REMARK SOURCE hebe.pdb HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 28-JAN-05 1YOX COMPND HYPOTHETICAL PROTEIN PA3696; COMPND 3 CHAIN: A, B, C, D, E, F; COMPND 4 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA; SOURCE 3 ORGANISM_TAXID: 208964; SOURCE 4 STRAIN: PAO1; SOURCE 5 GENE: PA3696; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3); SOURCE 7 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3); SOURCE 9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 10 EXPRESSION_SYSTEM_PLASMID: PET28-LIC AUTHOR J.R.WALKER,X.XU,J.GU,A.JOACHIMIAK,A.EDWARDS,A.SAVCHENKO,MIDWEST AUTHOR 2 CENTER FOR STRUCTURAL GENOMICS (MCSG) HET MSE A 15 8 HET MSE A 35 8 HET MSE A 38 8 HET MSE A 75 8 HET MSE B 15 8 HET MSE B 35 8 HET MSE B 38 8 HET MSE B 75 8 HET MSE C 15 8 HET MSE C 35 8 HET MSE C 38 8 HET MSE C 75 8 HET MSE D 15 8 HET MSE D 35 8 HET MSE D 38 8 HET MSE D 75 8 HET MSE D 200 8 HET MSE E 15 8 HET MSE E 35 8 HET MSE E 38 8 HET MSE E 48 8 HET MSE E 75 8 HET MSE F 15 8 HET MSE F 35 8 HET MSE F 38 8 HET MSE F 75 8 >GLU.A 5 33.44 106.36 50.95 34.49 108.20 50.62 33.97 107.28 50.79 2 0 1000.00 -999 ? >LEU.A 6 34.69 103.03 54.79 36.50 103.48 53.66 35.59 103.25 54.22 3 0 1000.00 -999 ? >ASP^A 7 31.47 98.27 54.75 29.78 98.88 53.59 30.62 98.57 54.17 2 0 1000.00 -999 ? >TYR^A 8 33.48 99.87 60.24 31.59 100.93 61.96 32.54 100.40 61.10 3 0 1000.00 -999 ? >ARG^A 9 32.57 91.83 61.49 30.92 91.45 58.92 31.75 91.64 60.21 2 0 1000.00 -999 ? >ILE^A 10 34.87 97.19 65.74 34.98 98.44 66.33 34.93 97.82 66.04 3 0 1000.00 -999 ? >LEU^A 11 37.80 92.02 65.10 37.40 91.37 63.07 37.60 91.69 64.09 3 0 1000.00 -999 ? >GLY.A 12 37.59 91.87 69.61 36.89 92.22 69.44 37.24 92.05 69.53 1 0 1000.00 -999 ? >GLU.A 13 36.90 90.43 74.27 37.20 88.79 72.89 37.05 89.61 73.58 2 0 1000.00 -999 ? >SER.A 14 38.23 94.74 75.18 37.44 94.20 77.43 37.83 94.47 76.31 2 0 1000.00 -999 ? >MET?A 15 41.19 94.89 72.82 44.60 93.39 74.87 42.89 94.14 73.84 2 0 1000.00 -999 ? >GLN.A 16 37.78 96.26 70.23 36.11 97.55 70.47 36.94 96.90 70.35 2 0 1000.00 -999 ? >THR^A 17 41.20 95.90 65.72 41.88 94.29 64.43 41.54 95.10 65.07 2 0 1000.00 -999 ? >VAL^A 18 39.16 97.50 62.95 38.83 99.60 62.30 39.00 98.55 62.63 3 0 1000.00 -999 ? >GLU^A 19 38.47 93.46 58.30 37.59 91.54 58.29 38.03 92.50 58.29 2 0 1000.00 -999 ? >ILE^A 20 38.93 99.34 56.55 38.07 100.52 56.76 38.50 99.93 56.66 3 0 1000.00 -999 ? >GLU^A 21 34.04 95.42 52.98 32.01 95.78 52.46 33.03 95.60 52.72 2 0 1000.00 -999 ? >LEU^A 22 38.89 98.81 50.65 39.97 100.50 51.60 39.43 99.65 51.12 3 0 1000.00 -999 ? >ASP.A 23 33.90 98.53 47.39 32.44 97.16 48.05 33.17 97.85 47.72 2 0 1000.00 -999 ? >PRO.A 24 36.23 96.50 43.54 36.72 98.30 44.78 36.48 97.40 44.16 3 0 1000.00 -999 ? >GLY.A 25 37.94 102.27 44.03 38.16 101.88 44.72 38.05 102.08 44.37 1 0 1000.00 -999 ? >GLU.A 26 35.43 102.53 48.37 34.09 101.27 49.46 34.76 101.90 48.91 2 0 1000.00 -999 ? >THR^A 27 40.94 104.25 49.76 42.57 105.51 48.93 41.75 104.88 49.34 2 0 1000.00 -999 ? >VAL^A 28 41.52 104.38 53.57 41.43 102.72 55.09 41.47 103.55 54.33 3 0 1000.00 -999 ? >ILE^A 29 44.21 108.05 55.20 43.81 109.31 55.02 44.01 108.68 55.11 3 0 1000.00 -999 ? >ALA^A 30 46.18 105.51 58.49 46.03 103.99 58.60 46.11 104.75 58.54 2 0 1000.00 -999 ? >GLU.A 31 48.43 105.72 62.80 49.10 105.41 64.83 48.76 105.56 63.81 2 0 1000.00 -999 ? >ALA.A 32 52.42 104.19 59.31 53.79 104.79 58.98 53.10 104.49 59.15 2 0 1000.00 -999 ? >GLY.A 33 52.63 100.81 61.03 51.94 101.14 60.95 52.28 100.97 60.99 1 0 1000.00 -999 ? >ALA.A 34 48.99 100.51 62.18 47.99 101.64 62.22 48.49 101.07 62.20 2 0 1000.00 -999 ? >MET?A 35 48.13 97.89 59.55 49.05 95.47 56.97 48.59 96.68 58.26 2 0 1000.00 -999 ? >ASN.A 36 46.64 93.75 61.54 46.70 94.70 63.44 46.67 94.22 62.49 2 0 1000.00 -999 ? >TYR.A 37 44.85 91.15 58.21 42.22 91.22 59.16 43.54 91.19 58.69 3 0 1000.00 -999 ? >MET?A 38 45.82 93.08 53.68 48.60 96.02 52.38 47.21 94.55 53.03 2 0 1000.00 -999 ? >THR.A 39 43.68 90.81 51.52 41.63 90.87 52.30 42.66 90.84 51.91 2 0 1000.00 -999 ? >GLY.A 40 44.86 90.17 47.95 44.96 90.84 48.26 44.91 90.51 48.10 1 0 1000.00 -999 ? >ASP.A 41 43.12 93.25 44.80 43.69 92.62 42.85 43.40 92.94 43.83 2 0 1000.00 -999 ? >ILE^A 42 44.65 96.02 49.88 43.47 96.97 50.18 44.06 96.49 50.03 3 0 1000.00 -999 ? >ARG^A 43 49.45 96.39 45.41 47.60 93.97 44.76 48.52 95.18 45.08 2 0 1000.00 -999 ? >PHE^A 44 51.26 99.68 51.23 53.76 98.42 51.36 52.51 99.05 51.29 3 0 1000.00 -999 ? >THR^A 45 51.55 104.06 49.28 50.58 105.48 47.90 51.07 104.77 48.59 2 0 1000.00 -999 ? >ALA.A 46 53.32 106.59 51.52 54.81 106.54 51.84 54.07 106.57 51.68 2 0 1000.00 -999 ? >ARG.A 47 52.06 113.10 53.26 49.91 113.83 55.36 50.98 113.47 54.31 2 0 1000.00 -999 ? >MET?A 75 49.91 109.37 56.55 47.10 110.14 58.03 48.51 109.75 57.29 2 0 1000.00 -999 ? >THR^A 76 49.83 106.14 54.47 51.32 104.60 54.91 50.58 105.37 54.69 2 0 1000.00 -999 ? >HIS^A 77 47.06 107.80 51.31 47.57 109.74 51.93 47.31 108.77 51.62 3 0 1000.00 -999 ? >PHE^A 78 46.44 100.89 53.53 48.58 100.63 55.29 47.51 100.76 54.41 3 0 1000.00 -999 ? >THR^A 79 43.48 101.38 48.20 43.39 103.15 46.91 43.44 102.26 47.56 2 0 1000.00 -999 ? >ASN^A 80 40.16 98.08 46.87 39.69 96.14 46.08 39.92 97.11 46.48 2 0 1000.00 -999 ? >GLU.A 81 45.64 99.32 42.60 45.16 101.11 43.63 45.40 100.21 43.11 2 0 1000.00 -999 ? >GLY.A 82 41.50 95.06 42.09 41.05 95.63 42.46 41.27 95.35 42.27 1 0 1000.00 -999 ? >GLN.A 83 38.66 92.36 39.74 37.66 90.82 38.62 38.16 91.59 39.18 2 0 1000.00 -999 ? >GLY.A 84 36.66 92.21 44.95 36.78 93.08 45.04 36.72 92.65 45.00 1 0 1000.00 -999 ? >LYS.A 85 35.13 93.25 48.26 32.48 89.30 45.51 33.80 91.28 46.88 2 0 1000.00 -999 ? >GLN^A 86 39.67 93.32 47.90 39.91 91.22 48.12 39.79 92.27 48.01 2 0 1000.00 -999 ? >HIS^A 87 38.21 92.11 54.14 36.31 91.32 53.72 37.26 91.71 53.93 3 0 1000.00 -999 ? >VAL^A 88 42.59 95.94 55.52 43.69 97.32 54.21 43.14 96.63 54.87 3 0 1000.00 -999 ? >ALA^A 89 42.80 95.78 59.34 42.71 94.46 60.06 42.76 95.12 59.70 2 0 1000.00 -999 ? >PHE^A 90 44.35 100.10 59.78 44.92 100.48 57.05 44.63 100.29 58.41 3 0 1000.00 -999 ? >ALA.A 91 45.02 98.50 65.39 45.13 97.08 65.91 45.07 97.79 65.65 2 0 1000.00 -999 ? >ALA.A 92 46.84 100.83 67.79 46.13 101.69 68.81 46.49 101.26 68.30 2 0 1000.00 -999 ? >PRO.A 93 50.84 102.14 68.77 49.64 100.29 69.04 50.24 101.22 68.90 3 0 1000.00 -999 ? >TYR.A 94 48.51 102.27 73.17 47.22 104.59 72.23 47.86 103.43 72.70 3 0 1000.00 -999 ? >PRO.A 95 47.29 97.51 76.31 46.55 98.16 74.30 46.92 97.83 75.31 3 0 1000.00 -999 ? >GLY^A 96 42.34 99.14 74.16 42.46 98.68 73.52 42.40 98.91 73.84 1 0 1000.00 -999 ? >SER^A 97 39.22 99.70 72.14 37.50 100.85 73.45 38.36 100.27 72.79 2 0 1000.00 -999 ? >VAL^A 98 38.43 101.35 68.81 39.51 101.00 66.97 38.97 101.17 67.89 3 0 1000.00 -999 ? >VAL^A 99 35.53 103.78 68.40 34.85 104.93 70.15 35.19 104.35 69.27 3 0 1000.00 -999 ? >ALA^A 100 33.90 104.36 65.00 33.16 103.27 64.23 33.53 103.81 64.61 2 0 1000.00 -999 ? >VAL^A 101 32.73 107.96 64.62 34.08 108.98 66.05 33.41 108.47 65.34 3 0 1000.00 -999 ? >ASP^A 102 29.11 108.39 61.46 28.14 109.00 59.65 28.62 108.70 60.56 2 0 1000.00 -999 ? >LEU.A 103 32.64 113.04 60.04 34.77 112.93 60.56 33.70 112.98 60.30 3 0 1000.00 -999 ? >ASP~A 104 27.32 113.13 58.73 25.84 111.63 59.14 26.58 112.38 58.94 2 0 1000.00 -999 ? >ASP~A 105 27.12 111.18 64.08 26.07 109.62 63.14 26.60 110.40 63.61 2 0 1000.00 -999 ? >VAL~A 106 28.94 115.36 65.01 30.40 113.96 65.94 29.67 114.66 65.47 3 0 1000.00 -999 ? >GLY~A 107 28.73 118.35 62.63 29.25 117.72 62.53 28.99 118.03 62.58 1 0 1000.00 -999 ? >GLY.A 108 31.44 117.05 60.31 31.55 117.33 61.07 31.49 117.19 60.69 1 0 1000.00 -999 ? >ARG^A 109 35.21 121.46 63.75 32.67 122.79 62.57 33.94 122.13 63.16 2 0 1000.00 -999 ? >LEU^A 110 35.74 114.44 65.52 35.73 112.71 66.83 35.73 113.58 66.17 3 0 1000.00 -999 ? >PHE^A 111 38.38 119.43 68.23 37.43 121.85 67.15 37.90 120.64 67.69 3 0 1000.00 -999 ? >CYH^A 112 41.28 114.14 68.77 42.20 112.55 66.66 41.74 113.35 67.71 2 0 1000.00 -999 ? >GLN^A 113 46.23 112.66 72.34 46.42 110.90 73.55 46.32 111.78 72.94 2 0 1000.00 -999 ? >LYS.A 114 47.32 112.54 67.81 52.64 113.47 64.55 49.98 113.01 66.18 2 0 1000.00 -999 ? >ASP.A 115 48.56 109.04 71.00 50.64 109.22 71.34 49.60 109.13 71.17 2 0 1000.00 -999 ? >SER.A 116 44.49 108.17 69.45 43.97 108.79 71.71 44.23 108.48 70.58 2 0 1000.00 -999 ? >PHE^A 117 44.29 109.56 63.44 43.91 109.35 60.67 44.10 109.45 62.05 3 0 1000.00 -999 ? >LEU^A 118 43.00 103.96 64.49 43.81 101.93 64.52 43.41 102.95 64.50 3 0 1000.00 -999 ? >CYH^A 119 42.41 105.64 60.46 41.12 103.12 60.32 41.77 104.38 60.39 2 0 1000.00 -999 ? >ALA^A 120 39.97 107.53 58.23 40.30 109.02 58.37 40.13 108.28 58.30 2 0 1000.00 -999 ? >ALA^A 121 37.78 107.38 55.14 36.29 107.61 55.12 37.04 107.49 55.13 2 0 1000.00 -999 ? >TYR.A 122 40.94 109.05 50.01 42.13 110.62 48.02 41.53 109.83 49.02 3 0 1000.00 -999 ? >GLY.A 123 39.02 112.62 51.86 39.10 112.22 52.62 39.06 112.42 52.24 1 0 1000.00 -999 ? >THR.A 124 39.17 113.61 55.52 38.87 112.40 57.36 39.02 113.01 56.44 2 0 1000.00 -999 ? >ARG.A 125 41.42 120.74 55.93 42.84 123.49 55.67 42.13 122.12 55.80 2 0 1000.00 -999 ? >VAL.A 126 43.50 116.47 59.25 44.74 114.76 58.56 44.12 115.61 58.90 3 0 1000.00 -999 ? >GLY.A 127 46.03 119.00 60.59 45.62 118.50 61.08 45.83 118.75 60.84 1 0 1000.00 -999 ? >ILE.A 128 48.04 120.92 64.52 48.85 121.23 64.19 48.44 121.07 64.36 3 0 1000.00 -999 ? >ALA.A 129 44.59 122.61 66.50 43.22 121.97 66.72 43.91 122.29 66.61 2 0 1000.00 -999 ? >GLU.A 142 57.01 114.86 68.56 55.46 116.06 67.70 56.24 115.46 68.13 2 0 1000.00 -999 ? >GLY.A 143 54.43 117.39 73.33 54.25 117.06 72.60 54.34 117.23 72.96 1 0 1000.00 -999 ? >PHE.A 144 48.34 116.96 74.50 45.57 116.90 74.03 46.96 116.93 74.27 3 0 1000.00 -999 ? >ILE.A 145 49.77 116.76 68.90 50.52 116.78 67.71 50.14 116.77 68.31 3 0 1000.00 -999 ? >LEU^A 146 44.50 118.89 70.28 42.38 118.57 70.77 43.44 118.73 70.53 3 0 1000.00 -999 ? >GLN^A 147 46.17 115.82 65.24 46.74 114.38 63.78 46.45 115.10 64.51 2 0 1000.00 -999 ? >LYS^A 148 41.13 118.34 64.06 42.14 122.34 62.16 41.64 120.34 63.11 2 0 1000.00 -999 ? >LEU^A 149 39.45 114.47 62.11 41.10 113.25 62.90 40.27 113.86 62.50 3 0 1000.00 -999 ? >GLU^A 150 37.57 119.29 58.67 38.45 120.90 59.69 38.01 120.09 59.18 2 0 1000.00 -999 ? >GLY.A 151 34.53 115.74 56.56 34.08 115.72 57.26 34.31 115.73 56.91 1 0 1000.00 -999 ? >ASP.A 152 31.01 113.73 54.37 32.31 113.03 52.85 31.66 113.38 53.61 2 0 1000.00 -999 ? >GLY.A 153 33.13 110.05 56.20 33.10 110.48 56.87 33.12 110.26 56.54 1 0 1000.00 -999 ? >LEU^A 154 33.92 106.05 58.79 31.80 105.63 59.20 32.86 105.84 58.99 3 0 1000.00 -999 ? >VAL^A 155 36.86 108.25 61.38 37.65 110.00 62.46 37.25 109.13 61.92 3 0 1000.00 -999 ? >PHE^A 156 37.79 104.00 62.09 35.74 103.19 60.37 36.76 103.59 61.23 3 0 1000.00 -999 ? >VAL^A 157 39.90 106.45 67.13 38.77 108.28 67.63 39.33 107.36 67.38 3 0 1000.00 -999 ? >HIS^A 158 43.39 102.65 70.44 44.02 101.14 71.75 43.70 101.89 71.10 3 0 1000.00 -999 ? >ALA^A 159 41.05 104.58 73.52 39.67 104.75 74.08 40.36 104.66 73.80 2 0 1000.00 -999 ? >GLY^A 160 43.83 102.97 75.60 43.07 103.23 75.84 43.45 103.10 75.72 1 0 1000.00 -999 ? >GLY.A 161 42.62 100.80 78.49 42.20 101.06 77.86 42.41 100.93 78.17 1 0 1000.00 -999 ? >THR.A 162 38.98 101.58 79.39 37.88 101.48 81.32 38.43 101.53 80.36 2 0 1000.00 -999 ? >LEU^A 163 36.19 103.10 75.67 35.18 104.45 74.27 35.68 103.77 74.97 3 0 1000.00 -999 ? >ILE^A 164 35.63 106.86 80.15 35.99 106.76 81.45 35.81 106.81 80.80 3 0 1000.00 -999 ? >ARG^A 165 30.27 109.11 74.40 28.32 109.18 72.00 29.29 109.15 73.20 2 0 1000.00 -999 ? >ARG^A 166 32.31 111.63 82.12 30.98 112.65 84.69 31.64 112.14 83.40 2 0 1000.00 -999 ? >GLN^A 167 26.08 112.17 76.65 26.44 112.52 74.57 26.26 112.34 75.61 2 0 1000.00 -999 ? >LEU^A 168 29.90 117.86 78.71 31.66 117.31 79.88 30.78 117.59 79.30 3 0 1000.00 -999 ? >ASN^A 169 24.32 119.24 79.90 23.65 117.68 78.60 23.99 118.46 79.25 2 0 1000.00 -999 ? >GLY^A 170 27.16 123.10 80.92 27.45 122.32 81.03 27.31 122.71 80.97 1 0 1000.00 -999 ? >GLU^A 171 27.89 118.69 82.53 27.36 116.68 82.96 27.62 117.68 82.74 2 0 1000.00 -999 ? >THR^A 172 32.68 121.19 83.90 33.94 122.90 84.38 33.31 122.04 84.14 2 0 1000.00 -999 ? >LEU^A 173 34.51 117.06 82.68 34.63 114.85 82.67 34.57 115.96 82.68 3 0 1000.00 -999 ? >ARG^A 174 39.35 120.85 87.12 37.15 122.82 87.95 38.25 121.84 87.53 2 0 1000.00 -999 ? >VAL^A 175 40.75 115.44 82.92 39.81 114.81 81.00 40.28 115.12 81.96 3 0 1000.00 -999 ? >ASP^A 176 44.77 112.88 83.57 46.81 112.48 83.11 45.79 112.68 83.34 2 0 1000.00 -999 ? >THR.A 177 45.43 115.65 79.73 47.11 116.81 79.01 46.27 116.23 79.37 2 0 1000.00 -999 ? >GLY.A 178 46.87 112.38 78.32 46.13 112.53 78.63 46.50 112.46 78.48 1 0 1000.00 -999 ? >CYH.A 