39.37 70.89 11.70 41.11 69.49 10.75 40.24 70.19 11.23 2 0 1000.00 -999 ? >THR.C 73 42.21 73.28 12.61 44.13 73.42 11.61 43.17 73.35 12.11 2 0 1000.00 -999 ? >GLY.C 74 42.02 75.89 15.35 42.80 75.73 15.00 42.41 75.81 15.18 1 0 1000.00 -999 ? >PHE^C 75 44.52 79.08 12.82 44.74 77.56 10.45 44.63 78.32 11.63 3 0 1000.00 -999 ? >LYS^C 76 45.60 80.80 18.40 48.70 78.16 22.61 47.15 79.48 20.50 2 0 1000.00 -999 ? >PHE.C 77 43.48 84.51 16.27 42.63 83.12 13.97 43.06 83.82 15.12 3 0 1000.00 -999 ? >PRO.C 78 47.73 88.06 17.54 46.87 86.95 19.30 47.30 87.50 18.42 3 0 1000.00 -999 ? >ASP.C 79 42.89 88.90 21.44 41.65 87.57 20.36 42.27 88.24 20.90 2 0 1000.00 -999 ? >GLY.C 80 44.32 84.67 23.26 43.83 84.85 22.66 44.07 84.76 22.96 1 0 1000.00 -999 ? >SER.C 81 41.26 83.46 21.39 40.81 84.86 19.41 41.03 84.16 20.40 2 0 1000.00 -999 ? >ILE^C 82 41.79 78.85 20.42 42.67 77.82 20.89 42.23 78.33 20.65 3 0 1000.00 -999 ? >LEU^C 83 38.79 81.39 15.95 37.78 82.86 17.15 38.28 82.13 16.55 3 0 1000.00 -999 ? >SER.C 84 38.47 77.43 13.92 38.36 75.04 13.58 38.42 76.24 13.75 2 0 1000.00 -999 ? >PRO.C 85 39.43 79.20 9.95 37.67 78.47 11.11 38.55 78.83 10.53 3 0 1000.00 -999 ? >ASP.C 86 34.49 76.57 7.09 32.84 76.31 8.33 33.67 76.44 7.71 2 0 1000.00 -999 ? >ALA^C 87 38.94 76.78 5.83 38.56 76.61 4.36 38.75 76.69 5.09 2 0 1000.00 -999 ? >ALA^C 88 42.10 78.86 5.94 42.51 79.02 7.40 42.31 78.94 6.67 2 0 1000.00 -999 ? >PHE^C 89 46.31 80.61 1.88 48.73 80.88 0.48 47.52 80.74 1.18 3 0 1000.00 -999 ? >VAL^C 90 48.56 80.33 5.59 48.97 79.76 7.65 48.76 80.05 6.62 3 0 1000.00 -999 ? >GLU^C 91 52.44 83.60 2.30 51.58 85.51 1.95 52.01 84.55 2.12 2 0 1000.00 -999 ? >ARG~C 92 54.68 76.09 2.00 53.75 73.30 2.85 54.21 74.70 2.42 2 0 1000.00 -999 ? >GLY~C 93 57.06 81.02 5.07 56.31 80.81 5.35 56.69 80.92 5.21 1 0 1000.00 -999 ? >ALA~C 94 54.88 81.75 8.09 53.50 82.43 8.08 54.19 82.09 8.08 2 0 1000.00 -999 ? >TRP~C 95 53.32 74.76 7.24 50.85 74.54 10.30 52.08 74.65 8.77 3 0 1000.00 -999 ? >GLU~C 96 57.70 76.21 6.07 58.97 75.65 4.54 58.34 75.93 5.31 2 0 1000.00 -999 ? >ALA~C 97 58.76 79.56 10.81 58.45 81.05 10.65 58.61 80.30 10.73 2 0 1000.00 -999 ? >LEU~C 98 55.22 77.41 13.33 53.63 78.83 13.58 54.42 78.12 13.45 3 0 1000.00 -999 ? >SER~C 99 57.77 74.99 15.78 56.66 74.55 17.88 57.22 74.77 16.83 2 0 1000.00 -999 ? >GLU~C 100 57.06 68.88 14.75 56.25 68.95 12.79 56.65 68.92 13.77 2 0 1000.00 -999 ? >ALA~C 101 54.63 71.46 18.23 