REMARK SOURCE hebe.pdb HEADER SUGAR BINDING PROTEIN 22-SEP-09 3JYS COMPND SUSD SUPERFAMILY PROTEIN; COMPND 3 CHAIN: A; COMPND 4 SYNONYM: PUTATIVE OUTER MEMBRANE PROTEIN, PROBABLY INVOLVED IN COMPND 5 NUTRIENT BINDING; COMPND 6 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: BACTEROIDES VULGATUS ATCC 8482; SOURCE 3 ORGANISM_TAXID: 435590; SOURCE 4 STRAIN: ATCC 8482 / DSM 1447 / NCTC 11154; SOURCE 5 GENE: BVU_1379, YP_001298690.1; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: HK100; SOURCE 9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 10 EXPRESSION_SYSTEM_PLASMID: SPEEDET AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) HET MSE A 96 8 HET MSE A 111 8 HET MSE A 129 8 HET MSE A 170 8 HET MSE A 172 13 HET MSE A 233 8 HET MSE A 301 8 HET MSE A 409 8 HET MSE A 418 8 HET MG A 1 1 SITE 1 AC1 6 PHE A 291 ASP A 404 ASP A 406 HOH A 729 >ASP.A 38 34.69 39.96 113.00 35.02 41.54 114.44 34.86 40.75 113.72 2 0 25.00 -999 ? MG MG A 1 >ALA.A 40 33.26 42.84 106.14 31.99 43.58 105.66 32.62 43.21 105.90 2 0 30.85 -999 ? MG MG A 1 >TYR.A 41 37.19 41.01 103.41 38.84 39.56 105.13 38.01 40.28 104.27 3 0 26.56 -999 ? MG MG A 1 >THR.A 42 35.24 46.16 101.02 34.06 47.18 102.52 34.65 46.67 101.77 2 0 30.96 -999 ? MG MG A 1 >ASP~A 43 38.28 50.02 100.54 38.93 50.41 102.56 38.60 50.21 101.55 2 0 27.77 -999 ? MG MG A 1 >ALA~A 44 41.96 47.72 99.86 42.95 48.55 99.06 42.46 48.13 99.46 2 0 27.04 -999 ? MG MG A 1 >SER~A 46 40.12 46.01 104.70 38.36 45.69 103.02 39.24 45.85 103.86 2 0 27.04 -999 ? MG MG A 1 >TYR~A 47 40.77 42.74 100.63 38.31 42.18 99.38 39.54 42.46 100.01 3 0 28.03 -999 ? MG MG A 1 >THR~A 48 45.39 44.33 104.25 46.86 45.79 103.66 46.13 45.06 103.96 2 0 20.61 -999 ? MG MG A 1 >GLY~A 50 42.18 41.17 107.25 42.99 41.36 107.21 42.58 41.26 107.23 1 0 21.38 -999 ? MG MG A 1 >LEU~A 51 46.41 39.79 105.28 47.82 38.32 104.42 47.11 39.06 104.85 3 0 19.73 -999 ? MG MG A 1 >HIS~A 52 47.97 43.17 110.89 49.06 43.65 112.62 48.51 43.41 111.76 3 0 13.53 -999 ? MG MG A 1 >LYS~A 53 44.26 40.05 111.79 37.91 39.70 113.24 41.09 39.88 112.52 2 0 22.70 -999 ? MG MG A 1 >ILE~A 54 44.99 35.93 109.16 44.50 35.18 108.11 44.75 35.55 108.64 3 0 19.84 -999 ? MG MG A 1 >TYR~A 55 50.43 37.44 109.52 51.73 36.73 107.18 51.08 37.08 108.35 3 0 15.31 -999 ? MG MG A 1 >SER~A 56 47.91 38.54 114.73 48.01 40.86 114.03 47.96 39.70 114.38 2 0 12.93 -999 ? MG MG A 1 >VAL~A 57 45.94 35.67 116.30 44.22 34.46 115.79 45.08 35.06 116.04 3 0 16.77 -999 ? MG MG A 1 >TRP.A 58 49.94 32.27 114.95 50.89 29.18 117.16 50.41 30.72 116.06 3 0 15.63 -999 ? MG MG A 1 >ALA.A 59 49.99 37.38 119.66 