179 43.51 110.73 79.00 43.94 109.60 81.43 43.72 110.17 80.22 2 0 1000.00 -999 ? >LEU^A 180 41.93 114.42 76.36 40.26 115.70 75.83 41.09 115.06 76.10 3 0 1000.00 -999 ? >VAL^A 181 40.95 110.91 73.38 40.42 108.75 73.24 40.69 109.83 73.31 3 0 1000.00 -999 ? >ALA^A 182 38.53 113.01 71.37 38.04 112.18 70.17 38.28 112.60 70.77 2 0 1000.00 -999 ? >PHE^A 183 37.16 117.44 72.79 39.22 119.26 72.32 38.19 118.35 72.56 3 0 1000.00 -999 ? >THR.A 184 33.21 117.63 69.71 31.31 116.93 70.45 32.26 117.28 70.08 2 0 1000.00 -999 ? >ASP.A 185 31.99 122.01 68.05 33.58 122.17 66.70 32.79 122.09 67.38 2 0 1000.00 -999 ? >GLY.A 186 30.48 123.07 72.14 31.27 122.76 72.27 30.87 122.92 72.20 1 0 1000.00 -999 ? >ILE^A 187 33.65 120.59 74.50 33.69 119.32 74.89 33.67 119.96 74.70 3 0 1000.00 -999 ? >ASP^A 188 35.09 126.03 76.57 33.65 127.17 75.49 34.37 126.60 76.03 2 0 1000.00 -999 ? >TYR.A 189 40.03 122.39 74.43 41.22 123.04 71.99 40.62 122.71 73.21 3 0 1000.00 -999 ? >ASP.A 190 41.18 125.62 79.63 42.65 126.84 80.59 41.92 126.23 80.11 2 0 1000.00 -999 ? >VAL^A 191 45.11 122.89 79.30 46.29 121.52 78.03 45.70 122.20 78.67 3 0 1000.00 -999 ? >GLN^A 192 44.92 125.57 83.24 45.79 127.41 83.92 45.36 126.49 83.58 2 0 1000.00 -999 ? >LEU^A 193 50.90 123.29 84.42 52.77 122.12 84.42 51.84 122.70 84.42 3 0 1000.00 -999 ? >ALA.A 194 50.43 122.09 88.72 50.36 120.67 89.29 50.40 121.38 89.01 2 0 1000.00 -999 ? >GLY.A 195 53.96 122.55 90.21 53.31 122.92 90.50 53.63 122.73 90.36 1 0 1000.00 -999 ? >LEU.A 207 51.21 117.39 87.54 53.40 117.43 87.40 52.30 117.41 87.47 3 0 1000.00 -999 ? >LEU^A 208 49.71 118.57 81.95 51.29 119.57 80.82 50.50 119.07 81.38 3 0 1000.00 -999 ? >LEU^A 209 44.76 119.67 84.93 45.30 118.91 86.93 45.03 119.29 85.93 3 0 1000.00 -999 ? >THR^A 210 42.72 119.81 80.93 42.93 119.21 78.87 42.82 119.51 79.90 2 0 1000.00 -999 ? >THR^A 211 39.52 121.58 81.93 39.43 123.07 83.50 39.47 122.32 82.71 2 0 1000.00 -999 ? >LEU^A 212 36.28 119.54 79.22 37.67 118.34 78.02 36.98 118.94 78.62 3 0 1000.00 -999 ? >LYS^A 213 33.09 122.80 79.88 37.85 126.39 81.06 35.47 124.59 80.47 2 0 1000.00 -999 ? >GLY^A 214 29.97 123.03 77.71 29.93 122.35 78.17 29.95 122.69 77.94 1 0 1000.00 -999 ? >SER^A 215 27.42 120.81 76.00 25.15 121.45 76.65 26.28 121.13 76.32 2 0 1000.00 -999 ? >GLY^A 216 28.79 118.01 73.83 28.73 117.74 74.59 28.76 117.88 74.21 1 0 1000.00 -999 ? >THR^A 217 30.67 114.71 73.80 29.79 112.98 72.82 30.23 113.84 73.31 2 0 1000.00 -999 ? >VAL^A 218 34.07 113.77 75.26 34.40 115.01 77.07 34.23 114.39 76.16 3 0 1000.00 -999 ? >TRP^A 219 34.73 111.72 71.95 32.15 108.98 70.82 33.44 110.35 71.39 3 0 1000.00 -999 ? >LEU^A 220 38.04 109.88 78.90 37.67 111.87 79.65 37.85 110.88 79.27 3 0 1000.00 -999 ? >GLN^A 221 43.02 107.40 77.02 44.23 107.45 75.28 43.62 107.43 76.15 2 0 1000.00 -999 ? >SER.A 222 41.97 105.16 81.26 41.78 102.79 81.40 41.88 103.98 81.33 2 0 1000.00 -999 ? >LEU.A 223 45.62 102.56 79.99 47.54 101.59 80.51 46.58 102.08 80.25 3 0 1000.00 -999 ? >PRO~A 224 46.87 108.23 79.32 46.70 106.30 78.13 46.78 107.26 78.73 3 0 1000.00 -999 ? >PHE~A 225 51.68 105.04 73.72 54.31 104.37 72.99 52.99 104.71 73.36 3 0 1000.00 -999 ? >SER~A 226 52.21 108.02 77.35 50.65 109.92 77.63 51.43 108.97 77.49 2 0 1000.00 -999 ? >ARG~A 227 48.53 106.31 83.48 46.19 107.92 84.68 47.36 107.11 84.08 2 0 1000.00 -999 ? >LEU~A 228 51.31 102.43 78.78 52.00 100.33 78.65 51.65 101.38 78.71 3 0 1000.00 -999 ? >ALA~A 229 55.43 103.85 78.13 55.58 104.63 76.83 55.51 104.24 77.48 2 0 1000.00 -999 ? >GLY~A 230 56.65 106.27 80.85 56.35 105.51 80.96 56.50 105.89 80.90 1 0 1000.00 -999 ? >ARG~A 231 54.46 104.86 86.39 56.83 103.50 87.87 55.64 104.18 87.13 2 0 1000.00 -999 ? >ILE~A 232 57.28 100.57 80.35 57.04 99.17 80.30 57.16 99.87 80.33 3 0 1000.00 -999 ? >TYR~A 233 62.22 104.94 80.69 64.85 105.91 80.42 63.53 105.43 80.56 3 0 1000.00 -999 ? >ASP~A 234 59.41 104.80 85.89 59.11 106.81 85.31 59.26 105.80 85.60 2 0 1000.00 -999 ? >ALA~A 235 60.24 100.49 86.27 59.05 99.61 85.94 59.64 100.05 86.11 2 0 1000.00 -999 ? >THR~A 236 63.39 99.54 84.38 63.04 100.09 82.28 63.22 99.82 83.33 2 0 1000.00 -999 ? >PHE~A 237 66.17 103.31 88.58 68.25 104.63 89.98 67.21 103.97 89.28 3 0 1000.00 -999 ? >ARG~A 238 66.95 95.64 90.45 66.44 94.96 93.43 66.70 95.30 91.94 2 0 1000.00 -999 ? >ALA~A 239 68.60 97.04 85.39 67.62 96.36 84.44 68.11 96.70 84.92 2 0 1000.00 -999 ? >ARG~A 240 66.84 102.75 82.88 64.39 103.97 84.28 65.61 103.36 83.58 2 0 1000.00 -999 ? >GLU~A 241 71.42 101.25 89.64 70.85 99.30 90.32 71.14 100.27 89.98 2 0 1000.00 -999 ? >GLU~A 242 73.74 95.76 86.75 72.70 93.97 86.35 73.22 94.86 86.55 2 0 1000.00 -999 ? >VAL.A 243 76.14 100.22 84.95 75.26 100.81 82.99 75.70 100.51 83.97 3 0 1000.00 -999 ? >ARG.A 244 77.87 107.00 86.88 76.61 108.85 84.73 77.24 107.93 85.80 2 0 1000.00 -999 ? >ALA.B 2 36.57 105.30 110.91 35.07 105.48 111.21 35.82 105.39 111.06 2 0 1000.00 -999 ? >SER.B 3 37.28 105.83 107.22 39.01 104.19 106.88 38.15 105.01 107.05 2 0 1000.00 -999 ? >HIS.B 4 36.06 110.02 104.49 36.94 111.80 105.17 36.50 110.91 104.83 3 0 1000.00 -999 ? >GLU.B 5 31.11 104.20 105.22 29.40 104.34 106.52 30.25 104.27 105.87 2 0 1000.00 -999 ? >LEU.B 6 34.35 105.51 98.84 36.35 106.44 99.22 35.35 105.98 99.03 3 0 1000.00 -999 ? >ASP^B 7 29.27 105.18 96.56 28.03 105.21 98.26 28.65 105.19 97.41 2 0 1000.00 -999 ? >TYR^B 8 33.13 101.32 94.15 32.76 98.65 94.91 32.94 99.99 94.53 3 0 1000.00 -999 ? >ARG^B 9 29.23 104.18 87.85 29.44 105.65 85.13 29.33 104.92 86.49 2 0 1000.00 -999 ? >ILE^B 10 34.45 98.41 88.69 35.36 97.51 89.22 34.91 97.96 88.95 3 0 1000.00 -999 ? >LEU^B 11 34.22 102.22 84.14 33.30 104.13 84.55 33.76 103.17 84.35 3 0 1000.00 -999 ? >GLY.B 12 34.97 98.54 81.65 34.51 98.18 82.27 34.74 98.36 81.96 1 0 1000.00 -999 ? >GLU.B 13 33.85 95.09 78.90 32.24 95.81 80.04 33.05 95.45 79.47 2 0 1000.00 -999 ? >SER.B 14 38.80 93.40 80.93 38.53 91.46 79.50 38.66 92.43 80.21 2 0 1000.00 -999 ? >MET?B 15 40.54 96.77 81.26 43.13 97.17 77.85 41.83 96.97 79.55 2 0 1000.00 -999 ? >GLN.B 16 37.61 96.39 84.63 36.76 95.05 86.02 37.18 95.72 85.32 2 0 1000.00 -999 ? >THR^B 17 38.83 101.82 86.00 39.26 103.52 84.86 39.04 102.67 85.43 2 0 1000.00 -999 ? >VAL^B 18 37.29 102.70 89.30 37.73 102.62 91.45 37.51 102.66 90.38 3 0 1000.00 -999 ? >GLU^B 19 33.43 107.50 88.60 31.67 107.77 87.45 32.55 107.64 88.02 2 0 1000.00 -999 ? >ILE^B 20 36.12 107.15 93.99 36.23 106.11 95.04 36.18 106.63 94.52 3 0 1000.00 -999 ? >GLU^B 21 29.25 109.16 94.38 27.42 108.12 94.29 28.34 108.64 94.33 2 0 1000.00 -999 ? >LEU^B 22 33.70 112.10 97.01 35.74 111.31 97.16 34.72 111.70 97.08 3 0 1000.00 -999 ? >ASP.B 23 28.84 112.40 100.19 27.51 110.91 99.32 28.18 111.66 99.76 2 0 1000.00 -999 ? >PRO.B 24 28.31 117.26 99.77 30.15 116.01 100.17 29.23 116.64 99.97 3 0 1000.00 -999 ? >GLY.B 25 33.74 116.59 102.39 33.54 115.98 101.93 33.64 116.29 102.16 1 0 1000.00 -999 ? >GLU.B 26 32.50 111.76 101.96 31.30 110.12 101.45 31.90 110.94 101.71 2 0 1000.00 -999 ? >THR^B 27 38.21 112.02 100.58 39.80 113.34 101.41 39.00 112.68 101.00 2 0 1000.00 -999 ? >VAL^B 28 39.90 109.27 98.57 39.49 108.49 96.54 39.70 108.88 97.56 3 0 1000.00 -999 ? >ILE^B 29 44.14 107.92 99.92 44.31 108.24 100.69 44.22 108.08 100.31 3 0 1000.00 -999 ? >ALA^B 30 45.64 107.60 95.42 44.76 107.58 94.17 45.20 107.59 94.79 2 0 1000.00 -999 ? >GLU.B 31 49.46 106.07 92.37 48.36 104.45 93.19 48.91 105.26 92.78 2 0 1000.00 -999 ? >ALA.B 32 49.54 110.96 91.70 50.58 112.11 91.84 50.06 111.53 91.77 2 0 1000.00 -999 ? >GLY.B 33 49.30 109.93 88.07 48.70 109.75 88.59 49.00 109.84 88.33 1 0 1000.00 -999 ? >ALA.B 34 46.49 107.46 88.77 46.25 106.74 90.08 46.37 107.10 89.43 2 0 1000.00 -999 ? >MET?B 35 43.57 109.81 88.25 42.26 113.10 87.27 42.91 111.45 87.76 2 0 1000.00 -999 ? >ASN.B 36 41.16 108.73 84.25 42.27 106.92 84.53 41.71 107.83 84.39 2 0 1000.00 -999 ? >TYR.B 37 36.94 111.22 84.50 35.16 109.10 84.96 36.05 110.16 84.74 3 0 1000.00 -999 ? >MET?B 38 37.20 114.40 88.04 40.43 116.45 89.91 38.82 115.42 88.98 2 0 1000.00 -999 ? >THR.B 39 33.91 116.29 88.30 32.41 114.92 88.95 33.16 115.60 88.62 2 0 1000.00 -999 ? >GLY.B 40 33.62 120.07 88.98 33.71 119.55 89.54 33.66 119.81 89.26 1 0 1000.00 -999 ? >ASP.B 41 32.53 120.14 93.60 31.29 121.80 93.11 31.91 120.97 93.35 2 0 1000.00 -999 ? >ILE^B 42 37.08 116.47 92.36 36.83 115.35 93.15 36.95 115.91 92.75 3 0 1000.00 -999 ? >ARG^B 43 39.28 122.41 93.87 36.76 123.33 92.33 38.02 122.87 93.10 2 0 1000.00 -999 ? >PHE^B 44 44.21 117.30 93.28 45.38 118.32 90.94 44.80 117.81 92.11 3 0 1000.00 -999 ? >THR^B 45 46.33 118.23 97.59 45.56 119.18 99.39 45.94 118.70 98.49 2 0 1000.00 -999 ? >ALA.B 46 49.62 116.31 97.92 50.98 116.92 97.58 50.30 116.62 97.75 2 0 1000.00 -999 ? >ARG.B 47 52.00 111.03 102.03 49.41 109.91 103.29 50.70 110.47 102.66 2 0 1000.00 -999 ? >MET?B 75 50.11 110.22 97.86 48.39 106.57 98.76 49.25 108.40 98.31 2 0 1000.00 -999 ? >THR^B 76 47.39 112.69 96.95 47.32 113.35 94.88 47.36 113.02 95.91 2 0 1000.00 -999 ? >HIS^B 77 44.71 113.03 101.04 45.88 111.86 102.34 45.29 112.44 101.69 3 0 1000.00 -999 ? >PHE^B 78 42.00 113.07 94.20 44.25 112.78 92.54 43.12 112.92 93.37 3 0 1000.00 -999 ? >THR^B 79 38.15 115.73 98.12 38.53 116.44 100.17 38.34 116.09 99.15 2 0 1000.00 -999 ? >ASN^B 80 33.39 115.98 97.38 31.64 117.03 96.77 32.52 116.51 97.07 2 0 1000.00 -999 ? >GLU.B 81 37.44 120.97 98.33 37.48 120.71 100.46 37.46 120.84 99.39 2 0 1000.00 -999 ? >GLY.B 82 31.39 121.39 96.97 31.38 120.63 97.34 31.39 121.01 97.15 1 0 1000.00 -999 ? >GLN.B 83 26.86 121.41 94.63 26.43 123.46 94.09 26.64 122.44 94.36 2 0 1000.00 -999 ? >GLY.B 84 26.16 116.72 96.03 26.96 116.80 96.18 26.56 116.76 96.10 1 0 1000.00 -999 ? >LYS.B 85 27.68 113.57 94.57 22.96 111.21 92.92 25.32 112.39 93.74 2 0 1000.00 -999 ? >GLN^B 86 31.19 116.61 93.61 30.67 117.61 91.80 30.93 117.11 92.70 2 0 1000.00 -999 ? >HIS^B 87 31.02 110.94 90.16 29.02 110.66 90.74 30.02 110.80 90.45 3 0 1000.00 -999 ? >VAL^B 88 37.02 111.05 90.49 38.36 111.83 92.03 37.69 111.44 91.26 3 0 1000.00 -999 ? >ALA^B 89 38.25 108.19 88.27 37.71 107.98 86.86 37.98 108.09 87.57 2 0 1000.00 -999 ? >PHE^B 90 41.68 107.07 91.16 41.39 109.27 92.84 41.54 108.17 92.00 3 0 1000.00 -999 ? >ALA.B 91 43.37 103.53 86.74 43.03 103.44 85.22 43.20 103.49 85.98 2 0 1000.00 -999 ? >ALA.B 92 46.69 101.66 86.99 46.84 100.21 87.46 46.77 100.94 87.22 2 0 1000.00 -999 ? >PRO.B 93 50.91 102.46 86.18 49.03 102.14 84.92 49.97 102.30 85.55 3 0 1000.00 -999 ? >TYR.B 94 50.06 97.53 84.84 49.97 96.92 87.60 50.02 97.23 86.22 3 0 1000.00 -999 ? >PRO.B 95 47.49 95.94 79.83 46.72 96.99 81.66 47.10 96.47 80.74 3 0 1000.00 -999 ? >GLY^B 96 43.96 94.76 84.05 43.56 95.45 83.92 43.76 95.11 83.98 1 0 1000.00 -999 ? >SER^B 97 40.96 94.65 86.32 40.64 92.37 87.06 40.80 93.51 86.69 2 0 1000.00 -999 ? >VAL^B 98 40.03 96.41 89.53 39.82 98.58 89.65 39.92 97.49 89.59 3 0 1000.00 -999 ? >VAL^B 99 39.15 94.60 92.77 39.85 92.53 93.14 39.50 93.56 92.96 3 0 1000.00 -999 ? >ALA^B 100 37.26 96.44 95.50 35.86 97.03 95.38 36.56 96.73 95.44 2 0 1000.00 -999 ? >VAL^B 101 38.15 95.00 98.90 39.92 93.66 99.16 39.03 94.33 99.03 3 0 1000.00 -999 ? >ASP^B 102 34.65 95.69 102.12 33.85 96.52 103.88 34.25 96.11 103.00 2 0 1000.00 -999 ? >LEU.B 103 39.49 97.15 105.25 41.44 97.64 104.18 40.46 97.40 104.72 3 0 1000.00 -999 ? >ASP~B 104 34.51 95.31 107.42 34.53 97.03 108.68 34.52 96.17 108.05 2 0 1000.00 -999 ? >ASP~B 105 35.21 91.35 103.68 33.25 92.02 103.26 34.23 91.68 103.47 2 0 1000.00 -999 ? >VAL~B 106 39.30 90.90 105.90 40.16 91.72 103.96 39.73 91.31 104.93 3 0 1000.00 -999 ? >GLY~B 107 39.62 91.64 109.64 39.74 92.17 109.03 39.68 91.91 109.33 1 0 1000.00 -999 ? >GLY.B 108 40.73 95.22 108.92 41.11 94.58 108.62 40.92 94.90 108.77 1 0 1000.00 -999 ? >ARG^B 109 47.15 92.84 109.01 46.03 93.03 111.90 46.59 92.93 110.46 2 0 1000.00 -999 ? >LEU^B 110 44.24 94.07 102.47 43.76 93.20 100.54 44.00 93.63 101.51 3 0 1000.00 -999 ? >PHE^B 111 49.69 91.70 104.31 49.79 91.53 107.11 49.74 91.61 105.71 3 0 1000.00 -999 ? >CYH^B 112 49.17 94.35 98.86 47.92 96.34 97.42 48.54 95.35 98.14 2 0 1000.00 -999 ? >GLN^B 113 53.23 94.29 94.10 53.73 93.03 92.45 53.48 93.66 93.27 2 0 1000.00 -999 ? >LYS.B 114 52.93 98.23 96.01 56.94 103.16 96.39 54.94 100.70 96.20 2 0 1000.00 -999 ? >ASP.B 115 53.03 97.88 91.14 54.97 98.67 90.97 54.00 98.28 91.06 2 0 1000.00 -999 ? >SER.B 116 48.85 96.80 92.69 49.36 94.50 92.49 49.10 95.65 92.59 2 0 1000.00 -999 ? >PHE^B 117 47.48 101.22 96.95 45.96 103.19 98.19 46.72 102.21 97.57 3 0 1000.00 -999 ? >LEU^B 118 44.05 101.32 92.48 43.41 102.24 90.60 43.73 101.78 91.54 3 0 1000.00 -999 ? >CYH^B 119 43.19 103.96 95.80 40.77 104.06 94.32 41.98 104.01 95.06 2 0 1000.00 -999 ? >ALA^B 120 41.65 103.77 