55.15 71.75 19.63 54.89 71.60 18.93 2 0 1000.00 -999 ? >GLU~C 102 54.52 76.29 18.13 55.44 78.15 18.01 54.98 77.22 18.07 2 0 1000.00 -999 ? >ARG~C 103 54.66 73.21 10.88 57.54 73.41 11.83 56.10 73.31 11.35 2 0 1000.00 -999 ? >GLU~C 104 52.28 68.26 15.09 53.58 66.72 15.80 52.93 67.49 15.44 2 0 1000.00 -999 ? >GLY~C 105 48.28 71.93 18.01 48.39 72.30 17.30 48.34 72.11 17.65 1 0 1000.00 -999 ? >PHE.C 106 44.70 74.96 19.29 42.69 73.28 20.31 43.70 74.12 19.80 3 0 1000.00 -999 ? >PRO.C 107 48.41 75.64 13.67 48.52 76.74 15.60 48.46 76.19 14.64 3 0 1000.00 -999 ? >PRO.C 108 52.03 79.61 17.48 49.98 79.87 16.64 51.01 79.74 17.06 3 0 1000.00 -999 ? >LEU.C 109 50.33 82.31 12.74 50.17 80.77 11.23 50.25 81.54 11.98 3 0 1000.00 -999 ? >ALA.C 110 46.58 84.54 12.03 46.31 86.02 12.18 46.45 85.28 12.10 2 0 1000.00 -999 ? >PRO.C 111 44.70 81.30 9.82 45.90 83.11 9.34 45.30 82.21 9.58 3 0 1000.00 -999 ? >LYS.C 112 46.26 85.30 5.70 48.70 87.24 0.32 47.48 86.27 3.01 2 0 1000.00 -999 ? >ALA^C 113 42.74 84.31 4.78 42.60 84.13 3.26 42.67 84.22 4.02 2 0 1000.00 -999 ? >VAL^C 114 39.92 82.50 6.60 40.08 83.39 8.61 40.00 82.95 7.60 3 0 1000.00 -999 ? >PHE^C 115 37.40 80.74 3.02 38.92 81.74 0.89 38.16 81.24 1.96 3 0 1000.00 -999 ? >GLU^C 116 34.16 81.91 9.55 34.19 80.34 11.01 34.17 81.12 10.28 2 0 1000.00 -999 ? >VAL^C 117 30.25 79.02 5.99 30.26 77.50 4.38 30.26 78.26 5.19 3 0 1000.00 -999 ? >ARG.C 118 23.84 81.99 7.71 20.96 82.89 8.14 22.40 82.44 7.92 2 0 1000.00 -999 ? >SER.C 119 25.36 76.83 9.19 26.01 76.36 11.48 25.69 76.59 10.34 2 0 1000.00 -999 ? >ALA.C 120 21.59 76.77 9.95 20.69 75.53 9.78 21.14 76.15 9.86 2 0 1000.00 -999 ? >SER.C 121 21.96 77.62 13.65 23.61 76.12 14.64 22.78 76.87 14.15 2 0 1000.00 -999 ? >GLN.C 122 26.55 79.39 13.07 28.32 79.02 11.91 27.44 79.21 12.49 2 0 1000.00 -999 ? >ASP~C 123 22.72 85.01 14.32 22.17 86.98 13.81 22.45 86.00 14.06 2 0 1000.00 -999 ? >PRO~C 124 22.42 85.76 9.05 24.03 85.84 10.61 23.22 85.80 9.83 3 0 1000.00 -999 ? >GLU~C 125 23.49 90.92 12.47 24.77 92.03 11.18 24.13 91.48 11.82 2 0 1000.00 -999 ? >GLU~C 126 25.70 86.11 16.87 24.79 84.48 17.88 25.24 85.29 17.37 2 0 1000.00 -999 ? >LEU~C 127 28.78 84.76 10.86 28.88 82.61 10.64 28.83 83.69 10.75 3 0 1000.00 -999 ? >ARG~C 128 27.44 90.91 8.67 24.77 90.67 7.24 26.11 90.79 7.95 2 0 1000.00 -999 ? >ALA~C 129 31.18 89.99 14.40 30.34 89.92 15.72 30.76 89.95 15.06 2 0 1000.00 -999 ? >LYS~C 130 33.40 