99.28 42.79 103.33 100.23 42.22 103.55 99.76 2 0 1000.00 -999 ? >ALA^B 121 39.20 105.55 101.56 38.05 104.91 102.31 38.62 105.23 101.93 2 0 1000.00 -999 ? >TYR.B 122 40.90 110.68 104.63 42.28 112.27 106.47 41.59 111.48 105.55 3 0 1000.00 -999 ? >GLY.B 123 41.24 106.88 107.11 41.67 106.63 106.40 41.45 106.76 106.75 1 0 1000.00 -999 ? >THR.B 124 43.08 103.95 105.47 42.61 102.60 103.81 42.85 103.27 104.64 2 0 1000.00 -999 ? >ARG^B 125 45.96 103.38 111.03 45.10 100.49 111.56 45.53 101.93 111.29 2 0 1000.00 -999 ? >VAL^B 126 49.21 102.52 104.57 48.92 103.05 102.46 49.07 102.79 103.52 3 0 1000.00 -999 ? >GLY^B 127 52.36 100.93 105.98 52.09 100.58 105.23 52.22 100.76 105.60 1 0 1000.00 -999 ? >ILE^B 128 56.60 99.32 104.36 57.54 99.91 103.72 57.07 99.62 104.04 3 0 1000.00 -999 ? >ALA^B 129 54.91 95.10 105.54 53.77 94.19 105.06 54.34 94.65 105.30 2 0 1000.00 -999 ? >PHE^B 130 58.31 91.55 102.48 60.06 89.63 101.41 59.18 90.59 101.94 3 0 1000.00 -999 ? >THR^B 131 60.73 94.86 101.25 61.08 96.97 101.02 60.90 95.91 101.14 2 0 1000.00 -999 ? >LYS.B 132 63.29 92.63 99.60 64.86 86.54 100.89 64.07 89.58 100.24 2 0 1000.00 -999 ? >ARG.B 133 67.02 97.13 96.89 66.76 100.12 97.55 66.89 98.63 97.22 2 0 1000.00 -999 ? >LEU.B 134 66.58 89.05 95.52 66.49 87.65 97.24 66.54 88.35 96.38 3 0 1000.00 -999 ? >GLY.B 135 68.79 92.08 92.38 68.10 91.62 92.35 68.44 91.85 92.37 1 0 1000.00 -999 ? >PHE.B 144 58.48 92.15 95.86 55.93 91.08 96.24 57.20 91.61 96.05 3 0 1000.00 -999 ? >ILE^B 145 57.49 97.43 98.23 58.01 98.73 98.80 57.75 98.08 98.51 3 0 1000.00 -999 ? >LEU^B 146 54.15 93.36 100.95 53.78 91.43 99.93 53.97 92.39 100.44 3 0 1000.00 -999 ? >GLN^B 147 52.46 99.29 100.15 51.41 100.72 99.02 51.94 100.01 99.59 2 0 1000.00 -999 ? >LYS^B 148 49.86 96.72 104.70 52.41 94.06 109.34 51.13 95.39 107.02 2 0 1000.00 -999 ? >LEU^B 149 45.59 98.12 103.06 46.59 98.52 101.10 46.09 98.32 102.08 3 0 1000.00 -999 ? >GLU^B 150 46.23 97.62 108.92 47.67 97.78 110.46 46.95 97.70 109.69 2 0 1000.00 -999 ? >GLY.B 151 41.10 100.47 108.54 41.00 99.65 108.35 41.05 100.06 108.44 1 0 1000.00 -999 ? >ASP.B 152 36.53 100.19 109.26 36.52 102.28 109.71 36.52 101.24 109.49 2 0 1000.00 -999 ? >GLY.B 153 36.81 101.38 104.60 37.26 100.71 104.61 37.03 101.05 104.60 1 0 1000.00 -999 ? >LEU^B 154 36.03 100.84 99.90 34.17 99.87 99.33 35.10 100.36 99.62 3 0 1000.00 -999 ? >VAL^B 155 40.40 99.70 99.18 41.77 98.76 100.65 41.08 99.23 99.92 3 0 1000.00 -999 ? >PHE^B 156 38.94 100.62 95.07 36.33 101.22 96.00 37.63 100.92 95.54 3 0 1000.00 -999 ? >VAL^B 157 43.73 97.01 94.05 43.97 95.37 95.49 43.85 96.19 94.77 3 0 1000.00 -999 ? >HIS^B 158 45.41 97.26 88.25 45.66 96.99 86.19 45.53 97.13 87.22 3 0 1000.00 -999 ? >ALA^B 159 45.32 92.98 88.80 44.38 91.85 89.08 44.85 92.41 88.94 2 0 1000.00 -999 ? >GLY^B 160 47.36 92.98 85.56 46.95 92.38 85.92 47.16 92.68 85.74 1 0 1000.00 -999 ? >GLY.B 161 45.90 90.58 82.95 45.49 90.92 83.63 45.70 90.75 83.29 1 0 1000.00 -999 ? >THR.B 162 43.42 88.34 84.78 42.41 86.63 83.89 42.91 87.49 84.33 2 0 1000.00 -999 ? >LEU^B 163 41.40 89.08 89.03 41.23 88.88 91.24 41.32 88.98 90.13 3 0 1000.00 -999 ? >ILE^B 164 44.11 83.89 89.50 44.79 83.26 88.71 44.45 83.58 89.11 3 0 1000.00 -999 ? >ARG^B 165 38.66 85.95 95.85 37.04 88.54 96.52 37.85 87.24 96.19 2 0 1000.00 -999 ? >ARG^B 166 44.94 79.59 93.38 44.53 76.75 92.35 44.74 78.17 92.87 2 0 1000.00 -999 ? >GLN^B 167 39.86 79.86 100.73 39.63 81.84 101.46 39.75 80.85 101.09 2 0 1000.00 -999 ? >LEU^B 168 45.62 79.04 101.26 47.19 79.40 99.74 46.40 79.22 100.50 3 0 1000.00 -999 ? >ASN^B 169 41.84 75.06 103.17 40.30 76.34 102.36 41.07 75.70 102.77 2 0 1000.00 -999 ? >GLY^B 170 46.33 74.68 105.19 46.14 74.74 104.41 46.23 74.71 104.80 1 0 1000.00 -999 ? >GLU^B 171 46.28 75.21 100.38 44.32 74.47 100.02 45.30 74.84 100.20 2 0 1000.00 -999 ? >THR^B 172 51.34 75.74 100.14 52.81 74.27 100.76 52.08 75.00 100.45 2 0 1000.00 -999 ? >LEU^B 173 49.98 78.57 96.67 48.80 79.06 94.84 49.39 78.81 95.75 3 0 1000.00 -999 ? >ARG^B 174 56.91 75.92 95.29 56.62 73.29 93.68 56.77 74.60 94.49 2 0 1000.00 -999 ? >VAL^B 175 53.87 81.88 92.72 52.43 83.05 93.99 53.15 82.47 93.35 3 0 1000.00 -999 ? >ASP^B 176 55.51 84.30 88.92 56.88 85.59 87.92 56.20 84.95 88.42 2 0 1000.00 -999 ? >THR.B 177 56.62 86.92 92.76 58.26 87.35 94.08 57.44 87.13 93.42 2 0 1000.00 -999 ? >GLY.B 178 55.15 89.70 90.62 54.79 88.97 90.78 54.97 89.33 90.70 1 0 1000.00 -999 ? >CYH.B 179 51.95 87.67 90.20 52.44 86.10 88.00 52.19 86.88 89.10 2 0 1000.00 -999 ? >LEU^B 180 52.04 87.93 94.99 51.44 87.38 97.08 51.74 87.65 96.04 3 0 1000.00 -999 ? >VAL^B 181 48.49 91.09 94.09 46.76 91.61 92.80 47.63 91.35 93.45 3 0 1000.00 -999 ? >ALA^B 182 47.24 90.81 97.70 45.97 91.70 97.76 46.60 91.25 97.73 2 0 1000.00 -999 ? >PHE^B 183 48.93 87.84 101.14 51.48 88.77 101.94 50.21 88.31 101.54 3 0 1000.00 -999 ? >THR.B 184 44.99 88.30 104.04 43.22 87.08 103.72 44.10 87.69 103.88 2 0 1000.00 -999 ? >ASP.B 185 45.76 87.90 108.86 46.21 89.89 109.41 45.99 88.90 109.13 2 0 1000.00 -999 ? >GLY.B 186 46.87 83.75 108.06 47.40 84.14 107.56 47.13 83.94 107.81 1 0 1000.00 -999 ? >ILE^B 187 48.78 83.84 103.84 48.15 83.72 102.76 48.47 83.78 103.30 3 0 1000.00 -999 ? >ASP^B 188 53.65 81.67 106.22 53.05 81.47 108.26 53.35 81.57 107.24 2 0 1000.00 -999 ? >TYR^B 189 54.73 86.61 102.69 55.11 89.01 104.06 54.92 87.81 103.38 3 0 1000.00 -999 ? >ASP^B 190 59.95 83.78 102.24 60.24 81.81 101.57 60.10 82.80 101.91 2 0 1000.00 -999 ? >VAL^B 191 60.62 85.77 98.27 60.16 87.76 97.35 60.39 86.76 97.81 3 0 1000.00 -999 ? >GLN^B 192 63.62 81.99 98.94 64.97 83.12 100.14 64.29 82.55 99.54 2 0 1000.00 -999 ? >LEU^B 193 67.08 83.87 93.50 67.82 85.49 92.29 67.45 84.68 92.90 3 0 1000.00 -999 ? >ALA.B 194 64.24 80.41 92.06 63.29 80.32 90.89 63.76 80.36 91.47 2 0 1000.00 -999 ? >GLY.B 195 67.70 79.25 90.99 66.98 79.09 90.50 67.34 79.17 90.75 1 0 1000.00 -999 ? >GLY.B 196 66.64 76.03 89.36 66.16 76.69 89.61 66.40 76.36 89.49 1 0 1000.00 -999 ? >GLY.B 203 67.92 87.99 81.20 68.12 87.33 80.77 68.02 87.66 80.99 1 0 1000.00 -999 ? >GLY.B 204 69.51 84.55 81.82 69.22 84.95 82.44 69.36 84.75 82.13 1 0 1000.00 -999 ? >GLU.B 205 70.39 86.71 85.50 68.69 87.95 85.91 69.54 87.33 85.70 2 0 1000.00 -999 ? >GLY.B 206 66.65 85.98 88.21 66.44 85.43 87.75 66.55 85.70 87.98 1 0 1000.00 -999 ? >LEU.B 207 62.99 82.73 88.04 60.98 83.08 87.14 61.99 82.91 87.59 3 0 1000.00 -999 ? >LEU^B 208 61.46 86.73 92.21 62.72 88.28 93.06 62.09 87.50 92.63 3 0 1000.00 -999 ? >LEU^B 209 59.96 81.20 93.49 58.47 79.63 93.02 59.22 80.41 93.26 3 0 1000.00 -999 ? >THR^B 210 57.18 83.43 96.35 56.19 85.24 96.89 56.68 84.34 96.62 2 0 1000.00 -999 ? >THR^B 211 56.18 80.50 98.58 57.30 78.67 98.93 56.74 79.58 98.76 2 0 1000.00 -999 ? >LEU^B 212 51.69 81.73 99.54 51.47 83.70 98.72 51.58 82.72 99.13 3 0 1000.00 -999 ? >LYS^B 213 51.38 78.92 103.10 55.88 75.34 105.44 53.63 77.13 104.27 2 0 1000.00 -999 ? >GLY^B 214 48.61 78.90 105.71 48.36 78.70 104.89 48.48 78.80 105.30 1 0 1000.00 -999 ? >SER^B 215 44.93 79.76 105.46 44.74 77.94 107.09 44.84 78.85 106.28 2 0 1000.00 -999 ? >GLY^B 216 43.32 82.79 103.89 43.47 82.19 103.29 43.39 82.49 103.59 1 0 1000.00 -999 ? >THR^B 217 42.63 84.49 100.58 40.69 85.25 100.00 41.66 84.87 100.29 2 0 1000.00 -999 ? >VAL^B 218 45.24 85.14 97.92 46.57 83.35 97.93 45.90 84.24 97.93 3 0 1000.00 -999 ? >TRP^B 219 44.07 88.64 97.73 40.34 89.64 97.61 42.20 89.14 97.67 3 0 1000.00 -999 ? >LEU^B 220 47.25 85.30 91.60 48.26 83.77 92.89 47.76 84.53 92.24 3 0 1000.00 -999 ? >GLN^B 221 49.21 90.24 88.75 49.80 92.21 89.19 49.51 91.23 88.97 2 0 1000.00 -999 ? >SER.B 222 48.36 86.82 85.30 46.66 87.35 83.74 47.51 87.08 84.52 2 0 1000.00 -999 ? >LEU.B 223 49.68 90.34 82.52 50.99 90.97 80.84 50.33 90.66 81.68 3 0 1000.00 -999 ? >PRO~B 224 53.26 89.55 86.92 51.98 91.18 86.01 52.62 90.36 86.47 3 0 1000.00 -999 ? >PHE~B 225 54.09 97.60 85.72 55.23 99.96 84.69 54.66 98.78 85.20 3 0 1000.00 -999 ? >SER~B 226 57.09 93.94 86.35 56.94 92.16 87.98 57.02 93.05 87.16 2 0 1000.00 -999 ? >ARG~B 227 55.13 87.74 82.95 54.26 85.13 84.29 54.69 86.44 83.62 2 0 1000.00 -999 ? >LEU~B 228 54.30 94.10 81.36 53.29 95.36 79.85 53.80 94.73 80.61 3 0 1000.00 -999 ? >ALA~B 229 58.26 95.97 81.90 58.35 96.85 83.16 58.30 96.41 82.53 2 0 1000.00 -999 ? >GLY~B 230 61.05 93.37 82.28 60.54 93.45 81.71 60.80 93.41 82.00 1 0 1000.00 -999 ? >ARG~B 231 59.76 88.67 77.50 59.89 88.11 74.45 59.83 88.39 75.97 2 0 1000.00 -999 ? >ILE~B 232 58.99 95.84 77.31 58.06 96.90 76.94 58.53 96.37 77.13 3 0 1000.00 -999 ? >TYR~B 233 64.99 96.32 80.24 67.71 96.80 80.71 66.35 96.56 80.48 3 0 1000.00 -999 ? >ASP~B 234 64.61 91.17 78.36 65.59 89.51 77.45 65.10 90.34 77.91 2 0 1000.00 -999 ? >ALA~B 235 63.67 92.32 74.10 62.25 91.92 73.73 62.96 92.12 73.92 2 0 1000.00 -999 ? >THR~B 236 64.52 95.94 73.16 62.71 96.92 73.76 63.61 96.43 73.46 2 0 1000.00 -999 ? >PHE.B 237 65.99 99.26 77.10 64.30 101.50 77.47 65.14 100.38 77.28 3 0 1000.00 -999 ? >GLU.C 5 49.06 63.94 78.15 50.99 63.13 77.58 50.03 63.54 77.87 2 0 1000.00 -999 ? >LEU.C 6 47.10 68.32 79.10 49.14 68.33 79.93 48.12 68.32 79.51 3 0 1000.00 -999 ? >ASP^C 7 42.21 68.23 82.18 41.32 66.38 81.60 41.76 67.31 81.89 2 0 1000.00 -999 ? >TYR^C 8 43.11 73.11 78.96 41.62 73.14 76.61 42.36 73.13 77.79 3 0 1000.00 -999 ? >ARG^C 9 39.81 75.75 85.58 40.09 77.66 88.00 39.95 76.71 86.79 2 0 1000.00 -999 ? >ILE^C 10 41.33 79.21 78.72 41.71 79.44 77.41 41.52 79.32 78.07 3 0 1000.00 -999 ? >LEU^C 11 41.59 81.76 84.05 41.43 80.22 85.50 41.51 80.99 84.77 3 0 1000.00 -999 ? >GLY.C 12 39.88 85.40 82.08 39.53 84.80 81.63 39.70 85.10 81.85 1 0 1000.00 -999 ? >GLU.C 13 35.61 87.50 80.06 35.18 85.71 78.95 35.40 86.60 79.51 2 0 1000.00 -999 ? >SER.C 14 40.19 89.31 76.90 38.60 91.15 76.83 39.39 90.23 76.86 2 0 1000.00 -999 ? >MET?C 15 43.42 88.71 78.78 44.93 92.59 79.82 44.18 90.65 79.30 2 0 1000.00 -999 ? >GLN.C 16 41.98 84.84 77.94 40.85 83.81 76.43 41.41 84.32 77.19 2 0 1000.00 -999 ? >THR^C 17 45.97 82.48 81.34 46.16 82.49 83.47 46.07 82.48 82.41 2 0 1000.00 -999 ? >VAL^C 18 46.01 78.68 81.04 46.97 77.27 79.62 46.49 77.97 80.33 3 0 1000.00 -999 ? >GLU^C 19 45.13 76.17 86.57 43.52 75.92 87.91 44.33 76.04 87.24 2 0 1000.00 -999 ? >ILE^C 20 48.33 72.81 82.72 48.21 72.46 81.29 48.27 72.63 82.01 3 0 1000.00 -999 ? >GLU^C 21 43.74 68.83 86.51 41.67 68.70 86.75 42.70 68.76 86.63 2 0 1000.00 -999 ? >LEU^C 22 49.68 67.91 86.26 50.99 69.13 84.91 50.33 68.52 85.59 3 0 1000.00 -999 ? >ASP.C 23 46.63 62.82 86.11 44.69 63.52 85.58 45.66 63.17 85.84 2 0 1000.00 -999 ? >PRO.C 24 48.46 61.36 90.38 49.47 62.24 88.61 48.97 61.80 89.50 3 0 1000.00 -999 ? >GLY.C 25 53.14 61.37 86.59 52.66 62.00 86.49 52.90 61.69 86.54 1 0 1000.00 -999 ? >GLU.C 26 49.45 63.12 83.46 47.57 63.81 82.71 48.51 63.47 83.08 2 0 1000.00 -999 ? >THR^C 27 53.97 66.68 82.36 56.11 66.32 82.49 55.04 66.50 82.43 2 0 1000.00 -999 ? >VAL^C 28 53.64 70.05 80.65 52.44 71.84 81.15 53.04 70.94 80.90 3 0 1000.00 -999 ? >ILE^C 29 57.32 71.20 77.83 57.62 70.17 76.82 57.47 70.69 77.32 3 0 1000.00 -999 ? >ALA^C 30 56.72 75.72 78.92 55.75 76.18 79.99 56.24 75.95 79.46 2 0 1000.00 -999 ? >GLU.C 31 60.76 80.50 78.34 60.38 81.76 79.99 60.57 81.13 79.17 2 0 1000.00 -999 ? >ALA.C 32 59.62 79.04 82.81 60.78 78.51 83.69 60.20 78.77 83.25 2 0 1000.00 -999 ? >GLY.C 33 59.10 82.83 82.69 58.56 82.26 82.46 58.83 82.55 82.58 1 0 1000.00 -999 ? >ALA.C 34 55.47 82.13 81.68 55.06 81.46 80.40 55.26 81.79 81.04 2 0 1000.00 -999 ? >MET?C 35 54.48 80.30 84.91 54.94 79.50 88.51 54.71 79.90 86.71 2 0 1000.00 -999 ? >ASN.C 36 50.74 82.59 86.98 50.54 83.65 85.15 50.64 83.12 86.06 2 0 1000.00 -999 ? >TYR.C 37 49.00 79.72 90.20 46.53 79.16 89.01 47.76 79.44 89.61 3 0 1000.00 -999 ? >MET?C 38 51.86 75.94 90.90 56.08 75.27 90.00 53.97 75.60 90.45 2 0 1000.00 -999 ? >THR.C 39 50.39 73.67 93.56 48.53 72.82 92.73 49.46 73.25 93.15 2 0 1000.00 -999 ? >GLY.C 40 52.39 71.72 96.09 52.33 71.39 95.39 52.36 71.55 95.74 1 0 1000.00 -999 ? >ASP.C 41 52.95 67.18 94.72 51.98 67.10 96.63 52.46 67.14 95.68 2 0 1000.00 -999 ? >ILE^C 42 53.90 71.39 90.39 53.13 71.71 89.87 53.51 71.55 90.13 3 0 1000.00 -999 ? >ARG^C 43 59.63 68.84 93.09 57.71 69.86 95.27 58.67 69.35 94.18 2 0 1000.00 -999 ? >PHE^C 44 60.33 73.82 88.73 61.32 75.10 91.02 60.83 74.46 89.87 3 0 1000.00 -999 ? >THR^C 45 63.23 70.76 85.58 64.17 68.86 86.07 63.70 69.81 85.82 2 0 1000.00 -999 ? >ALA.C 46 65.31 72.68 83.00 66.60 73.47 83.33 65.95 73.07 83.16 2 0 1000.00 -999 ? >ARG.C 47 67.18 72.06 77.22 64.93 72.11 75.11 66.06 72.09 76.17 2 0 1000.00 -999 ? >MET?C 75 62.06 74.50 77.76 59.18 74.44 75.74 60.62 74.47 76.75 2 0 1000.00 -999 ? >THR^C 76 61.05 73.76 81.34 60.96 75.63 82.38 61.01 74.69 81.86 2 0 1000.00 -999 ? >HIS^C 77 60.25 68.84 80.73 60.85 68.51 78.75 60.55 68.67 79.74 3 0 1000.00 -999 ? >PHE^C 78 56.18 73.25 85.01 57.42 75.78 84.95 56.80 74.52 84.98 3 0 1000.00 -999 ? >THR^C 79 55.65 67.30 86.43 56.69 65.55 85.69 56.17 66.43 86.06 2 0 1000.00 -999 ? >ASN^C 80 51.63 65.80 88.63 50.46 65.35 90.38 51.05 65.58 89.50 2 0 1000.00 -999 ? >GLU.C 81 57.31 65.43 91.00 58.81 64.14 90.30 58.06 64.78 90.65 2 0 1000.00 -999 ? >GLY.C 82 52.20 63.69 93.93 52.19 63.30 93.21 52.20 63.49 93.57 1 0 1000.00 -999 ? >GLN.C 83 50.33 60.97 96.64 52.05 59.92 95.97 51.19 60.44 96.31 2 0 1000.00 -999 ? >GLY.C 84 46.33 63.37 93.18 47.07 63.68 92.95 46.70 63.52 93.07 1 0 1000.00 -999 ? >LYS.C 85 45.51 66.17 90.73 39.71 65.85 88.17 42.61 66.01 89.45 2 0 1000.00 -999 ? >GLN^C 86 49.69 67.93 92.06 49.25 68.70 93.99 49.47 68.32 93.03 2 0 1000.00 -999 ? >HIS^C 87 45.39 72.40 89.40 43.62 71.29 89.48 44.51 71.84 89.44 3 0 1000.00 -999 ? >VAL^C 88 50.22 74.91 87.11 52.28 74.18 86.74 51.25 74.55 86.93 3 0 1000.00 -999 ? >ALA^C 89 49.14 78.11 85.32 48.15 79.08 85.99 48.64 78.60 85.65 2 0 1000.00 -999 ? >PHE^C 90 52.11 77.76 81.89 53.35 75.52 82.97 52.73 76.64 82.43 3 0 1000.00 -999 ? >ALA.C 91 50.46 83.36 80.71 49.78 84.37 81.57 50.12 83.86 81.14 2 0 1000.00 -999 ? >ALA.C 92 52.39 85.30 78.04 51.94 85.49 76.61 52.17 85.40 77.32 2 0 1000.00 -999 ? >PRO.C 93 56.13 87.60 77.97 54.02 87.91 78.76 55.08 87.76 78.37 3 0 1000.00 -999 ? >TYR.C 94 52.79 90.06 74.72 53.20 87.92 73.00 52.99 88.99 73.86 3 0 1000.00 -999 ? >PRO.C 95 48.65 93.57 77.12 48.81 91.36 76.85 48.73 92.47 76.98 3 0 1000.00 -999 ? >GLY^C 96 45.89 88.97 74.84 45.97 88.63 75.59 45.93 88.80 75.22 1 0 1000.00 -999 ? >SER^C 97 44.18 85.64 74.67 42.76 86.17 72.81 43.47 85.91 73.74 2 0 1000.00 -999 ? >VAL^C 98 45.10 82.00 74.82 46.01 81.15 76.65 45.56 81.58 75.73 3 0 1000.00 -999 ? >VAL^C 99 43.98 79.31 72.36 43.75 80.34 70.38 43.87 79.82 71.37 3 0 1000.00 -999 ? >ALA^C 100 44.29 75.57 72.79 43.42 74.72 73.71 43.86 75.14 73.25 2 0 1000.00 -999 ? >VAL^C 101 45.12 73.86 69.56 45.82 75.00 67.78 45.47 74.43 68.67 3 0 1000.00 -999 ? >ASP^C 102 43.51 69.26 69.38 43.86 67.20 69.80 43.68 68.23 69.59 2 0 1000.00 -999 ? >LEU.C 103 48.96 68.44 67.56 50.45 70.05 68.04 49.70 69.24 67.80 3 0 1000.00 -999 ? >ASP~C 104 44.46 65.06 66.78 45.58 63.46 67.60 45.02 64.26 67.19 2 0 1000.00 -999 ? >ASP~C 105 42.14 69.68 65.47 40.54 68.82 66.57 41.34 69.25 66.02 2 0 1000.00 -999 ? >VAL~C 106 45.66 70.03 62.35 46.06 71.83 63.63 45.86 70.93 62.99 3 0 1000.00 -999 ? >GLY~C 107 47.66 67.06 61.04 47.79 67.29 61.79 47.72 67.17 61.41 1 0 1000.00 -999 ? >GLY.C 108 50.07 66.83 63.97 50.10 67.44 63.42 50.09 67.13 63.69 1 0 1000.00 -999 ? >ARG^C 109 55.22 69.90 60.94 55.05 67.98 58.54 55.14 68.94 59.74 2 0 1000.00 -999 ? >LEU^C 110 50.80 74.06 65.04 49.39 75.77 65.22 50.09 74.92 65.13 3 0 1000.00 -999 ? >PHE^C 111 54.75 75.92 60.74 55.76 73.81 59.16 55.26 74.86 59.95 3 0 1000.00 -999 ? >CYH^C 112 54.25 79.17 65.75 53.34 79.25 68.27 53.80 79.21 67.01 2 0 1000.00 -999 ? >GLN^C 113 56.52 85.00 66.15 55.98 87.05 66.40 56.25 86.02 66.28 2 0 1000.00 -999 ? >LYS.C 114 58.21 81.92 69.25 61.58 83.48 72.60 59.90 82.70 70.93 2 0 1000.00 -999 ? >ASP.C 115 56.68 86.27 70.90 58.49 87.33 71.19 57.59 86.80 71.05 2 0 1000.00 -999 ? >SER.C 116 53.40 83.20 70.78 52.10 84.43 69.17 52.75 83.82 69.97 2 0 1000.00 -999 ? >PHE^C 117 55.58 77.63 72.69 55.58 75.26 74.24 55.58 76.44 73.47 3 0 1000.00 -999 ? >LEU^C 118 51.31 79.80 75.94 50.81 80.76 77.82 51.06 80.28 76.88 3 0 1000.00 -999 ? >CYH^C 119 52.90 75.69 76.64 50.79 75.71 78.35 51.85 75.70 77.49 2 0 1000.00 -999 ? >ALA^C 120 52.44 72.15 75.42 53.23 71.97 74.19 52.84 72.06 74.81 2 0 1000.00 -999 ? >ALA^C 121 51.83 68.59 76.56 50.75 67.71 75.94 51.29 68.15 76.25 2 0 1000.00 -999 ? >TYR.C 122 56.55 65.01 78.43 59.03 63.68 78.15 57.79 64.34 78.29 3 0 1000.00 -999 ? >GLY.C 123 55.65 64.60 74.00 55.65 65.42 74.00 55.65 65.01 74.00 1 0 1000.00 -999 ? >THR.C 124 55.26 67.72 71.88 54.04 69.48 71.90 54.65 68.60 71.89 2 0 1000.00 -999 ? >ARG^C 125 58.39 64.49 67.81 56.57 64.49 65.32 57.48 64.49 66.56 2 0 1000.00 -999 ? >VAL^C 126 59.33 71.65 69.51 58.84 73.16 71.07 59.09 72.40 70.29 3 0 1000.00 -999 ? >GLY^C 127 61.74 72.75 66.81 61.08 73.25 66.86 61.41 73.00 66.83 1 0 1000.00 -999 ? >ILE^C 128 64.11 76.50 64.90 65.01 77.46 65.29 64.56 76.98 65.09 3 0 1000.00 -999 ? >ALA^C 129 61.17 76.13 61.33 59.68 76.11 61.18 60.43 76.12 61.26 2 0 1000.00 -999 ? >PHE^C 130 61.79 81.42 59.06 62.38 83.64 57.44 62.09 82.53 58.25 3 0 1000.00 -999 ? >THR^C 131 65.08 82.12 62.16 66.13 80.91 63.63 65.61 81.51 62.89 2 0 1000.00 -999 ? >LYS^C 132 65.85 85.48 60.59 64.15 86.00 54.54 65.00 85.74 57.57 2 0 1000.00 -999 ? >ARG.C 133 70.22 87.47 61.30 73.01 88.81 61.34 71.62 88.14 61.32 2 0 1000.00 -999 ? >LEU.C 134 64.18 91.21 60.08 62.96 90.12 58.65 63.57 90.66 59.37 3 0 1000.00 -999 ? >GLY.C 135 66.86 95.20 60.08 67.05 94.70 60.64 66.95 94.95 60.36 1 0 1000.00 -999 ? >ALA.C 136 67.56 97.47 63.06 68.44 98.68 62.79 68.00 98.08 62.92 2 0 1000.00 -999 ? >GLY~C 137 64.09 97.54 64.71 64.60 96.88 64.71 64.35 97.21 64.71 1 0 1000.00 -999 ? >PHE~C 138 60.74 93.65 68.33 60.24 91.56 70.11 60.49 92.61 69.22 3 0 1000.00 -999 ? >PHE~C 139 61.17 90.99 64.11 58.73 90.01 65.07 59.95 90.50 64.59 3 0 1000.00 -999 ? >GLY~C 140 66.98 93.33 64.68 66.54 92.98 65.28 66.76 93.16 64.98 1 0 1000.00 -999 ? >GLY~C 141 67.27 92.04 68.25 67.13 91.54 67.59 67.20 91.79 67.92 1 0 1000.00 -999 ? >GLU.C 142 65.20 88.95 71.01 63.36 88.84 72.12 64.28 88.90 71.57 2 0 1000.00 -999 ? >GLY.C 143 65.18 88.02 65.30 64.63 88.00 65.96 64.91 88.01 65.63 1 0 1000.00 -999 ? >PHE^C 144 59.88 86.64 62.37 57.32 85.53 61.97 58.60 86.08 62.17 3 0 1000.00 -999 ? >ILE^C 145 62.34 82.70 66.26 63.41 82.41 67.09 62.87 82.56 66.68 3 0 1000.00 -999 ? >LEU^C 146 58.60 80.24 62.30 56.72 80.87 61.54 57.66 80.55 61.92 3 0 1000.00 -999 ? >GLN^C 147 59.64 78.03 67.99 59.36 77.97 70.07 59.50 78.00 69.03 2 0 1000.00 -999 ? >LYS^C 148 57.47 73.84 64.66 61.60 70.24 61.24 59.54 72.04 62.95 2 0 1000.00 -999 ? >LEU^C 149 54.23 72.79 67.90 54.49 74.71 68.94 54.36 73.75 68.42 3 0 1000.00 -999 ? >GLU^C 150 56.92 67.95 65.08 57.94 68.07 63.21 57.43 68.01 64.14 2 0 1000.00 -999 ? >GLY.C 151 52.89 65.42 67.90 52.33 65.88 67.42 52.61 65.65 67.66 1 0 1000.00 -999 ? >ASP.C 152 49.21 62.75 68.78 49.60 61.74 70.62 49.40 62.25 69.70 2 0 1000.00 -999 ? >GLY.C 153 48.79 66.37 71.98 48.83 66.81 71.31 48.81 66.59 71.64 1 0 1000.00 -999 ? >LEU^C 154 46.74 69.93 74.36 44.60 69.71 74.24 45.67 69.82 74.30 3 0 1000.00 -999 ? >VAL^C 155 49.50 72.98 72.41 50.62 73.30 70.54 50.06 73.14 71.47 3 0 1000.00 -999 ? >PHE^C 156 47.65 75.40 75.85 46.29 73.18 76.93 46.97 74.29 76.39 3 0 1000.00 -999 ? >VAL^C 157 49.52 79.55 71.83 49.37 78.79 69.70 49.44 79.17 70.77 3 0 1000.00 -999 ? >HIS^C 158 49.52 85.07 74.36 49.03 86.95 75.15 49.27 86.01 74.75 3 0 1000.00 -999 ? >ALA^C 159 47.65 86.10 70.54 46.45 85.88 69.61 47.05 85.99 70.07 2 0 1000.00 -999 ? >GLY^C 160 48.46 89.71 71.57 47.89 89.44 71.01 48.17 89.57 71.29 1 0 1000.00 -999 ? >GLY.C 161 45.38 91.95 71.51 45.43 91.07 71.56 45.40 91.51 71.53 1 0 1000.00 -999 ? >THR.C 162 42.73 89.94 69.60 40.92 91.03 69.28 41.83 90.48 69.44 2 0 1000.00 -999 ? >LEU^C 163 42.92 85.34 68.36 43.05 83.73 66.80 42.98 84.53 67.58 3 0 1000.00 -999 ? >ILE^C 164 42.57 87.99 63.09 41.68 89.21 63.27 42.12 88.60 63.18 3 0 1000.00 -999 ? >ARG^C 165 39.92 80.00 63.04 39.88 77.04 63.82 39.90 78.52 63.43 2 0 1000.00 -999 ? >ARG^C 166 42.36 86.55 57.85 40.61 88.24 55.95 41.48 87.40 56.90 2 0 1000.00 -999 ? >GLN^C 167 38.97 79.22 57.68 39.80 78.23 59.39 39.38 78.72 58.54 2 0 1000.00 -999 ? >LEU.C 168 44.52 80.52 53.15 45.60 82.38 53.53 45.06 81.45 53.34 3 0 1000.00 -999 ? >ASN.C 169 40.02 78.67 50.42 38.92 77.68 51.97 39.47 78.17 51.19 2 0 1000.00 -999 ? >GLY.C 170 44.14 79.19 47.71 43.65 79.66 48.21 43.90 79.42 47.96 1 0 1000.00 -999 ? >GLU^C 171 41.71 83.13 48.93 40.10 83.59 50.28 40.91 83.36 49.61 2 0 1000.00 -999 ? >THR^C 172 47.02 85.45 49.25 48.75 86.21 48.17 47.89 85.83 48.71 2 0 1000.00 -999 ? >LEU^C 173 46.70 86.42 53.87 45.39 87.35 55.41 46.05 86.89 54.64 3 0 1000.00 -999 ? >ARG^C 174 50.78 91.78 50.00 48.67 93.88 49.17 49.73 92.83 49.59 2 0 1000.00 -999 ? >VAL^C 175 50.43 90.41 57.03 49.70 88.79 58.40 50.06 89.60 57.72 3 0 1000.00 -999 ? >ASP^C 176 52.04 93.97 59.99 53.65 94.99 61.00 52.85 94.48 60.49 2 0 1000.00 -999 ? >THR.C 177 55.30 90.49 60.06 57.22 89.99 59.20 56.26 90.24 59.63 2 0 1000.00 -999 ? >GLY.C 178 54.95 90.38 63.86 54.35 90.36 63.33 54.65 90.37 63.59 1 0 1000.00 -999 ? >CYH.C 179 51.17 89.87 63.51 50.09 92.40 63.26 50.63 91.14 63.38 2 0 1000.00 -999 ? >LEU^C 180 52.53 85.67 61.45 52.08 84.04 60.04 52.31 84.86 60.75 3 0 1000.00 -999 ? >VAL^C 181 50.78 83.94 65.50 49.25 84.10 67.07 50.01 84.02 66.28 3 0 1000.00 -999 ? >ALA^C 182 50.46 80.44 64.01 49.75 79.58 65.09 50.11 80.01 64.55 2 0 1000.00 -999 ? >PHE^C 183 51.59 79.33 59.27 54.34 79.33 58.78 52.97 79.33 59.03 3 0 1000.00 -999 ? >THR.C 184 49.04 74.96 59.57 46.89 74.97 59.28 47.96 74.97 59.42 2 0 1000.00 -999 ? >ASP.C 185 50.92 71.59 56.60 52.69 70.91 57.54 51.81 71.25 57.07 2 0 1000.00 -999 ? >GLY.C 186 49.76 74.03 53.10 50.11 74.59 53.59 49.94 74.31 53.35 1 0 1000.00 -999 ? >ILE^C 187 50.11 78.35 54.95 49.09 79.25 54.53 49.60 78.80 54.74 3 0 1000.00 -999 ? >ASP^C 188 53.91 79.24 50.60 55.95 79.22 50.06 54.93 79.23 50.33 2 0 1000.00 -999 ? >TYR^C 189 56.33 81.22 55.85 58.29 79.44 56.81 57.31 80.33 56.33 3 0 1000.00 -999 ? >ASP^C 190 58.88 84.44 51.80 58.21 85.66 50.24 58.55 85.05 51.02 2 0 1000.00 -999 ? >VAL^C 191 59.22 87.96 54.63 59.68 88.07 56.78 59.45 88.02 55.71 3 0 1000.00 -999 ? >GLN^C 192 59.59 90.04 50.31 61.63 89.40 50.12 60.61 89.72 50.22 2 0 1000.00 -999 ? >LEU^C 193 62.47 95.19 53.55 62.75 97.18 54.41 62.61 96.19 53.98 3 0 1000.00 -999 ? >ALA.C 194 58.25 96.45 51.73 56.87 96.67 52.33 57.56 96.56 52.03 2 0 1000.00 -999 ? >GLY.C 195 58.43 100.12 50.65 58.77 99.81 51.33 58.60 99.96 50.99 1 0 1000.00 -999 ? >GLY.C 206 60.19 100.36 57.94 59.64 100.25 58.55 59.92 100.30 58.24 1 0 1000.00 -999 ? >LEU.C 207 56.51 98.34 55.76 54.42 97.82 55.89 55.47 98.08 55.82 3 0 1000.00 -999 ? >LEU^C 208 58.96 93.58 58.46 61.00 94.46 58.30 59.98 94.02 58.38 3 0 1000.00 -999 ? >LEU^C 209 55.22 92.65 53.94 53.76 94.28 53.91 54.49 93.47 53.92 3 0 1000.00 -999 ? >THR^C 210 54.89 88.43 55.36 55.33 87.02 56.98 55.11 87.73 56.17 2 0 1000.00 -999 ? >THR^C 211 53.10 86.99 52.33 53.15 87.72 50.32 53.12 87.35 51.33 2 0 1000.00 -999 ? >LEU^C 212 50.12 83.81 54.19 50.88 83.48 56.20 50.50 83.64 55.19 3 0 1000.00 -999 ? >LYS^C 213 49.74 81.73 50.09 54.09 83.30 49.43 51.92 82.51 49.76 2 0 1000.00 -999 ? >GLY^C 214 47.89 78.39 49.94 47.43 78.89 50.33 47.66 78.64 50.14 1 0 1000.00 -999 ? >SER.C 215 45.69 76.14 52.05 46.91 74.79 53.65 46.30 75.46 52.85 2 0 1000.00 -999 ? >GLY.C 216 44.77 76.11 55.64 44.94 76.80 55.48 44.85 76.45 55.56 1 0 1000.00 -999 ? >THR^C 217 44.34 78.11 58.80 43.02 77.28 60.30 43.68 77.69 59.55 2 0 1000.00 -999 ? >VAL^C 218 46.16 81.22 59.84 47.16 82.61 58.46 46.66 81.92 59.15 3 0 1000.00 -999 ? >TRP^C 219 46.68 79.49 63.22 43.86 77.92 65.42 45.27 78.71 64.32 3 0 1000.00 -999 ? >LEU^C 220 46.43 87.22 62.32 47.08 87.00 60.25 46.76 87.11 61.29 3 0 1000.00 -999 ? >GLN^C 221 49.74 89.00 67.09 51.22 87.90 68.17 50.48 88.45 67.63 2 0 1000.00 -999 ? >SER.C 222 46.22 92.53 66.49 44.70 92.93 68.35 45.46 92.73 67.42 2 0 1000.00 -999 ? >LEU.C 223 48.26 94.35 70.26 49.25 95.99 71.38 48.76 95.17 70.82 3 0 1000.00 -999 ? >PRO~C 224 52.13 92.53 66.43 51.46 92.03 68.55 51.79 92.28 67.49 3 0 1000.00 -999 ? >PHE~C 225 56.47 91.13 72.91 58.59 91.78 74.56 57.53 91.46 73.74 3 0 1000.00 -999 ? >SER~C 226 57.08 93.27 68.72 56.18 92.19 66.74 56.63 92.73 67.73 2 0 1000.00 -999 ? >ARG~C 227 51.51 97.42 66.46 50.12 96.86 63.77 50.82 97.14 65.11 2 0 1000.00 -999 ? >LEU~C 228 53.44 95.73 72.66 52.79 96.27 74.74 53.11 96.00 73.70 3 0 1000.00 -999 ? >ALA~C 229 57.72 96.54 72.78 58.56 95.32 72.88 58.14 95.93 72.83 2 0 1000.00 -999 ? >GLY~C 230 59.01 98.38 69.68 58.48 98.63 70.24 58.74 98.51 69.96 1 0 1000.00 -999 ? >ARG~C 231 55.10 101.83 67.07 53.46 100.50 64.79 54.28 101.16 65.93 2 0 1000.00 -999 ? >ILE~C 232 56.96 100.58 74.81 56.28 100.20 75.94 56.62 100.39 75.37 3 0 1000.00 -999 ? >TYR~C 233 63.31 100.64 72.20 66.01 101.25 71.77 64.66 100.94 71.98 3 0 1000.00 -999 ? >ASP~C 234 61.75 103.90 69.35 59.97 103.62 68.32 60.86 103.76 68.84 2 0 1000.00 -999 ? >ALA~C 235 58.92 106.36 72.55 57.48 106.03 72.77 58.20 106.20 72.66 2 0 1000.00 -999 ? >THR~C 236 60.91 106.52 75.79 60.54 104.68 76.89 60.72 105.60 76.34 2 0 1000.00 -999 ? >PHE.C 