86.89 14.30 34.26 80.57 14.09 33.83 83.73 14.19 2 0 1000.00 -999 ? >MET~C 131 34.93 88.16 11.05 34.03 85.80 9.06 34.48 86.98 10.05 2 0 1000.00 -999 ? >GLY~C 132 35.61 91.34 13.02 35.86 90.54 13.18 35.74 90.94 13.10 1 0 1000.00 -999 ? >ILE~C 133 36.97 88.19 16.43 36.71 87.66 17.75 36.84 87.93 17.09 3 0 1000.00 -999 ? >TYR~C 134 38.62 85.47 11.84 37.78 82.82 12.19 38.20 84.15 12.01 3 0 1000.00 -999 ? >LEU~C 135 39.71 91.92 10.50 38.97 91.35 8.50 39.34 91.63 9.50 3 0 1000.00 -999 ? >ARG~C 136 39.06 92.48 17.48 37.07 91.74 19.67 38.06 92.11 18.57 2 0 1000.00 -999 ? >ASN~C 137 43.23 88.38 15.71 42.61 88.53 17.74 42.92 88.46 16.73 2 0 1000.00 -999 ? >GLY.C 138 45.65 90.04 11.86 44.98 89.78 11.75 45.32 89.91 11.81 1 0 1000.00 -999 ? >VAL.C 139 43.71 88.08 9.24 42.23 86.48 9.26 42.97 87.28 9.25 3 0 1000.00 -999 ? >LEU.C 140 45.32 89.84 5.09 47.10 90.90 5.73 46.21 90.37 5.41 3 0 1000.00 -999 ? >LEU^C 141 41.39 87.96 2.82 40.15 87.74 1.04 40.77 87.85 1.93 3 0 1000.00 -999 ? >GLY^C 142 37.82 87.14 5.77 37.76 87.48 4.97 37.79 87.31 5.37 1 0 1000.00 -999 ? >VAL^C 143 35.18 85.46 3.60 35.59 84.86 1.54 35.39 85.16 2.57 3 0 1000.00 -999 ? >LEU^C 144 31.09 85.68 5.71 29.81 85.26 7.40 30.45 85.47 6.56 3 0 1000.00 -999 ? >VAL^C 145 29.51 82.28 2.73 30.19 80.88 1.16 29.85 81.58 1.94 3 0 1000.00 -999 ? >ASP^C 146 24.97 83.41 3.62 23.19 83.08 4.70 24.08 83.25 4.16 2 0 1000.00 -999 ? >PRO.C 147 24.83 77.78 3.35 24.57 79.54 2.02 24.70 78.66 2.68 3 0 1000.00 -999 ? >TYR.C 148 20.96 78.95 4.97 22.25 76.83 6.26 21.60 77.89 5.62 3 0 1000.00 -999 ? >ALA.C 149 20.67 83.56 1.35 21.06 84.77 2.17 20.87 84.17 1.76 2 0 1000.00 -999 ? >ARG.C 150 21.43 79.76 -3.56 20.09 77.08 -4.26 20.76 78.42 -3.91 2 0 1000.00 -999 ? >ALA^C 151 25.40 85.38 -0.69 24.69 86.49 0.09 25.04 85.93 -0.30 2 0 1000.00 -999 ? >VAL^C 152 29.04 86.06 0.10 30.78 85.95 -1.25 29.91 86.00 -0.58 3 0 1000.00 -999 ? >GLU^C 153 28.44 89.41 3.36 27.43 90.08 5.10 27.93 89.75 4.23 2 0 1000.00 -999 ? >VAL^C 154 34.24 89.81 2.03 35.26 89.65 0.13 34.75 89.73 1.08 3 0 1000.00 -999 ? >PHE^C 155 34.31 90.75 6.59 31.56 90.46 7.07 32.93 90.61 6.83 3 0 1000.00 -999 ? >ARG.C 156 40.28 93.44 0.79 39.19 91.76 -1.54 39.74 92.60 -0.37 2 0 1000.00 -999 ? >PRO.C 157 43.09 94.33 6.72 40.91 94.84 6.83 42.00 94.58 6.77 3 0 1000.00 -999 ? >GLY.C 158 40.23 99.05 7.20 39.85 98.50 6.79 40.04 98.78 7.00 1 0 1000.00 -999 ? >LYS.C 159 37.71 98.57 4.42 42.30 