237 65.03 105.72 73.18 66.75 103.79 74.27 65.89 104.76 73.72 3 0 1000.00 -999 ? >ALA.D 2 24.49 83.81 109.74 25.94 84.14 110.15 25.22 83.97 109.94 2 0 1000.00 -999 ? >SER.D 3 24.23 83.37 105.94 22.40 84.92 105.53 23.31 84.15 105.74 2 0 1000.00 -999 ? >HIS.D 4 25.71 79.20 103.06 25.12 77.43 104.02 25.41 78.32 103.54 3 0 1000.00 -999 ? >GLU.D 5 30.03 84.88 104.37 31.72 85.16 105.74 30.87 85.02 105.05 2 0 1000.00 -999 ? >LEU.D 6 27.09 83.96 97.76 25.70 82.31 98.05 26.40 83.13 97.91 3 0 1000.00 -999 ? >ASP^D 7 31.91 84.67 95.12 33.26 85.40 96.62 32.59 85.03 95.87 2 0 1000.00 -999 ? >TYR^D 8 27.77 88.03 92.74 28.06 90.72 93.45 27.92 89.37 93.10 3 0 1000.00 -999 ? >ARG^D 9 31.45 84.98 86.24 31.78 84.25 83.26 31.61 84.62 84.75 2 0 1000.00 -999 ? >ILE^D 10 26.27 90.77 87.16 25.55 91.50 87.78 25.91 91.13 87.47 3 0 1000.00 -999 ? >LEU^D 11 26.61 87.13 82.63 27.78 85.37 83.26 27.20 86.25 82.94 3 0 1000.00 -999 ? >GLY.D 12 25.50 90.70 80.11 25.93 91.10 80.71 25.72 90.90 80.41 1 0 1000.00 -999 ? >GLU.D 13 26.99 94.61 77.64 28.55 94.74 79.09 27.77 94.67 78.36 2 0 1000.00 -999 ? >SER.D 14 21.58 95.39 79.52 21.54 97.48 78.34 21.56 96.44 78.93 2 0 1000.00 -999 ? >MET?D 15 19.96 92.02 79.84 17.49 91.58 76.42 18.72 91.80 78.13 2 0 1000.00 -999 ? >GLN.D 16 23.01 92.57 83.21 23.63 94.05 84.59 23.32 93.31 83.90 2 0 1000.00 -999 ? >THR^D 17 21.98 87.03 84.39 21.71 85.23 83.22 21.85 86.13 83.81 2 0 1000.00 -999 ? >VAL^D 18 23.60 86.33 87.72 23.18 86.49 89.87 23.39 86.41 88.79 3 0 1000.00 -999 ? >GLU^D 19 27.85 81.85 87.05 29.82 81.82 86.26 28.83 81.84 86.66 2 0 1000.00 -999 ? >ILE^D 20 25.33 81.85 92.52 25.09 82.98 93.45 25.21 82.41 92.98 3 0 1000.00 -999 ? >GLU^D 21 32.39 80.65 92.79 34.10 81.70 92.16 33.25 81.18 92.48 2 0 1000.00 -999 ? >LEU^D 22 28.08 77.25 95.50 26.00 77.99 95.66 27.04 77.62 95.58 3 0 1000.00 -999 ? >ASP.D 23 32.91 77.36 98.60 34.04 78.83 97.63 33.47 78.10 98.11 2 0 1000.00 -999 ? >PRO.D 24 33.93 72.64 98.38 31.95 73.66 98.73 32.94 73.15 98.55 3 0 1000.00 -999 ? >GLY.D 25 28.42 72.92 100.94 28.65 73.50 100.51 28.54 73.21 100.72 1 0 1000.00 -999 ? >GLU.D 26 29.39 78.31 100.54 30.58 79.71 99.44 29.99 79.01 99.99 2 0 1000.00 -999 ? >THR^D 27 23.82 77.08 99.14 22.34 76.08 100.45 23.08 76.58 99.79 2 0 1000.00 -999 ? >VAL^D 28 21.82 79.64 97.17 22.10 80.38 95.08 21.96 80.01 96.12 3 0 1000.00 -999 ? >ILE^D 29 17.14 80.04 98.47 17.02 80.47 99.90 17.08 80.26 99.18 3 0 1000.00 -999 ? >ALA^D 30 15.89 80.80 94.12 16.78 80.74 92.89 16.33 80.77 93.50 2 0 1000.00 -999 ? >GLU.D 31 10.81 82.21 93.38 9.34 81.24 94.57 10.07 81.73 93.97 2 0 1000.00 -999 ? >ALA.D 32 12.13 77.08 90.73 10.74 76.38 90.63 11.43 76.73 90.68 2 0 1000.00 -999 ? >GLY.D 33 12.40 78.13 87.06 12.68 78.65 87.56 12.54 78.39 87.31 1 0 1000.00 -999 ? >ALA.D 34 14.95 80.96 87.36 15.16 81.78 88.62 15.06 81.37 87.99 2 0 1000.00 -999 ? >MET?D 35 17.92 78.60 86.90 19.49 75.43 85.84 18.70 77.01 86.37 2 0 1000.00 -999 ? >ASN.D 36 20.34 80.03 83.02 19.04 81.71 83.09 19.69 80.87 83.05 2 0 1000.00 -999 ? >TYR.D 37 24.56 77.83 83.08 26.26 80.03 83.45 25.41 78.93 83.26 3 0 1000.00 -999 ? >MET?D 38 24.68 74.65 86.68 21.54 72.50 88.57 23.11 73.58 87.62 2 0 1000.00 -999 ? >THR.D 39 28.09 72.98 86.88 29.42 74.51 87.52 28.76 73.74 87.20 2 0 1000.00 -999 ? >GLY.D 40 28.78 69.27 87.60 28.62 69.81 88.17 28.70 69.54 87.89 1 0 1000.00 -999 ? >ASP.D 41 29.85 69.10 92.17 31.25 67.64 91.41 30.55 68.37 91.79 2 0 1000.00 -999 ? >ILE^D 42 25.12 72.67 91.08 25.16 73.93 91.88 25.14 73.30 91.48 3 0 1000.00 -999 ? >ARG^D 43 23.28 66.55 92.35 25.97 66.16 90.86 24.62 66.35 91.61 2 0 1000.00 -999 ? >PHE^D 44 18.02 71.25 91.89 17.23 70.00 89.53 17.63 70.62 90.71 3 0 1000.00 -999 ? >THR^D 45 15.90 70.19 96.28 16.88 69.39 98.08 16.39 69.79 97.18 2 0 1000.00 -999 ? >ALA.D 46 12.52 71.98 96.20 11.32 71.57 95.36 11.92 71.78 95.78 2 0 1000.00 -999 ? >ARG.D 47 12.07 74.47 100.73 11.53 77.48 101.37 11.80 75.98 101.05 2 0 1000.00 -999 ? >MET?D 75 11.84 77.78 96.90 13.01 81.75 97.58 12.43 79.76 97.24 2 0 1000.00 -999 ? >THR^D 76 14.58 75.56 95.55 14.95 75.11 93.46 14.76 75.34 94.50 2 0 1000.00 -999 ? >HIS^D 77 17.25 75.41 99.71 16.06 76.47 101.07 16.66 75.94 100.39 3 0 1000.00 -999 ? >PHE^D 78 19.97 75.83 92.88 17.73 75.93 91.21 18.85 75.88 92.04 3 0 1000.00 -999 ? >THR^D 79 24.09 73.50 96.75 23.57 72.39 98.64 23.83 72.94 97.69 2 0 1000.00 -999 ? >ASN^D 80 28.88 73.53 96.02 30.66 72.64 95.19 29.77 73.08 95.61 2 0 1000.00 -999 ? >GLU.D 81 25.05 68.35 97.04 24.91 68.57 99.16 24.98 68.46 98.10 2 0 1000.00 -999 ? >GLY.D 82 31.10 68.24 95.47 31.05 68.98 95.86 31.07 68.61 95.66 1 0 1000.00 -999 ? >GLN.D 83 36.30 68.36 94.42 38.46 68.23 94.63 37.38 68.29 94.53 2 0 1000.00 -999 ? >GLY.D 84 35.88 73.24 94.13 35.16 73.23 94.52 35.52 73.24 94.32 1 0 1000.00 -999 ? >LYS.D 85 34.21 76.41 92.98 37.74 79.77 94.29 35.97 78.09 93.64 2 0 1000.00 -999 ? >GLN^D 86 31.08 72.93 92.08 31.54 71.79 90.33 31.31 72.36 91.21 2 0 1000.00 -999 ? >HIS^D 87 30.68 78.89 88.70 32.59 79.56 89.25 31.64 79.23 88.97 3 0 1000.00 -999 ? >VAL^D 88 24.76 78.23 89.20 23.53 77.29 90.81 24.15 77.76 90.00 3 0 1000.00 -999 ? >ALA^D 89 23.23 80.92 86.97 23.78 81.10 85.56 23.51 81.01 86.27 2 0 1000.00 -999 ? >PHE^D 90 19.78 81.79 89.80 20.41 79.63 91.48 20.09 80.71 90.64 3 0 1000.00 -999 ? >ALA.D 91 17.71 85.08 85.36 18.04 85.11 83.85 17.88 85.09 84.61 2 0 1000.00 -999 ? >ALA.D 92 14.22 86.59 85.68 14.01 88.04 86.12 14.12 87.32 85.90 2 0 1000.00 -999 ? >PRO.D 93 10.20 85.26 85.19 11.83 85.97 83.74 11.02 85.61 84.47 3 0 1000.00 -999 ? >TYR.D 94 10.54 90.57 83.55 10.40 91.13 86.29 10.47 90.85 84.92 3 0 1000.00 -999 ? >PRO.D 95 12.73 91.68 78.32 13.73 91.28 80.30 13.23 91.48 79.31 3 0 1000.00 -999 ? >GLY^D 96 16.49 93.67 82.51 16.91 93.03 82.39 16.70 93.35 82.45 1 0 1000.00 -999 ? >SER^D 97 19.41 94.13 84.86 19.50 96.37 85.70 19.45 95.25 85.28 2 0 1000.00 -999 ? >VAL^D 98 20.49 92.39 88.04 20.52 90.25 88.25 20.50 91.32 88.15 3 0 1000.00 -999 ? >VAL^D 99 21.45 94.18 91.27 20.41 96.12 91.69 20.93 95.15 91.48 3 0 1000.00 -999 ? >ALA^D 100 23.39 92.55 94.15 24.85 92.14 94.10 24.12 92.35 94.13 2 0 1000.00 -999 ? >VAL^D 101 22.38 93.84 97.51 20.76 95.37 97.78 21.57 94.61 97.65 3 0 1000.00 -999 ? >ASP^D 102 25.89 93.62 100.75 26.97 92.71 102.35 26.43 93.16 101.55 2 0 1000.00 -999 ? >LEU.D 103 21.22 91.72 103.85 19.40 91.09 102.73 20.31 91.41 103.29 3 0 1000.00 -999 ? >ASP~D 104 26.05 93.75 105.95 26.47 92.28 107.44 26.26 93.01 106.70 2 0 1000.00 -999 ? >ASP~D 105 25.10 97.48 102.35 27.07 96.89 102.01 26.09 97.19 102.18 2 0 1000.00 -999 ? >VAL~D 106 21.05 98.08 104.61 20.29 97.38 102.57 20.67 97.73 103.59 3 0 1000.00 -999 ? >GLY~D 107 20.63 97.23 108.32 20.59 96.69 107.72 20.61 96.96 108.02 1 0 1000.00 -999 ? >GLY.D 108 19.93 93.55 107.66 19.48 94.13 107.34 19.71 93.84 107.50 1 0 1000.00 -999 ? >ARG^D 109 13.12 94.36 107.68 14.05 95.34 110.45 13.58 94.85 109.07 2 0 1000.00 -999 ? >LEU^D 110 16.30 94.52 101.19 16.65 95.59 99.36 16.48 95.05 100.27 3 0 1000.00 -999 ? >PHE^D 111 10.76 96.58 103.02 10.69 96.79 105.82 10.73 96.68 104.42 3 0 1000.00 -999 ? >CYH^D 112 11.38 93.76 97.65 12.79 92.02 96.06 12.09 92.89 96.86 2 0 1000.00 -999 ? >GLN^D 113 7.17 93.61 92.98 6.66 94.64 91.17 6.91 94.13 92.08 2 0 1000.00 -999 ? >LYS.D 114 7.95 89.69 94.91 6.67 84.59 95.35 7.31 87.14 95.13 2 0 1000.00 -999 ? >ASP.D 115 7.65 89.83 90.01 5.87 88.77 89.84 6.76 89.30 89.92 2 0 1000.00 -999 ? >SER.D 116 11.77 91.37 91.39 10.89 93.71 91.26 11.33 92.54 91.33 2 0 1000.00 -999 ? >PHE^D 117 13.47 87.04 95.67 15.26 85.26 96.98 14.37 86.15 96.32 3 0 1000.00 -999 ? >LEU^D 118 16.96 87.25 91.07 17.35 86.15 89.15 17.16 86.70 90.11 3 0 1000.00 -999 ? >CYH^D 119 17.94 84.63 94.45 20.34 84.72 92.97 19.14 84.68 93.71 2 0 1000.00 -999 ? >ALA^D 120 19.58 84.88 97.86 18.51 85.28 98.83 19.04 85.08 98.34 2 0 1000.00 -999 ? >ALA^D 121 22.32 83.41 100.13 23.22 84.25 101.00 22.77 83.83 100.57 2 0 1000.00 -999 ? >TYR.D 122 20.98 78.14 103.19 19.83 76.61 105.23 20.40 77.38 104.21 3 0 1000.00 -999 ? >GLY.D 123 20.19 81.88 105.57 19.81 82.17 104.92 20.00 82.03 105.25 1 0 1000.00 -999 ? >THR.D 124 18.23 84.83 104.14 18.37 86.06 102.35 18.30 85.45 103.25 2 0 1000.00 -999 ? >ARG^D 125 16.30 84.82 109.00 17.83 87.24 110.12 17.06 86.03 109.56 2 0 1000.00 -999 ? >VAL^D 126 12.08 85.60 103.22 12.36 85.04 101.08 12.22 85.32 102.15 3 0 1000.00 -999 ? >GLY^D 127 8.72 86.78 104.61 8.98 87.24 103.93 8.85 87.01 104.27 1 0 1000.00 -999 ? >ILE^D 128 4.23 88.03 103.11 4.18 88.09 101.68 4.20 88.06 102.40 3 0 1000.00 -999 ? >ALA^D 129 5.77 92.36 104.26 6.95 93.27 103.92 6.36 92.82 104.09 2 0 1000.00 -999 ? >PHE^D 130 2.27 96.00 101.27 0.36 97.77 100.21 1.32 96.88 100.74 3 0 1000.00 -999 ? >THR^D 131 -0.13 92.59 100.22 -0.43 90.47 99.93 -0.28 91.53 100.08 2 0 1000.00 -999 ? >LYS^D 132 -2.91 94.68 98.59 -4.44 100.64 99.82 -3.68 97.66 99.20 2 0 1000.00 -999 ? >ARG.D 133 -6.50 90.08 95.98 -6.15 87.03 96.01 -6.33 88.56 95.99 2 0 1000.00 -999 ? >LEU.D 134 -6.31 98.13 94.30 -6.28 99.68 95.86 -6.29 98.91 95.08 3 0 1000.00 -999 ? >GLY.D 135 -8.79 95.26 91.22 -8.09 95.62 91.26 -8.44 95.44 91.24 1 0 1000.00 -999 ? >ALA.D 136 -5.94 96.64 88.99 -5.61 98.09 89.37 -5.77 97.36 89.18 2 0 1000.00 -999 ? >GLY.D 137 -2.43 95.21 88.41 -3.03 94.74 88.32 -2.73 94.98 88.36 1 0 1000.00 -999 ? >PHE.D 138 -1.93 92.85 83.99 -4.30 93.32 82.57 -3.11 93.08 83.28 3 0 1000.00 -999 ? >PHE.D 139 1.19 92.95 90.40 1.49 95.74 90.21 1.34 94.35 90.31 3 0 1000.00 -999 ? >GLY.D 140 -0.28 87.05 88.65 -0.78 87.57 88.99 -0.53 87.31 88.82 1 0 1000.00 -999 ? >GLY.D 141 -3.36 87.36 90.82 -2.71 87.42 91.23 -3.03 87.39 91.03 1 0 1000.00 -999 ? >GLU.D 142 -0.91 85.68 94.97 0.15 85.40 93.19 -0.38 85.54 94.08 2 0 1000.00 -999 ? >GLY.D 143 -2.06 91.53 93.79 -1.39 91.01 93.80 -1.73 91.27 93.80 1 0 1000.00 -999 ? >PHE^D 144 2.31 95.71 94.89 4.83 96.79 95.32 3.57 96.25 95.10 3 0 1000.00 -999 ? >ILE^D 145 3.20 90.21 96.99 2.87 88.82 97.44 3.04 89.52 97.22 3 0 1000.00 -999 ? >LEU^D 146 6.36 94.44 99.65 6.79 96.34 98.80 6.57 95.39 99.23 3 0 1000.00 -999 ? >GLN^D 147 8.55 88.36 99.29 9.36 87.03 97.82 8.96 87.69 98.55 2 0 1000.00 -999 ? >LYS^D 148 10.89 91.33 103.39 8.60 89.81 106.75 9.74 90.57 105.07 2 0 1000.00 -999 ? >LEU^D 149 15.13 90.28 101.73 14.25 89.69 99.73 14.69 89.99 100.73 3 0 1000.00 -999 ? >GLU^D 150 14.24 90.39 107.62 13.27 90.32 109.47 13.75 90.35 108.54 2 0 1000.00 -999 ? >GLY.D 151 19.82 88.50 107.24 19.85 89.29 106.98 19.83 88.89 107.11 1 0 1000.00 -999 ? >ASP.D 152 24.32 89.03 107.93 24.74 86.98 108.35 24.53 88.00 108.14 2 0 1000.00 -999 ? >GLY.D 153 24.32 87.84 103.23 23.73 88.41 103.25 24.03 88.12 103.24 1 0 1000.00 -999 ? >LEU^D 154 24.76 88.39 98.58 26.69 89.39 98.20 25.73 88.89 98.39 3 0 1000.00 -999 ? >VAL^D 155 20.42 89.12 97.75 18.54 89.05 98.79 19.48 89.08 98.27 3 0 1000.00 -999 ? >PHE^D 156 21.95 88.23 93.67 24.54 87.74 94.62 23.25 87.99 94.15 3 0 1000.00 -999 ? >VAL^D 157 16.96 91.52 92.60 16.69 93.11 94.11 16.82 92.32 93.35 3 0 1000.00 -999 ? >HIS^D 158 15.23 91.07 86.80 15.00 91.17 84.71 15.11 91.12 85.76 3 0 1000.00 -999 ? >ALA^D 159 14.97 95.41 87.48 15.81 96.63 87.75 15.39 96.02 87.61 2 0 1000.00 -999 ? >GLY^D 160 12.89 95.10 84.31 13.31 95.74 84.63 13.10 95.42 84.47 1 0 1000.00 -999 ? >GLY.D 161 14.35 97.43 81.69 14.73 97.08 82.38 14.54 97.25 82.04 1 0 1000.00 -999 ? >THR.D 162 16.89 99.67 83.37 17.80 101.64 82.91 17.35 100.66 83.14 2 0 1000.00 -999 ? >LEU^D 163 18.35 99.28 87.88 18.59 99.85 90.01 18.47 99.57 88.94 3 0 1000.00 -999 ? >ILE^D 164 15.81 104.43 88.36 15.16 105.01 87.57 15.48 104.72 87.96 3 0 1000.00 -999 ? >ARG^D 165 21.51 102.64 94.37 24.46 103.73 94.22 22.99 103.18 94.30 2 0 1000.00 -999 ? >ARG^D 166 14.70 109.02 92.18 15.08 111.93 91.24 14.89 110.48 91.71 2 0 1000.00 -999 ? >GLN^D 167 19.81 108.58 99.63 20.17 106.55 100.21 19.99 107.57 99.92 2 0 1000.00 -999 ? >LEU^D 168 13.95 109.06 99.96 12.46 108.57 98.41 13.21 108.81 99.18 3 0 1000.00 -999 ? >ASN^D 169 17.31 113.23 102.15 18.98 112.03 101.49 18.14 112.63 101.82 2 0 1000.00 -999 ? >GLY^D 170 12.72 113.35 104.09 12.80 113.22 103.30 12.76 113.28 103.69 1 0 1000.00 -999 ? >GLU^D 171 13.27 113.44 99.37 14.79 114.39 98.21 14.03 113.91 98.79 2 0 1000.00 -999 ? >THR^D 172 8.10 112.24 98.94 6.19 113.29 99.14 7.15 112.76 99.04 2 0 1000.00 -999 ? >LEU^D 173 9.53 109.42 95.57 10.68 108.86 93.78 10.10 109.14 94.68 3 0 1000.00 -999 ? >ARG^D 174 2.69 111.85 94.19 3.31 114.45 92.61 3.00 113.15 93.40 2 0 1000.00 -999 ? >VAL^D 175 5.95 105.95 91.52 7.83 104.86 92.06 6.89 105.41 91.79 3 0 1000.00 -999 ? >ASP^D 176 4.16 103.36 87.81 2.85 101.87 87.07 3.50 102.62 87.44 2 0 1000.00 -999 ? >THR.D 177 3.35 100.67 91.63 1.78 100.14 93.02 2.56 100.40 92.32 2 0 1000.00 -999 ? >GLY.D 178 4.82 98.06 89.24 5.15 98.77 89.52 4.98 98.42 89.38 1 0 1000.00 -999 ? >CYH.D 179 7.95 100.25 88.97 7.49 101.78 86.75 7.72 101.02 87.86 2 0 1000.00 -999 ? >LEU^D 180 8.06 100.10 93.82 8.80 100.83 95.83 8.43 100.47 94.83 3 0 1000.00 -999 ? >VAL^D 181 11.68 97.12 92.88 13.35 96.64 91.45 12.51 96.88 92.16 3 0 1000.00 -999 ? >ALA^D 182 12.97 97.52 96.46 14.29 96.68 96.44 13.63 97.10 96.45 2 0 1000.00 -999 ? >PHE^D 183 11.11 100.36 99.92 8.71 99.31 100.89 9.91 99.83 100.41 3 0 1000.00 -999 ? >THR.D 184 15.06 100.16 102.82 16.76 101.50 102.46 15.91 100.83 102.64 2 0 1000.00 -999 ? >ASP.D 185 14.40 100.40 107.66 14.08 98.33 108.06 14.24 99.37 107.86 2 0 1000.00 -999 ? >GLY.D 186 12.89 104.51 107.04 12.49 104.10 106.45 12.69 104.31 106.74 1 0 1000.00 -999 ? >ILE^D 187 11.06 104.20 102.66 11.57 104.31 101.35 11.32 104.26 102.00 3 0 1000.00 -999 ? >ASP^D 188 6.00 106.00 105.17 6.49 106.13 107.22 6.24 106.07 106.20 2 0 1000.00 -999 ? >TYR^D 189 5.37 101.22 101.56 5.10 98.80 102.86 5.23 100.01 102.21 3 0 1000.00 -999 ? >ASP^D 190 0.62 104.93 100.60 -1.44 105.07 100.73 -0.41 105.00 100.67 2 0 1000.00 -999 ? >VAL^D 191 -0.55 101.74 97.34 0.08 99.81 96.40 -0.23 100.77 96.87 3 0 1000.00 -999 ? >GLN^D 192 -3.77 105.32 97.84 -5.09 104.15 99.09 -4.43 104.73 98.46 2 0 1000.00 -999 ? >LEU^D 193 -7.05 103.30 92.24 -7.88 101.45 91.42 -7.47 102.38 91.83 3 0 1000.00 -999 ? >ALA.D 194 -4.48 107.08 91.12 -3.34 107.35 90.18 -3.91 107.21 90.65 2 0 1000.00 -999 ? >GLY.D 195 -7.46 109.45 91.01 -6.66 109.60 90.71 -7.06 109.53 90.86 1 0 1000.00 -999 ? >GLY.D 196 -7.34 111.42 87.77 -6.78 110.91 88.05 -7.06 111.16 87.91 1 0 1000.00 -999 ? >LEU.D 197 -3.10 109.37 87.05 -0.99 109.79 86.63 -2.04 109.58 86.84 3 0 1000.00 -999 ? >LYS.D 198 -5.92 108.15 83.37 -11.48 107.12 82.89 -8.70 107.64 83.13 2 0 1000.00 -999 ? >SER.D 199 -4.38 106.01 80.66 -2.52 104.55 80.06 -3.45 105.28 80.36 2 0 1000.00 -999 ? >MET?D 200 -6.02 104.47 77.57 -8.42 106.60 77.72 -7.22 105.53 77.65 2 0 1000.00 -999 ? >LEU.D 201 -1.80 102.22 77.54 -0.60 103.23 76.04 -1.20 102.72 76.79 3 0 1000.00 -999 ? >PHE.D 202 -2.45 99.72 81.05 0.28 100.23 80.75 -1.09 99.98 80.90 3 0 1000.00 -999 ? >GLY.D 203 -8.44 99.34 79.12 -8.09 99.83 79.63 -8.26 99.59 79.37 1 0 1000.00 -999 ? >GLY.D 204 -9.11 101.86 81.93 -8.93 101.10 82.06 -9.02 101.48 81.99 1 0 1000.00 -999 ? >GLU.D 205 -8.06 97.21 83.94 -7.54 95.30 84.66 -7.80 96.25 84.30 2 0 1000.00 -999 ? >GLY.D 206 -6.99 102.45 86.74 -6.51 101.88 86.32 -6.75 102.16 86.53 1 0 1000.00 -999 ? >LEU.D 207 -2.50 104.39 86.82 -2.14 104.52 84.63 -2.32 104.45 85.72 3 0 1000.00 -999 ? >LEU^D 208 -1.41 100.72 91.00 -2.58 99.05 91.69 -2.00 99.89 91.35 3 0 1000.00 -999 ? >LEU^D 209 -0.26 106.30 92.28 0.84 108.17 92.03 0.29 107.23 92.15 3 0 1000.00 -999 ? >THR^D 210 2.64 104.15 95.19 3.72 102.37 95.75 3.18 103.26 95.47 2 0 1000.00 -999 ? >THR^D 211 3.54 107.06 97.39 2.31 108.79 97.69 2.92 107.93 97.54 2 0 1000.00 -999 ? >LEU^D 212 8.07 106.28 98.43 8.35 104.35 97.48 8.21 105.31 97.95 3 0 1000.00 -999 ? >LYS^D 213 8.14 109.17 101.92 3.03 110.20 102.91 5.59 109.69 102.41 2 0 1000.00 -999 ? >GLY^D 214 10.92 109.34 104.48 11.20 109.47 103.67 11.06 109.40 104.08 1 0 1000.00 -999 ? >SER^D 215 14.61 108.58 104.32 15.01 110.65 105.55 14.81 109.61 104.94 2 0 1000.00 -999 ? >GLY^D 216 16.40 105.61 102.72 16.26 106.23 102.13 16.33 105.92 102.42 1 0 1000.00 -999 ? >THR^D 217 17.18 104.13 99.30 19.23 103.62 98.72 18.20 103.87 99.01 2 0 1000.00 -999 ? >VAL^D 218 14.68 103.06 96.66 13.20 104.71 96.61 13.94 103.89 96.63 3 0 1000.00 -999 ? >TRP^D 219 16.07 99.59 96.49 19.94 99.42 96.45 18.00 99.51 96.47 3 0 1000.00 -999 ? >LEU^D 220 12.64 102.87 90.22 11.68 104.28 91.59 12.16 103.57 90.91 3 0 1000.00 -999 ? >GLN^D 221 10.89 97.95 87.81 10.33 95.92 87.87 10.61 96.93 87.84 2 0 1000.00 -999 ? >SER.D 222 11.61 101.29 83.97 13.40 100.87 82.43 12.50 101.08 83.21 2 0 1000.00 -999 ? >LEU.D 223 10.57 97.70 81.15 9.23 97.08 79.49 9.90 97.39 80.32 3 0 1000.00 -999 ? >PRO~D 224 7.10 98.61 85.67 8.18 96.94 84.71 7.64 97.77 85.19 3 0 1000.00 -999 ? >PHE~D 225 6.59 90.50 84.27 5.79 88.19 82.94 6.19 89.35 83.61 3 0 1000.00 -999 ? >SER~D 226 3.15 94.00 85.03 3.68 95.53 86.78 3.41 94.76 85.90 2 0 1000.00 -999 ? >ARG~D 227 4.86 100.27 81.77 5.65 102.84 83.19 5.26 101.56 82.48 2 0 1000.00 -999 ? >LEU~D 228 5.93 93.88 79.84 7.11 92.96 78.17 6.52 93.42 79.00 3 0 1000.00 -999 ? >ALA~D 229 1.97 91.99 80.50 1.94 91.09 81.73 1.95 91.54 81.12 2 0 1000.00 -999 ? >GLY~D 230 -0.91 94.39 80.93 -0.40 94.36 80.35 -0.65 94.38 80.64 1 0 1000.00 -999 ? >ARG~D 231 0.04 99.12 76.06 -1.73 99.40 73.54 -0.84 99.26 74.80 2 0 1000.00 -999 ? >ILE~D 232 1.20 91.99 75.92 2.24 91.14 75.55 1.72 91.57 75.74 3 0 1000.00 -999 ? >TYR~D 233 -4.70 91.18 79.03 -7.27 90.21 79.53 -5.99 90.69 79.28 3 0 1000.00 -999 ? >ASP~D 234 -4.44 96.59 76.88 -5.66 98.05 76.00 -5.05 97.32 76.44 2 0 1000.00 -999 ? >ALA~D 235 -3.59 95.18 72.70 -2.17 95.61 72.30 -2.88 95.40 72.50 2 0 1000.00 -999 ? >THR~D 236 -4.28 91.54 71.92 -2.30 90.72 72.31 -3.29 91.13 72.12 2 0 1000.00 -999 ? >PHE.D 237 -6.97 89.37 75.08 -5.39 87.22 75.99 -6.18 88.30 75.54 3 0 1000.00 -999 ? >SER.E 3 7.27 125.78 73.51 7.20 123.59 72.39 7.23 124.68 72.95 2 0 1000.00 -999 ? >HIS.E 4 7.32 124.91 78.48 5.63 125.66 79.49 6.47 125.29 78.99 3 0 1000.00 -999 ? >GLU.E 5 13.56 126.43 75.61 15.14 127.41 74.64 14.35 126.92 75.13 2 0 1000.00 -999 ? >LEU.E 6 12.15 119.79 78.04 10.24 119.94 79.05 11.20 119.86 78.55 3 0 1000.00 -999 ? >ASP^E 7 16.79 120.21 81.37 17.61 122.11 80.95 17.20 121.16 81.16 2 0 1000.00 -999 ? >TYR^E 8 16.23 115.33 77.95 17.72 115.25 75.59 16.98 115.29 76.77 3 0 1000.00 -999 ? >ARG^E 9 19.64 112.42 84.48 20.08 110.83 87.07 19.86 111.62 85.77 2 0 1000.00 -999 ? >ILE^E 10 18.13 109.43 77.47 17.68 109.29 76.15 17.91 109.36 76.81 3 0 1000.00 -999 ? >LEU^E 11 18.09 106.57 82.80 18.18 108.44 83.97 18.13 107.50 83.39 3 0 1000.00 -999 ? >GLY.E 12 20.06 103.22 80.61 20.35 103.81 80.17 20.21 103.52 80.39 1 0 1000.00 -999 ? >GLU.E 13 23.78 100.93 79.23 25.51 101.89 78.52 24.65 101.41 78.87 2 0 1000.00 -999 ? >SER.E 14 19.66 99.07 75.56 20.70 97.52 74.06 20.18 98.29 74.81 2 0 1000.00 -999 ? >MET?E 15 16.44 99.63 77.49 15.13 95.69 78.49 15.78 97.66 77.99 2 0 1000.00 -999 ? >GLN.E 16 17.91 103.81 76.87 18.92 104.64 75.19 18.41 104.23 76.03 2 0 1000.00 -999 ? >THR^E 17 13.72 105.75 80.12 13.51 105.92 82.26 13.62 105.84 81.19 2 0 1000.00 -999 ? >VAL^E 18 13.72 109.56 79.84 12.68 111.07 78.49 13.20 110.32 79.17 3 0 1000.00 -999 ? >GLU^E 19 14.50 112.23 85.30 16.12 112.23 86.65 15.31 112.23 85.97 2 0 1000.00 -999 ? >ILE^E 20 11.02 115.31 81.76 11.18 115.79 80.35 11.10 115.55 81.05 3 0 1000.00 -999 ? >GLU^E 21 15.38 119.37 85.61 17.43 119.19 86.10 16.41 119.28 85.85 2 0 1000.00 -999 ? >LEU^E 22 9.55 120.39 85.10 8.21 119.39 83.68 8.88 119.89 84.39 3 0 1000.00 -999 ? >ASP.E 23 12.36 125.41 86.00 14.16 124.77 85.05 13.26 125.09 85.53 2 0 1000.00 -999 ? >PRO.E 24 10.25 126.65 90.07 9.37 125.68 88.25 9.81 126.17 89.16 3 0 1000.00 -999 ? >GLY.E 25 5.75 126.29 86.08 6.28 125.78 85.96 6.02 126.04 86.02 1 0 1000.00 -999 ? >GLU.E 26 9.63 124.86 82.47 11.72 124.31 82.20 10.68 124.58 82.33 2 0 1000.00 -999 ? >THR^E 27 5.13 121.34 81.75 2.98 121.58 81.49 4.05 121.46 81.62 2 0 1000.00 -999 ? >VAL^E 28 5.76 118.14 79.82 7.08 116.44 80.27 6.42 117.29 80.04 3 0 1000.00 -999 ? >ILE^E 29 2.25 116.75 76.93 2.05 117.74 75.80 2.15 117.25 76.37 3 0 1000.00 -999 ? >ALA^E 30 2.79 112.20 77.89 3.82 111.68 78.91 3.30 111.94 78.40 2 0 1000.00 -999 ? >GLU.E 31 -0.69 107.30 76.75 -2.10 106.63 78.20 -1.40 106.96 77.47 2 0 1000.00 -999 ? >ALA.E 32 -0.03 108.79 81.93 -1.36 109.00 82.65 -0.70 108.89 82.29 2 0 1000.00 -999 ? >GLY.E 33 0.63 105.04 81.35 1.15 105.63 81.21 0.89 105.33 81.28 1 0 1000.00 -999 ? >ALA.E 34 4.26 105.82 80.49 4.65 106.56 79.22 4.45 106.19 79.86 2 0 1000.00 -999 ? >MET?E 35 5.03 107.59 83.75 4.65 108.30 87.43 4.84 107.94 85.59 2 0 1000.00 -999 ? >ASN.E 36 8.98 105.52 85.78 9.36 104.45 83.97 9.17 104.99 84.87 2 0 1000.00 -999 ? >TYR.E 37 10.58 108.18 89.06 12.99 108.72 87.75 11.78 108.45 88.40 3 0 1000.00 -999 ? >MET?E 38 7.51 111.92 89.83 3.28 112.35 88.92 5.39 112.13 89.37 2 0 1000.00 -999 ? >THR.E 39 9.15 113.97 92.55 10.91 114.81 91.63 10.03 114.39 92.09 2 0 1000.00 -999 ? >GLY.E 40 7.10 115.77 95.18 7.16 116.08 94.48 7.13 115.93 94.83 1 0 1000.00 -999 ? >ASP.E 41 6.42 120.23 93.69 7.15 120.49 95.68 6.79 120.36 94.69 2 0 1000.00 -999 ? >ILE^E 42 5.27 116.26 89.28 5.92 116.75 87.98 5.59 116.51 88.63 3 0 1000.00 -999 ? >ARG^E 43 -0.08 118.39 92.58 1.61 117.67 95.06 0.77 118.03 93.82 2 0 1000.00 -999 ? >PHE^E 44 -1.17 114.46 87.19 -1.88 112.84 89.36 -1.52 113.65 88.28 3 0 1000.00 -999 ? >THR^E 45 -4.12 117.73 84.36 -3.90 119.85 84.17 -4.01 118.79 84.26 2 0 1000.00 -999 ? >ALA^E 46 -5.68 115.95 81.42 -6.57 114.74 81.75 -6.13 115.34 81.58 2 0 1000.00 -999 ? >ARG.E 47 -5.99 119.21 75.36 -4.21 121.73 75.60 -5.10 120.47 75.48 2 0 1000.00 -999 ? >MET?E 48 -9.78 115.36 77.22 -10.52 114.65 80.49 -10.15 115.01 78.86 2 0 1000.00 -999 ? >GLY.E 49 -10.85 113.63 74.00 -10.22 113.31 74.40 -10.54 113.47 74.20 1 0 1000.00 -999 ? >SER.E 72 -11.46 109.83 76.52 -12.69 109.69 78.64 -12.07 109.76 77.58 2 0 1000.00 -999 ? >VAL.E 73 -8.09 111.11 77.94 -7.06 111.40 79.88 -7.58 111.25 78.91 3 0 1000.00 -999 ? >PHE.E 74 -5.31 113.44 72.95 -3.48 113.95 70.86 -4.39 113.70 71.91 3 0 1000.00 -999 ? >MET?E 75 -2.76 113.35 76.89 0.26 113.32 75.06 -1.25 113.34 75.97 2 0 1000.00 -999 ? >THR^E 76 -1.74 114.09 80.46 -1.88 112.82 82.22 -1.81 113.46 81.34 2 0 1000.00 -999 ? >HIS^E 77 -1.00 118.92 79.52 -1.62 119.37 77.56 -1.31 119.15 78.54 3 0 1000.00 -999 ? >PHE^E 78 3.07 114.51 83.84 1.88 111.99 83.64 2.47 113.25 83.74 3 0 1000.00 -999 ? >THR^E 79 3.59 120.27 85.76 2.29 121.92 85.12 2.94 121.09 85.44 2 0 1000.00 -999 ? >ASN^E 80 7.49 121.86 88.03 8.57 122.34 89.81 8.03 122.10 88.92 2 0 1000.00 -999 ? >GLU.E 81 1.53 122.68 89.54 -0.56 122.46 89.66 0.49 122.57 89.60 2 0 1000.00 -999 ? >GLY.E 82 6.33 124.01 93.35 6.65 124.19 92.66 6.49 124.10 93.01 1 0 1000.00 -999 ? >GLN.E 83 9.83 124.13 97.00 11.00 123.05 98.46 10.41 123.59 97.73 2 0 1000.00 -999 ? >GLY.E 84 12.96 124.11 92.42 12.33 123.54 92.30 12.65 123.83 92.36 1 0 1000.00 -999 ? >LYS.E 85 14.12 121.39 90.04 18.88 122.95 87.65 16.50 122.17 88.84 2 0 1000.00 -999 ? >GLN^E 86 9.73 119.83 91.18 10.02 118.74 92.97 9.88 119.28 92.08 2 0 1000.00 -999 ? >HIS^E 87 14.12 115.51 88.09 15.88 116.65 87.91 15.00 116.08 88.00 3 0 1000.00 -999 ? >VAL^E 88 9.22 112.98 86.07 7.20 113.81 85.49 8.21 113.40 85.78 3 0 1000.00 -999 ? >ALA^E 89 10.33 109.94 84.14 11.44 108.99 84.75 10.89 109.46 84.45 2 0 1000.00 -999 ? >PHE^E 90 7.43 110.25 80.71 6.13 112.49 81.81 6.78 111.37 81.26 3 0 1000.00 -999 ? >ALA.E 91 9.28 104.75 79.59 10.06 103.77 80.54 9.67 104.26 80.07 2 0 1000.00 -999 ? >ALA.E 92 7.48 102.75 76.91 7.95 102.60 75.46 7.72 102.67 76.19 2 0 1000.00 -999 ? >PRO.E 93 3.81 100.29 76.75 5.90 100.15 77.63 4.86 100.22 77.19 3 0 1000.00 -999 ? >TYR.E 94 7.17 98.00 73.54 6.82 100.10 71.78 6.99 99.04 72.66 3 0 1000.00 -999 ? >PRO.E 95 11.42 94.59 75.70 11.17 96.83 75.51 11.29 95.71 75.60 3 0 1000.00 -999 ? >GLY^E 96 13.90 99.44 73.39 13.93 99.71 74.19 13.91 99.57 73.79 1 0 1000.00 -999 ? >SER^E 97 15.68 102.75 73.38 16.81 102.93 71.30 16.24 102.84 72.34 2 0 1000.00 -999 ? >VAL^E 98 14.64 106.40 73.52 13.57 107.16 75.29 14.11 106.78 74.41 3 0 1000.00 -999 ? >VAL^E 99 15.59 109.11 70.96 15.87 108.49 68.86 15.73 108.80 69.91 3 0 1000.00 -999 ? >ALA^E 100 15.19 112.82 71.62 16.04 113.67 72.54 15.61 113.25 72.08 2 0 1000.00 -999 ? >VAL^E 101 14.16 114.58 68.42 13.37 113.50 66.68 13.76 114.04 67.55 3 0 1000.00 -999 ? >ASP^E 102 15.65 119.20 68.29 15.30 121.29 68.67 15.47 120.25 68.48 2 0 1000.00 -999 ? >LEU.E 103 10.03 119.71 66.62 8.47 118.12 66.92 9.25 118.92 66.77 3 0 1000.00 -999 ? >ASP~E 104 14.35 123.43 65.74 13.28 125.15 66.32 13.82 124.29 66.03 2 0 1000.00 -999 ? >ASP~E 105 16.75 118.94 64.21 18.08 119.77 65.67 17.41 119.36 64.94 2 0 1000.00 -999 ? >VAL~E 106 13.07 118.59 61.30 12.67 116.82 62.61 12.87 117.71 61.95 3 0 1000.00 -999 ? >GLY~E 107 11.10 121.57 59.91 10.96 121.15 60.57 11.03 121.36 60.24 1 0 1000.00 -999 ? >GLY.E 108 8.69 121.59 62.88 8.73 120.94 62.43 8.71 121.26 62.65 1 0 1000.00 -999 ? >ARG^E 109 4.29 117.71 59.17 3.92 120.75 58.64 4.10 119.23 58.90 2 0 1000.00 -999 ? >LEU^E 110 8.22 114.28 64.07 9.79 112.77 64.21 9.00 113.52 64.14 3 0 1000.00 -999 ? >PHE^E 111 4.04 112.36 59.80 2.83 114.35 58.20 3.44 113.36 59.00 3 0 1000.00 -999 ? >CYH^E 112 5.32 108.78 64.45 5.09 109.58 67.01 5.21 109.18 65.73 2 0 1000.00 -999 ? >GLN^E 