97.91 1.67 40.00 98.24 3.05 2 0 1000.00 -999 ? >PRO.C 160 33.93 99.67 2.46 34.60 98.51 4.24 34.26 99.09 3.35 3 0 1000.00 -999 ? >PRO.C 161 32.11 95.13 6.55 32.69 95.42 4.43 32.40 95.28 5.49 3 0 1000.00 -999 ? >LEU^C 162 32.16 93.56 -0.36 33.93 94.69 -0.71 33.04 94.13 -0.54 3 0 1000.00 -999 ? >ARG^C 163 24.59 91.12 1.60 23.22 88.58 2.69 23.90 89.85 2.14 2 0 1000.00 -999 ? >LEU^C 164 28.93 89.39 -3.91 30.43 90.70 -4.71 29.68 90.05 -4.31 3 0 1000.00 -999 ? >GLU^C 165 23.22 88.65 -2.25 21.46 89.53 -1.49 22.34 89.09 -1.87 2 0 1000.00 -999 ? >GLY.C 166 23.54 86.37 -7.54 24.32 86.42 -7.23 23.93 86.39 -7.39 1 0 1000.00 -999 ? >VAL.C 167 27.20 85.75 -8.28 29.08 86.37 -7.39 28.14 86.06 -7.83 3 0 1000.00 -999 ? >GLU.C 168 27.04 81.71 -11.06 26.87 80.68 -12.89 26.96 81.19 -11.97 2 0 1000.00 -999 ? >ARG^C 169 33.30 81.26 -11.72 36.04 81.02 -13.05 34.67 81.14 -12.38 2 0 1000.00 -999 ? >VAL^C 170 34.16 85.67 -6.46 33.28 86.49 -4.64 33.72 86.08 -5.55 3 0 1000.00 -999 ? >SER^C 171 37.74 86.61 -7.27 39.51 87.97 -8.19 38.63 87.29 -7.73 2 0 1000.00 -999 ? >LEU.C 172 39.82 85.71 -3.24 37.98 85.54 -2.12 38.90 85.63 -2.68 3 0 1000.00 -999 ? >ASP.C 173 43.10 89.12 -7.10 43.48 87.49 -8.36 43.29 88.31 -7.73 2 0 1000.00 -999 ? >PRO.C 174 45.11 92.29 -3.35 44.44 90.38 -4.35 44.78 91.34 -3.85 3 0 1000.00 -999 ? >GLU.C 175 44.16 89.51 0.65 42.97 90.95 -0.36 43.56 90.23 0.15 2 0 1000.00 -999 ? >LEU.C 176 43.65 83.94 -2.53 43.35 83.20 -0.51 43.50 83.57 -1.52 3 0 1000.00 -999 ? >PRO.C 177 48.40 85.08 -5.35 46.22 85.35 -5.68 47.31 85.21 -5.51 3 0 1000.00 -999 ? >GLY.C 178 44.50 83.58 -9.11 44.16 83.68 -8.38 44.33 83.63 -8.75 1 0 1000.00 -999 ? >PHE.C 179 41.04 81.06 -4.66 39.02 79.45 -3.55 40.03 80.26 -4.10 3 0 1000.00 -999 ? >ALA^C 180 38.23 82.52 -7.57 37.86 82.63 -9.05 38.04 82.57 -8.31 2 0 1000.00 -999 ? >LEU^C 181 35.49 81.38 -3.79 34.71 80.37 -2.06 35.10 80.88 -2.93 3 0 1000.00 -999 ? >SER^C 182 32.98 78.97 -6.94 32.01 77.31 -8.43 32.50 78.14 -7.68 2 0 1000.00 -999 ? >LEU.C 183 28.92 80.64 -4.98 29.76 82.38 -4.02 29.34 81.51 -4.50 3 0 1000.00 -999 ? >PRO~C 184 27.17 78.08 -8.57 27.57 77.40 -6.47 27.37 77.74 -7.52 3 0 1000.00 -999 ? >PRO~C 185 30.67 74.28 -6.93 28.91 74.48 -5.60 29.79 74.38 -6.26 3 0 1000.00 -999 ? >LEU~C 186 29.40 76.52 -1.24 31.48 76.65 -0.66 30.44 76.59 -0.95 3 0 1000.00 -999 ? >TRP~C 187 24.14 77.88 -5.00 25.89 80.57 -2.71 25.01 79.22 -3.86 3 0 1000.00 -999 ?