113 3.16 102.97 65.30 3.84 100.97 65.11 3.50 101.97 65.20 2 0 1000.00 -999 ? >LYS.E 114 1.43 106.06 68.17 -4.43 105.53 70.42 -1.50 105.79 69.29 2 0 1000.00 -999 ? >ASP.E 115 3.02 101.76 69.95 1.13 100.71 70.19 2.07 101.24 70.07 2 0 1000.00 -999 ? >SER.E 116 6.33 105.05 69.70 7.09 103.82 67.83 6.71 104.44 68.76 2 0 1000.00 -999 ? >PHE^E 117 4.06 110.56 71.73 3.92 112.96 73.24 3.99 111.76 72.49 3 0 1000.00 -999 ? >LEU^E 118 8.30 108.63 74.86 8.95 107.51 76.71 8.63 108.07 75.79 3 0 1000.00 -999 ? >CYH^E 119 6.54 112.56 75.73 8.92 112.58 77.24 7.73 112.57 76.48 2 0 1000.00 -999 ? >ALA^E 120 7.01 116.05 74.43 6.07 116.12 73.21 6.54 116.09 73.82 2 0 1000.00 -999 ? >ALA^E 121 7.70 119.61 75.44 8.66 120.54 74.68 8.18 120.08 75.06 2 0 1000.00 -999 ? >TYR.E 122 2.94 122.94 77.66 0.52 124.29 77.64 1.73 123.62 77.65 3 0 1000.00 -999 ? >GLY.E 123 3.61 123.53 73.22 3.63 122.70 73.20 3.62 123.11 73.21 1 0 1000.00 -999 ? >THR.E 124 3.92 120.46 71.00 5.37 118.81 70.90 4.64 119.64 70.95 2 0 1000.00 -999 ? >ARG^E 125 0.44 123.51 68.41 1.65 124.02 65.58 1.04 123.76 67.00 2 0 1000.00 -999 ? >VAL^E 126 -0.14 116.30 68.63 0.74 114.81 70.03 0.30 115.55 69.33 3 0 1000.00 -999 ? >GLY^E 127 -2.73 115.09 66.10 -2.06 114.61 66.11 -2.40 114.85 66.10 1 0 1000.00 -999 ? >ILE^E 128 -5.16 111.04 64.74 -4.78 109.92 65.52 -4.97 110.48 65.13 3 0 1000.00 -999 ? >ALA^E 129 -2.41 111.72 60.94 -0.92 111.77 60.71 -1.66 111.75 60.83 2 0 1000.00 -999 ? >PHE^E 130 -2.67 106.69 58.27 -3.13 104.52 56.55 -2.90 105.60 57.41 3 0 1000.00 -999 ? >THR^E 131 -5.63 105.38 61.39 -6.86 105.59 63.14 -6.24 105.48 62.26 2 0 1000.00 -999 ? >LYS^E 132 -6.11 102.06 59.66 -8.92 104.25 57.18 -7.52 103.16 58.42 2 0 1000.00 -999 ? >ARG.E 133 -10.45 98.33 63.22 -11.24 95.71 61.78 -10.85 97.02 62.50 2 0 1000.00 -999 ? >LEU.E 134 -4.25 96.34 58.35 -3.41 98.15 57.43 -3.83 97.25 57.89 3 0 1000.00 -999 ? >GLY.E 135 -6.23 92.15 58.61 -6.60 92.63 59.17 -6.41 92.39 58.89 1 0 1000.00 -999 ? >ALA.E 136 -7.19 89.81 61.44 -7.77 88.41 61.13 -7.48 89.11 61.28 2 0 1000.00 -999 ? >GLY~E 137 -3.72 89.96 63.03 -4.30 90.56 63.08 -4.01 90.26 63.06 1 0 1000.00 -999 ? >PHE~E 138 -0.59 93.78 66.82 -0.28 95.68 68.87 -0.43 94.73 67.84 3 0 1000.00 -999 ? >PHE~E 139 -1.10 96.67 62.77 1.42 97.60 63.63 0.16 97.13 63.20 3 0 1000.00 -999 ? >GLY~E 140 -6.94 94.25 63.03 -6.55 94.53 63.72 -6.74 94.39 63.37 1 0 1000.00 -999 ? >GLY~E 141 -7.32 95.16 66.70 -7.15 95.72 66.08 -7.24 95.44 66.39 1 0 1000.00 -999 ? >GLU.E 142 -5.57 98.73 69.92 -3.87 99.18 71.15 -4.72 98.95 70.53 2 0 1000.00 -999 ? >GLY.E 143 -5.13 99.38 63.97 -4.64 99.46 64.65 -4.89 99.42 64.31 1 0 1000.00 -999 ? >PHE^E 144 0.03 101.49 61.27 2.45 102.83 61.06 1.24 102.16 61.17 3 0 1000.00 -999 ? >ILE^E 145 -2.61 104.92 65.49 -3.57 105.05 66.37 -3.09 104.98 65.93 3 0 1000.00 -999 ? >LEU^E 146 0.55 107.71 61.48 2.25 107.08 60.47 1.40 107.39 60.98 3 0 1000.00 -999 ? >GLN^E 147 -0.32 109.89 67.20 -0.24 110.31 69.28 -0.28 110.10 68.24 2 0 1000.00 -999 ? >LYS^E 148 1.66 114.07 63.81 -1.56 116.88 59.68 0.05 115.48 61.74 2 0 1000.00 -999 ? >LEU^E 149 4.91 115.40 66.82 4.80 113.54 67.92 4.85 114.47 67.37 3 0 1000.00 -999 ? >GLU^E 150 2.56 119.59 63.27 0.93 120.26 62.11 1.74 119.92 62.69 2 0 1000.00 -999 ? >GLY.E 151 5.98 122.65 67.01 6.52 122.24 66.55 6.25 122.44 66.78 1 0 1000.00 -999 ? >ASP.E 152 9.72 125.32 67.82 8.80 126.51 69.33 9.26 125.92 68.57 2 0 1000.00 -999 ? >GLY.E 153 10.43 121.78 71.13 10.35 121.36 70.43 10.39 121.57 70.78 1 0 1000.00 -999 ? >LEU^E 154 12.79 118.10 73.23 14.74 118.71 72.43 13.76 118.41 72.83 3 0 1000.00 -999 ? >VAL^E 155 9.95 115.27 71.31 8.62 115.05 69.56 9.28 115.16 70.43 3 0 1000.00 -999 ? >PHE^E 156 11.85 112.88 74.77 13.36 115.06 75.76 12.61 113.97 75.27 3 0 1000.00 -999 ? >VAL^E 157 10.18 108.61 70.74 10.37 109.21 68.56 10.28 108.91 69.65 3 0 1000.00 -999 ? >HIS^E 158 10.30 103.03 73.18 10.92 101.20 74.00 10.61 102.12 73.59 3 0 1000.00 -999 ? >ALA^E 159 12.13 102.26 69.33 13.40 102.43 68.48 12.76 102.35 68.91 2 0 1000.00 -999 ? >GLY^E 160 11.38 98.68 70.18 11.95 99.03 69.66 11.67 98.85 69.92 1 0 1000.00 -999 ? >GLY.E 161 14.62 96.69 70.11 14.50 97.55 70.15 14.56 97.12 70.13 1 0 1000.00 -999 ? >THR.E 162 17.24 98.76 68.30 18.83 97.93 66.96 18.04 98.34 67.63 2 0 1000.00 -999 ? >LEU^E 163 16.94 103.43 67.09 16.36 105.29 66.02 16.65 104.36 66.56 3 0 1000.00 -999 ? >ILE^E 164 17.36 100.88 61.92 17.49 99.75 61.71 17.43 100.31 61.82 3 0 1000.00 -999 ? >ARG^E 165 18.93 109.22 62.34 19.00 112.21 63.12 18.96 110.72 62.73 2 0 1000.00 -999 ? >ARG^E 166 17.90 102.53 57.16 18.73 101.04 54.56 18.32 101.79 55.86 2 0 1000.00 -999 ? >GLN^E 167 18.97 111.14 54.64 17.98 112.38 56.07 18.47 111.76 55.36 2 0 1000.00 -999 ? >LEU^E 168 14.46 108.30 51.96 13.47 106.36 52.08 13.96 107.33 52.02 3 0 1000.00 -999 ? >ASN^E 169 18.97 110.63 48.92 20.05 110.04 50.71 19.51 110.34 49.81 2 0 1000.00 -999 ? >GLY^E 170 14.64 110.21 46.51 15.02 109.66 47.00 14.83 109.93 46.75 1 0 1000.00 -999 ? >GLU^E 171 16.89 106.72 47.96 18.49 105.78 48.95 17.69 106.25 48.46 2 0 1000.00 -999 ? >THR^E 172 11.97 103.61 48.03 10.33 102.88 46.75 11.15 103.24 47.39 2 0 1000.00 -999 ? >LEU^E 173 12.71 102.23 52.49 13.98 101.42 54.02 13.34 101.83 53.26 3 0 1000.00 -999 ? >ARG^E 174 8.40 97.02 48.82 11.18 96.02 47.86 9.79 96.52 48.34 2 0 1000.00 -999 ? >VAL^E 175 9.43 98.00 55.77 9.56 100.04 56.68 9.50 99.02 56.22 3 0 1000.00 -999 ? >ASP^E 176 7.90 94.54 58.82 6.32 93.46 59.76 7.11 94.00 59.29 2 0 1000.00 -999 ? >THR.E 177 4.49 97.85 58.90 2.43 98.13 58.17 3.46 97.99 58.53 2 0 1000.00 -999 ? >GLY.E 178 4.99 97.60 62.66 5.52 97.77 62.09 5.25 97.68 62.37 1 0 1000.00 -999 ? >CYH.E 179 8.72 98.50 62.23 9.76 95.96 61.91 9.24 97.23 62.07 2 0 1000.00 -999 ? >LEU^E 180 6.95 102.55 60.20 7.17 104.36 59.05 7.06 103.45 59.62 3 0 1000.00 -999 ? >VAL^E 181 8.70 104.41 64.18 10.21 104.22 65.82 9.46 104.32 65.00 3 0 1000.00 -999 ? >ALA^E 182 8.70 107.90 62.66 9.30 108.76 63.81 9.00 108.33 63.24 2 0 1000.00 -999 ? >PHE^E 183 7.36 109.21 58.21 4.55 109.22 57.94 5.96 109.22 58.07 3 0 1000.00 -999 ? >THR.E 184 9.92 113.59 58.43 12.07 113.76 58.06 10.99 113.68 58.24 2 0 1000.00 -999 ? >ASP.E 185 8.09 117.26 55.88 6.32 117.97 56.67 7.21 117.61 56.28 2 0 1000.00 -999 ? >GLY.E 186 8.92 114.69 52.34 8.56 114.16 52.81 8.74 114.42 52.57 1 0 1000.00 -999 ? >ILE^E 187 8.76 110.25 54.17 9.80 109.54 53.74 9.28 109.90 53.95 3 0 1000.00 -999 ? >ASP^E 188 4.65 109.54 49.99 4.84 111.55 49.28 4.75 110.55 49.64 2 0 1000.00 -999 ? >TYR^E 189 2.47 106.64 54.85 0.41 108.08 56.02 1.44 107.36 55.44 3 0 1000.00 -999 ? >ASP^E 190 1.40 103.10 49.95 -0.23 101.92 49.30 0.59 102.51 49.62 2 0 1000.00 -999 ? >VAL^E 191 0.35 100.09 53.35 0.03 100.14 55.54 0.19 100.11 54.44 3 0 1000.00 -999 ? >GLN^E 192 0.12 97.99 49.13 -1.96 97.97 48.60 -0.92 97.98 48.86 2 0 1000.00 -999 ? >LEU^E 193 -2.06 92.46 52.45 -2.61 90.48 53.23 -2.33 91.47 52.84 3 0 1000.00 -999 ? >ALA.E 194 1.86 91.30 50.09 3.06 92.22 49.92 2.46 91.76 50.01 2 0 1000.00 -999 ? >GLU.E 205 0.89 85.40 58.44 -0.04 86.43 60.06 0.43 85.92 59.25 2 0 1000.00 -999 ? >GLY.E 206 0.29 87.36 54.46 0.56 87.17 55.19 0.43 87.26 54.83 1 0 1000.00 -999 ? >LEU.E 207 4.07 90.05 54.44 6.16 89.89 54.92 5.11 89.97 54.68 3 0 1000.00 -999 ? >LEU^E 208 0.97 94.33 57.01 -1.14 94.20 57.63 -0.09 94.26 57.32 3 0 1000.00 -999 ? >LEU^E 209 4.86 95.54 52.65 6.60 94.21 52.51 5.73 94.87 52.58 3 0 1000.00 -999 ? >THR^E 210 4.70 99.75 54.23 4.11 101.04 55.83 4.40 100.40 55.03 2 0 1000.00 -999 ? >THR^E 211 6.35 101.36 51.22 6.24 100.70 49.15 6.30 101.03 50.18 2 0 1000.00 -999 ? >LEU^E 212 8.70 104.89 53.19 8.08 104.67 55.27 8.39 104.78 54.23 3 0 1000.00 -999 ? >LYS^E 213 8.98 107.15 49.11 5.32 104.28 44.60 7.15 105.72 46.86 2 0 1000.00 -999 ? >GLY^E 214 10.54 110.56 49.00 11.13 110.02 49.19 10.84 110.29 49.10 1 0 1000.00 -999 ? >SER^E 215 13.23 112.55 50.71 13.75 113.41 48.48 13.49 112.98 49.59 2 0 1000.00 -999 ? >GLY^E 216 13.78 112.86 54.45 14.09 112.12 54.16 13.94 112.49 54.30 1 0 1000.00 -999 ? >THR^E 217 14.60 110.79 57.50 16.09 111.40 58.97 15.34 111.09 58.24 2 0 1000.00 -999 ? >VAL^E 218 12.98 107.50 58.51 12.02 106.11 57.08 12.50 106.81 57.80 3 0 1000.00 -999 ? >TRP^E 219 12.30 108.89 61.78 14.84 111.14 63.67 13.57 110.02 62.72 3 0 1000.00 -999 ? >LEU^E 220 13.32 101.38 61.14 12.87 102.01 59.02 13.10 101.69 60.08 3 0 1000.00 -999 ? >GLN^E 221 10.01 99.53 65.71 8.50 100.20 67.08 9.25 99.86 66.40 2 0 1000.00 -999 ? >SER.E 222 13.82 96.03 65.12 15.40 95.77 66.93 14.61 95.90 66.02 2 0 1000.00 -999 ? >LEU.E 223 11.91 93.98 68.86 10.74 92.42 69.96 11.32 93.20 69.41 3 0 1000.00 -999 ? >PRO~E 224 7.95 95.57 65.04 8.61 96.11 67.11 8.28 95.84 66.07 3 0 1000.00 -999 ? >PHE~E 225 3.73 96.75 71.61 1.56 95.97 73.21 2.65 96.36 72.41 3 0 1000.00 -999 ? >SER~E 226 3.15 94.69 67.26 4.05 95.56 65.12 3.60 95.12 66.19 2 0 1000.00 -999 ? >ARG~E 227 7.89 90.82 64.15 10.22 91.75 62.37 9.05 91.29 63.26 2 0 1000.00 -999 ? >LEU~E 228 7.00 92.19 71.36 7.90 91.71 73.30 7.45 91.95 72.33 3 0 1000.00 -999 ? >ALA~E 229 2.73 91.19 71.55 1.90 92.43 71.73 2.32 91.81 71.64 2 0 1000.00 -999 ? >GLY~E 230 1.59 89.34 68.40 2.08 89.14 69.01 1.84 89.24 68.70 1 0 1000.00 -999 ? >ARG~E 231 5.85 85.69 66.20 7.18 86.98 63.69 6.51 86.33 64.95 2 0 1000.00 -999 ? >ILE~E 232 3.67 87.27 73.70 4.25 87.73 74.90 3.96 87.50 74.30 3 0 1000.00 -999 ? >TYR~E 233 -2.63 86.86 70.97 -5.34 86.12 70.80 -3.98 86.49 70.88 3 0 1000.00 -999 ? >ASP~E 234 0.96 83.29 68.22 0.35 84.69 66.73 0.65 83.99 67.47 2 0 1000.00 -999 ? >ALA~E 235 2.10 81.25 71.90 3.43 81.66 72.47 2.76 81.45 72.18 2 0 1000.00 -999 ? >THR~E 236 -0.52 81.54 74.61 0.39 83.17 75.71 -0.07 82.36 75.16 2 0 1000.00 -999 ? >PHE.E 237 -6.34 80.14 73.65 -8.92 79.38 72.76 -7.63 79.76 73.20 3 0 1000.00 -999 ? >HIS.F 4 23.94 82.47 47.38 22.57 81.78 45.94 23.25 82.12 46.66 3 0 1000.00 -999 ? >GLU.F 5 30.60 82.41 49.55 32.51 82.13 48.54 31.55 82.27 49.04 2 0 1000.00 -999 ? >LEU.F 6 25.57 86.35 53.24 23.69 85.49 52.63 24.63 85.92 52.93 3 0 1000.00 -999 ? >ASP^F 7 28.48 91.20 52.60 30.19 90.67 51.39 29.34 90.94 51.99 2 0 1000.00 -999 ? >TYR^F 8 26.93 89.61 58.62 28.85 88.90 60.54 27.89 89.25 59.58 3 0 1000.00 -999 ? >ARG^F 9 25.98 97.65 59.09 26.26 100.71 58.94 26.12 99.18 59.01 2 0 1000.00 -999 ? >ILE^F 10 25.53 92.42 64.25 24.81 91.28 64.26 25.17 91.85 64.26 3 0 1000.00 -999 ? >LEU^F 11 22.04 97.15 63.44 22.29 97.94 61.41 22.17 97.55 62.42 3 0 1000.00 -999 ? >GLY.F 12 22.57 97.38 68.00 23.27 97.02 67.77 22.92 97.20 67.89 1 0 1000.00 -999 ? >GLU.F 13 24.92 98.73 71.79 26.97 98.85 71.27 25.95 98.79 71.53 2 0 1000.00 -999 ? >SER.F 14 22.10 94.19 73.61 22.99 95.44 75.51 22.55 94.82 74.56 2 0 1000.00 -999 ? >MET?F 15 19.09 93.91 71.37 15.70 95.48 73.50 17.40 94.69 72.44 2 0 1000.00 -999 ? >GLN.F 16 21.86 91.98 68.86 23.93 91.68 69.03 22.89 91.83 68.95 2 0 1000.00 -999 ? >THR^F 17 19.27 93.13 64.08 17.61 94.38 63.55 18.44 93.76 63.81 2 0 1000.00 -999 ? >VAL^F 18 21.24 91.66 61.19 21.56 89.59 60.54 21.40 90.62 60.87 3 0 1000.00 -999 ? >GLU^F 19 21.23 95.60 56.37 21.98 97.55 56.09 21.61 96.57 56.23 2 0 1000.00 -999 ? >ILE^F 20 21.29 89.82 54.75 22.22 88.84 55.16 21.76 89.33 54.96 3 0 1000.00 -999 ? >GLU^F 21 25.29 94.30 50.91 27.10 95.32 51.07 26.19 94.81 50.99 2 0 1000.00 -999 ? >LEU^F 22 21.25 90.44 48.74 20.40 88.76 49.85 20.82 89.60 49.29 3 0 1000.00 -999 ? >ASP.F 23 26.21 90.90 45.54 27.71 91.97 46.59 26.96 91.44 46.07 2 0 1000.00 -999 ? >PRO.F 24 23.55 93.06 41.81 23.19 91.24 43.08 23.37 92.15 42.44 3 0 1000.00 -999 ? >GLY.F 25 21.58 87.35 42.37 21.63 87.68 43.10 21.60 87.51 42.73 1 0 1000.00 -999 ? >GLU.F 26 24.66 87.53 45.96 26.45 87.49 47.05 25.56 87.51 46.51 2 0 1000.00 -999 ? >THR^F 27 19.82 84.82 48.35 18.45 83.53 47.31 19.13 84.17 47.83 2 0 1000.00 -999 ? >VAL^F 28 19.13 84.65 52.08 19.02 86.20 53.64 19.08 85.43 52.86 3 0 1000.00 -999 ? >ILE^F 29 16.59 80.88 53.80 16.96 79.79 52.70 16.78 80.33 53.25 3 0 1000.00 -999 ? >ALA^F 30 14.69 83.18 57.04 14.79 84.69 57.21 14.74 83.93 57.13 2 0 1000.00 -999 ? >GLU.F 31 10.14 80.60 60.33 10.50 78.65 59.50 10.32 79.62 59.91 2 0 1000.00 -999 ? >ALA.F 32 8.57 84.47 58.02 7.24 84.03 57.39 7.91 84.25 57.70 2 0 1000.00 -999 ? >GLY.F 33 7.93 87.56 60.10 8.70 87.41 59.87 8.31 87.48 59.99 1 0 1000.00 -999 ? >ALA.F 34 11.63 88.06 60.88 12.70 86.94 60.73 12.16 87.50 60.80 2 0 1000.00 -999 ? >MET?F 35 12.12 90.76 58.12 10.94 93.12 55.55 11.53 91.94 56.83 2 0 1000.00 -999 ? >ASN.F 36 13.15 95.08 60.11 13.33 94.05 61.93 13.24 94.56 61.02 2 0 1000.00 -999 ? >TYR.F 37 14.97 97.64 56.75 17.63 97.84 57.59 16.30 97.74 57.17 3 0 1000.00 -999 ? >MET?F 38 14.21 95.72 52.26 11.54 92.46 50.99 12.87 94.09 51.63 2 0 1000.00 -999 ? >THR.F 39 15.83 98.32 49.98 17.86 98.37 50.63 16.85 98.35 50.30 2 0 1000.00 -999 ? >GLY.F 40 15.52 98.63 46.20 14.99 98.22 46.65 15.26 98.42 46.42 1 0 1000.00 -999 ? >ASP.F 41 13.66 95.56 43.17 15.14 95.22 41.71 14.40 95.39 42.44 2 0 1000.00 -999 ? >ILE^F 42 14.90 92.57 48.45 16.11 91.87 48.80 15.51 92.22 48.63 3 0 1000.00 -999 ? >ARG^F 43 11.83 91.56 43.32 11.09 91.82 40.32 11.46 91.69 41.82 2 0 1000.00 -999 ? >PHE^F 44 9.01 88.23 50.14 6.47 89.34 50.46 7.74 88.79 50.30 3 0 1000.00 -999 ? >THR.F 45 8.77 84.10 47.54 10.07 83.99 45.77 9.42 84.04 46.65 2 0 1000.00 -999 ? >ALA.F 46 8.11 81.63 50.41 6.62 81.85 50.72 7.37 81.74 50.57 2 0 1000.00 -999 ? >ARG.F 47 8.74 75.14 48.65 6.68 72.99 49.47 7.71 74.06 49.06 2 0 1000.00 -999 ? >MET?F 75 10.61 79.61 55.28 14.04 77.96 56.16 12.32 78.78 55.72 2 0 1000.00 -999 ? >THR^F 76 11.01 82.70 53.08 9.49 84.22 53.46 10.25 83.46 53.27 2 0 1000.00 -999 ? >HIS^F 77 14.07 80.93 49.70 14.15 78.93 50.32 14.11 79.93 50.01 3 0 1000.00 -999 ? >PHE^F 78 14.01 87.85 51.99 11.78 88.16 53.66 12.90 88.01 52.82 3 0 1000.00 -999 ? >THR^F 79 16.83 87.37 46.59 15.86 85.91 45.28 16.34 86.64 45.94 2 0 1000.00 -999 ? >ASN^F 80 19.67 90.98 45.12 19.90 92.97 44.35 19.78 91.98 44.73 2 0 1000.00 -999 ? >GLU.F 81 14.49 89.38 42.25 14.59 87.31 41.71 14.54 88.35 41.98 2 0 1000.00 -999 ? >GLY.F 82 17.97 94.13 40.71 18.52 93.59 40.99 18.25 93.86 40.85 1 0 1000.00 -999 ? >GLN.F 83 20.58 98.12 39.22 18.53 97.94 39.84 19.55 98.03 39.53 2 0 1000.00 -999 ? >GLY.F 84 23.94 97.00 43.01 23.47 96.33 43.14 23.70 96.67 43.08 1 0 1000.00 -999 ? >LYS.F 85 24.16 96.34 46.71 28.74 98.77 49.63 26.45 97.56 48.17 2 0 1000.00 -999 ? >GLN^F 86 19.38 95.85 45.92 18.98 97.94 45.99 19.18 96.90 45.96 2 0 1000.00 -999 ? >HIS^F 87 21.71 96.83 52.34 23.57 97.63 51.79 22.64 97.23 52.06 3 0 1000.00 -999 ? >VAL^F 88 17.30 93.03 53.84 16.21 91.37 52.87 16.75 92.20 53.35 3 0 1000.00 -999 ? >ALA^F 89 17.21 93.18 57.65 17.28 94.53 58.34 17.25 93.86 57.99 2 0 1000.00 -999 ? >PHE^F 90 16.27 88.81 58.23 16.08 88.27 55.47 16.18 88.54 56.85 3 0 1000.00 -999 ? >ALA.F 91 15.20 90.31 63.85 14.82 91.64 64.52 15.01 90.98 64.18 2 0 1000.00 -999 ? >ALA.F 92 13.88 87.71 66.29 14.72 87.01 67.36 14.30 87.36 66.83 2 0 1000.00 -999 ? >PRO.F 93 10.13 85.98 66.89 11.01 87.96 67.58 10.57 86.97 67.24 3 0 1000.00 -999 ? >TYR.F 94 12.35 86.19 71.82 13.84 83.95 70.96 13.09 85.07 71.39 3 0 1000.00 -999 ? >PRO.F 95 12.97 91.00 74.93 13.90 90.36 72.99 13.43 90.68 73.96 3 0 1000.00 -999 ? >GLY.F 96 18.15 89.46 73.07 18.06 89.99 72.46 18.11 89.72 72.77 1 0 1000.00 -999 ? >SER.F 97 21.24 89.05 70.89 22.92 90.16 72.23 22.08 89.60 71.56 2 0 1000.00 -999 ? >VAL^F 98 22.08 87.77 67.42 21.05 88.36 65.53 21.57 88.06 66.48 3 0 1000.00 -999 ? >VAL^F 99 25.14 85.64 66.84 26.45 84.49 68.23 25.80 85.06 67.53 3 0 1000.00 -999 ? >ALA^F 100 26.82 84.91 63.47 27.59 85.96 62.66 27.20 85.43 63.07 2 0 1000.00 -999 ? >VAL^F 101 28.27 81.41 63.19 27.88 79.83 64.70 28.07 80.62 63.95 3 0 1000.00 -999 ? >ASP^F 102 31.76 81.06 59.74 32.24 80.73 57.68 32.00 80.89 58.71 2 0 1000.00 -999 ? >LEU.F 103 28.62 76.24 58.55 26.54 76.64 59.11 27.58 76.44 58.83 3 0 1000.00 -999 ? >ASP.F 104 34.04 77.23 57.20 33.52 76.83 55.16 33.78 77.03 56.18 2 0 1000.00 -999 ? >ASP.F 105 35.11 78.75 61.98 36.33 79.96 60.72 35.72 79.35 61.35 2 0 1000.00 -999 ? >VAL.F 106 32.49 74.79 62.93 30.76 75.66 64.00 31.63 75.23 63.46 3 0 1000.00 -999 ? >GLY.F 107 32.96 71.80 60.60 32.34 72.33 60.53 32.65 72.06 60.57 1 0 1000.00 -999 ? >GLY.F 108 29.77 72.57 58.68 29.72 72.32 59.43 29.74 72.44 59.06 1 0 1000.00 -999 ? >ARG.F 109 26.56 67.76 61.76 28.85 67.26 59.73 27.71 67.51 60.75 2 0 1000.00 -999 ? >LEU.F 110 25.40 74.78 64.03 25.83 76.37 65.42 25.61 75.57 64.73 3 0 1000.00 -999 ? >PHE^F 111 23.05 69.65 66.66 23.95 67.29 65.49 23.50 68.47 66.07 3 0 1000.00 -999 ? >CYH^F 112 20.17 74.88 67.32 19.32 76.57 65.20 19.74 75.72 66.26 2 0 1000.00 -999 ? >GLN^F 113 14.97 75.65 70.69 14.66 75.95 72.76 14.82 75.80 71.73 2 0 1000.00 -999 ? >LYS.F 114 14.00 76.12 66.47 8.57 75.46 64.50 11.29 75.79 65.48 2 0 1000.00 -999 ? >ASP.F 115 12.28 79.55 69.50 10.23 78.99 69.63 11.26 79.27 69.57 2 0 1000.00 -999 ? >SER.F 116 16.54 80.43 67.89 17.31 79.76 70.07 16.92 80.10 68.98 2 0 1000.00 -999 ? >PHE^F 117 17.25 79.35 61.81 18.08 79.81 59.18 17.66 79.58 60.50 3 0 1000.00 -999 ? >LEU^F 118 17.83 84.91 63.05 17.22 87.03 62.99 17.53 85.97 63.02 3 0 1000.00 -999 ? >CYH^F 119 18.41 83.50 59.01 19.62 85.94 58.87 19.01 84.72 58.94 2 0 1000.00 -999 ? >ALA^F 120 20.93 81.63 56.82 20.71 80.11 57.09 20.82 80.87 56.95 2 0 1000.00 -999 ? >ALA^F 121 22.89 81.69 53.54 24.41 81.56 53.44 23.65 81.63 53.49 2 0 1000.00 -999 ? >TYR.F 122 19.61 79.57 48.56 17.93 77.86 47.08 18.77 78.72 47.82 3 0 1000.00 -999 ? >GLY.F 123 22.62 76.41 50.46 22.17 76.62 51.15 22.40 76.51 50.81 1 0 1000.00 -999 ? >THR.F 124 22.21 75.80 54.20 22.25 77.08 55.98 22.23 76.44 55.09 2 0 1000.00 -999 ? >ARG^F 125 21.69 69.21 53.01 22.52 67.03 50.95 22.11 68.12 51.98 2 0 1000.00 -999 ? >VAL^F 126 17.91 73.14 57.58 17.34 75.18 58.18 17.63 74.16 57.88 3 0 1000.00 -999 ? >GLY^F 127 16.32 69.96 59.00 16.76 70.36 59.57 16.54 70.16 59.28 1 0 1000.00 -999 ? >ILE^F 128 13.62 67.97 62.51 12.31 67.99 62.76 12.97 67.98 62.63 3 0 1000.00 -999 ? >ALA.F 129 17.38 66.27 64.34 18.71 66.95 64.68 18.04 66.61 64.51 2 0 1000.00 -999 ? >PHE.F 144 14.38 71.19 73.35 16.91 70.25 72.54 15.64 70.72 72.95 3 0 1000.00 -999 ? >ILE.F 145 11.75 71.01 68.00 10.69 70.82 67.23 11.22 70.92 67.61 3 0 1000.00 -999 ? >LEU^F 146 17.51 69.62 68.80 19.54 70.31 69.26 18.53 69.96 69.03 3 0 1000.00 -999 ? >GLN^F 147 16.68 73.54 63.75 15.18 74.85 63.00 15.93 74.20 63.38 2 0 1000.00 -999 ? >LYS^F 148 20.47 70.82 62.43 23.01 67.41 61.35 21.74 69.12 61.89 2 0 1000.00 -999 ? >LEU^F 149 22.27 74.68 60.60 20.61 75.90 61.39 21.44 75.29 60.99 3 0 1000.00 -999 ? >GLU^F 150 23.53 69.17 57.97 25.04 67.72 58.34 24.28 68.44 58.15 2 0 1000.00 -999 ? >GLY.F 151 26.48 73.60 55.02 26.93 73.50 55.67 26.71 73.55 55.35 1 0 1000.00 -999 ? >ASP.F 152 30.30 75.53 53.24 29.35 75.73 51.32 29.83 75.63 52.28 2 0 1000.00 -999 ? >GLY.F 153 27.68 79.35 54.70 27.74 78.90 55.36 27.71 79.12 55.03 1 0 1000.00 -999 ? >LEU^F 154 26.94 83.31 57.32 28.74 84.49 57.78 27.84 83.90 57.55 3 0 1000.00 -999 ? >VAL^F 155 23.84 81.11 59.83 23.92 78.99 60.44 23.88 80.05 60.13 3 0 1000.00 -999 ? >PHE^F 156 23.04 85.51 60.90 24.99 86.59 59.20 24.02 86.05 60.05 3 0 1000.00 -999 ? >VAL^F 157 21.06 82.51 65.69 22.29 80.75 66.18 21.67 81.63 65.94 3 0 1000.00 -999 ? >HIS^F 158 17.30 85.93 68.98 16.46 87.24 70.39 16.88 86.59 69.69 3 0 1000.00 -999 ? >ALA.F 159 19.75 84.37 72.09 21.13 84.29 72.76 20.44 84.33 72.42 2 0 1000.00 -999 ? >GLY.F 160 16.90 85.50 74.33 17.68 85.35 74.50 17.29 85.43 74.41 1 0 1000.00 -999 ? >GLY.F 161 18.08 87.79 77.12 18.54 87.59 76.50 18.31 87.69 76.81 1 0 1000.00 -999 ? >THR.F 162 21.76 87.18 77.94 22.92 87.48 79.79 22.34 87.33 78.87 2 0 1000.00 -999 ? >LEU^F 163 24.41 86.02 74.01 25.75 84.62 72.86 25.08 85.32 73.44 3 0 1000.00 -999 ? >ILE^F 164 25.42 82.36 78.60 25.00 82.35 79.74 25.21 82.36 79.17 3 0 1000.00 -999 ? >ARG^F 165 31.32 80.99 72.88 32.33 82.04 70.15 31.82 81.51 71.52 2 0 1000.00 -999 ? >ARG^F 166 30.55 79.19 80.02 29.71 78.53 82.96 30.13 78.86 81.49 2 0 1000.00 -999 ? >GLN^F 167 34.64 77.12 73.70 34.78 79.17 74.28 34.71 78.14 73.99 2 0 1000.00 -999 ? >LEU^F 168 31.98 71.39 76.89 30.04 71.38 77.87 31.01 71.38 77.38 3 0 1000.00 -999 ? >ASN^F 169 37.77 71.32 78.08 37.59 73.46 78.13 37.68 72.39 78.10 2 0 1000.00 -999 ? >GLY.F 170 35.36 67.02 78.65 35.03 67.71 78.91 35.20 67.36 78.78 1 0 1000.00 -999 ? >GLU.F 171 33.72 71.18 81.72 35.28 72.56 81.39 34.50 71.87 81.55 2 0 1000.00 -999 ? >THR.F 172 29.92 68.55 82.53 28.67 66.92 83.30 29.30 67.73 82.91 2 0 1000.00 -999 ? >LEU^F 173 27.55 72.31 81.62 26.78 74.32 81.40 27.16 73.31 81.51 3 0 1000.00 -999 ? >ARG^F 174 22.87 67.61 85.34 25.51 66.52 86.56 24.19 67.06 85.95 2 0 1000.00 -999 ? >VAL^F 175 21.01 73.40 81.68 22.11 73.55 79.74 21.56 73.48 80.71 3 0 1000.00 -999 ? >ASP^F 176 16.76 75.55 82.27 14.67 75.44 82.32 15.72 75.50 82.30 2 0 1000.00 -999 ? >THR.F 177 16.49 72.87 78.29 15.15 71.11 78.15 15.82 71.99 78.22 2 0 1000.00 -999 ? >GLY.F 178 14.73 76.06 77.04 15.48 75.92 77.28 15.11 75.99 77.16 1 0 1000.00 -999 ? >CYH.F 179 18.05 77.86 77.62 17.46 78.91 80.13 17.76 78.38 78.88 2 0 1000.00 -999 ? >LEU^F 180 19.83 74.34 74.89 21.37 73.02 74.18 20.60 73.68 74.54 3 0 1000.00 -999 ? >VAL^F 181 20.45 77.98 71.89 20.69 80.14 71.65 20.57 79.06 71.77 3 0 1000.00 -999 ? >ALA^F 182 23.07 76.08 69.83 23.53 77.04 68.67 23.30 76.56 69.25 2 0 1000.00 -999 ? >PHE^F 183 24.93 71.77 71.17 22.96 69.81 70.83 23.95 70.79 71.00 3 0 1000.00 -999 ? >THR.F 184 28.95 72.43 67.89 30.73 73.41 68.61 29.84 72.92 68.25 2 0 1000.00 -999 ? >ASP.F 185 30.07 68.29 65.54 28.79 66.95 64.43 29.43 67.62 64.98 2 0 1000.00 -999 ? >GLY.F 186 31.00 66.57 69.63 30.40 67.10 69.80 30.70 66.83 69.72 1 0 1000.00 -999 ? >ILE^F 187 28.40 68.92 72.82 28.48 70.16 73.43 28.44 69.54 73.13 3 0 1000.00 -999 ? >ASP^F 188 27.09 63.40 74.51 28.54 62.47 73.25 27.82 62.93 73.88 2 0 1000.00 -999 ? >TYR^F 189 22.19 66.41 73.18 21.42 65.87 70.54 21.80 66.14 71.86 3 0 1000.00 -999 ? >ASP^F 190 20.46 62.74 78.04 22.23 62.77 79.22 21.34 62.75 78.63 2 0 1000.00 -999 ? >VAL^F 191 16.80 65.49 78.29 15.84 67.07 77.06 16.32 66.28 77.68 3 0 1000.00 -999 ? >GLN^F 192 15.16 61.57 80.87 13.28 60.60 81.19 14.22 61.08 81.03 2 0 1000.00 -999 ? >LEU.F 193 11.50 64.06 84.82 10.17 63.99 86.60 10.84 64.03 85.71 3 0 1000.00 -999 ? >ALA.F 194 14.54 66.30 87.29 15.03 67.74 87.37 14.78 67.02 87.33 2 0 1000.00 -999 ? >LEU.F 207 11.57 72.50 85.45 11.05 74.59 85.96 11.31 73.54 85.70 3 0 1000.00 -999 ? >LEU.F 208 12.80 69.58 80.45 11.52 68.02 79.56 12.16 68.80 80.01 3 0 1000.00 -999 ? >LEU^F 209 17.39 68.95 83.77 18.59 70.07 85.18 17.99 69.51 84.48 3 0 1000.00 -999 ? >THR^F 210 19.52 68.93 79.67 19.48 69.48 77.54 19.50 69.20 78.60 2 0 1000.00 -999 ? >THR^F 211 22.85 67.40 80.56 23.24 65.96 82.14 23.05 66.68 81.35 2 0 1000.00 -999 ? >LEU^F 212 25.73 69.68 77.70 24.31 70.94 76.67 25.02 70.31 77.18 3 0 1000.00 -999 ? >LYS^F 213 29.18 66.59 78.13 29.73 62.07 79.64 29.45 64.33 78.88 2 0 1000.00 -999 ? >GLY^F 214 31.85 66.39 75.45 31.97 67.03 76.05 31.91 66.71 75.75 1 0 1000.00 -999 ? >SER^F 215 34.10 69.08 74.03 36.09 68.05 74.99 35.10 68.57 74.51 2 0 1000.00 -999 ? >GLY^F 216 33.54 72.21 71.91 33.36 72.27 72.70 33.45 72.24 72.31 1 0 1000.00 -999 ? >THR^F 217 31.10 75.16 72.08 31.98 77.00 71.31 31.54 76.08 71.70 2 0 1000.00 -999 ? >VAL^F 218 27.68 75.73 73.75 26.81 74.46 75.35 27.25 75.09 74.55 3 0 1000.00 -999 ? >TRP^F 219 26.66 77.81 70.17 28.91 80.88 69.20 27.78 79.35 69.68 3 0 1000.00 -999 ? >LEU^F 220 23.33 79.29 77.39 23.83 77.27 78.16 23.58 78.28 77.78 3 0 1000.00 -999 ? >GLN^F 221 18.22 81.13 75.50 16.71 81.14 74.00 17.47 81.13 74.75 2 0 1000.00 -999 ? >SER.F 222 19.06 83.53 79.84 19.34 85.92 80.00 19.20 84.72 79.92 2 0 1000.00 -999 ? >LEU.F 223 15.26 85.76 78.68 13.25 86.65 79.09 14.25 86.20 78.89 3 0 1000.00 -999 ? >PRO~F 224 14.57 80.13 77.89 14.27 82.04 76.80 14.42 81.09 77.35 3 0 1000.00 -999 ? >PHE~F 225 9.17 83.18 72.49 6.55 83.83 71.62 7.86 83.50 72.05 3 0 1000.00 -999 ? >SER~F 226 8.84 80.18 76.04 10.55 78.43 75.75 9.69 79.30 75.90 2 0 1000.00 -999 ? >ARG~F 227 12.65 81.67 82.03 15.22 80.37 83.21 13.93 81.02 82.62 2 0 1000.00 -999 ? >LEU~F 228 9.36 85.81 77.46 8.82 87.95 77.18 9.09 86.88 77.32 3 0 1000.00 -999 ? >ALA~F 229 5.47 84.07 76.96 5.35 83.18 75.70 5.41 83.63 76.33 2 0 1000.00 -999 ? >GLY~F 230 4.47 81.70 79.78 4.70 82.50 79.85 4.59 82.10 79.82 1 0 1000.00 -999 ? >ARG~F 231 6.29 83.22 85.20 7.87 84.33 87.60 7.08 83.78 86.40 2 0 1000.00 -999 ? >ILE~F 232 3.48 87.58 79.05 3.46 89.05 79.15 3.47 88.32 79.10 3 0 1000.00 -999 ? >TYR~F 233 -1.18 82.75 79.63 -3.77 81.63 79.69 -2.47 82.19 79.66 3 0 1000.00 -999 ? >ASP~F 234 1.55 83.12 84.85 2.06 81.20 84.09 1.81 82.16 84.47 2 0 1000.00 -999 ? >ALA~F 235 0.59 87.52 84.88 1.65 88.47 84.35 1.12 87.99 84.62 2 0 1000.00 -999 ? >THR~F 236 -2.72 88.27 83.17 -2.37 87.99 81.03 -2.54 88.13 82.10 2 0 1000.00 -999 ? >PHE~F 237 -4.90 84.14 87.36 -6.80 82.49 88.68 -5.85 83.31 88.02 3 0 1000.00 -999 ? >ARG~F 238 -7.01 91.65 89.25 -7.21 93.43 86.74 -7.11 92.54 87.99 2 0 1000.00 -999 ? >ALA~F 239 -8.03 90.06 84.22 -7.18 90.99 83.35 -7.60 90.52 83.79 2 0 1000.00 -999 ? >ARG~F 240 -6.10 84.28 81.37 -3.55 83.97 82.99 -4.82 84.12 82.18 2 0 1000.00 -999 ? >GLU~F 241 -10.02 83.51 87.25 -10.76 83.68 89.26 -10.39 83.59 88.26 2 0 1000.00 -999 ? >GLU.F 242 -14.89 87.46 83.42 -13.95 86.30 81.90 -14.42 86.88 82.66 2 0 1000.00 -999 ?