50.75 38.55 119.02 50.37 37.96 119.34 2 0 9.74 -999 ? MG MG A 1 >LEU.A 60 45.21 38.17 119.53 43.07 38.63 119.52 44.14 38.40 119.53 3 0 15.93 -999 ? MG MG A 1 >SER.A 61 44.93 37.93 124.09 45.49 40.15 124.90 45.21 39.04 124.50 2 0 15.09 -999 ? MG MG A 1 >GLY.A 62 41.30 38.88 123.20 41.46 39.13 123.96 41.38 39.00 123.58 1 0 18.87 -999 ? MG MG A 1 >THR.A 79 43.30 32.97 126.50 44.08 32.61 128.57 43.69 32.79 127.54 2 0 20.48 -999 ? MG MG A 1 >ALA~A 80 46.26 33.72 124.18 47.38 34.68 124.60 46.82 34.20 124.39 2 0 15.37 -999 ? MG MG A 1 >LEU~A 81 47.04 31.31 119.97 47.20 29.64 118.52 47.12 30.47 119.24 3 0 17.52 -999 ? MG MG A 1 >LEU~A 82 51.92 32.74 121.89 54.09 32.74 121.52 53.01 32.74 121.71 3 0 12.21 -999 ? MG MG A 1 >ARG~A 83 49.11 32.48 128.92 47.93 33.08 131.65 48.52 32.78 130.28 2 0 19.24 -999 ? MG MG A 1 >CYH~A 84 48.31 28.03 125.56 45.76 29.00 125.96 47.03 28.52 125.76 2 0 20.48 -999 ? MG MG A 1 >TRP~A 85 51.58 25.20 119.91 55.05 27.01 120.11 53.32 26.10 120.01 3 0 17.92 -999 ? MG MG A 1 >TRP~A 86 56.74 28.21 125.10 56.69 28.35 129.02 56.71 28.28 127.06 3 0 16.60 -999 ? MG MG A 1 >THR~A 87 52.14 25.57 127.93 50.85 26.34 129.43 51.50 25.95 128.68 2 0 21.04 -999 ? MG MG A 1 >LEU~A 88 49.69 22.30 125.28 47.71 22.23 126.22 48.70 22.27 125.75 3 0 24.05 -999 ? MG MG A 1 >GLN~A 89 54.02 22.87 122.16 54.09 21.03 121.14 54.06 21.95 121.65 2 0 22.59 -999 ? MG MG A 1 >GLU~A 90 57.45 24.52 126.82 59.33 23.73 126.35 58.39 24.13 126.58 2 0 20.31 -999 ? MG MG A 1 >GLN~A 91 52.57 22.07 132.67 51.18 23.52 133.42 51.88 22.79 133.04 2 0 25.13 -999 ? MG MG A 1 >PRO.A 92 52.87 18.29 128.26 53.83 18.54 130.30 53.35 18.42 129.28 3 0 27.00 -999 ? MG MG A 1 >THR.A 93 57.54 17.42 129.51 57.80 18.92 127.98 57.67 18.17 128.74 2 0 25.45 -999 ? MG MG A 1 >ASP.A 94 62.06 16.13 130.82 62.76 16.42 128.85 62.41 16.28 129.83 2 0 28.24 -999 ? MG MG A 1 >GLU.A 95 62.55 21.20 128.49 62.52 21.99 126.53 62.54 21.59 127.51 2 0 22.25 -999 ? MG MG A 1 >MET?A 96 58.90 22.54 132.79 55.78 24.60 133.06 57.34 23.57 132.92 2 0 22.94 -999 ? MG MG A 1 >LYS^A 97 56.64 22.06 135.77 56.20 18.21 133.66 56.42 20.13 134.71 2 0 28.55 -999 ? MG MG A 1 >ASN^A 98 52.83 24.77 135.88 51.82 26.66 135.99 52.33 25.72 135.94 2 0 24.21 -999 ? MG MG A 1 >ALA.A 99 53.67 25.64 140.49 54.74 26.51 141.17 54.20 26.08 140.83 2 0 27.38 -999 ? MG MG A 1 >TRP.A 100 50.74 29.75 139.21 50.36 30.63 135.39 50.55 30.19 137.30 3 0 23.42 -999 ? MG MG A 1 >ASN.A 101 47.01 25.51 143.53 46.72 23.85 144.84 46.87 24.68 144.19 2 0 33.97 -999 ? MG MG A 1 >ASP~A 102 44.63 25.88 138.07 44.62 28.00 138.37 44.62 26.94 138.22 2 0 28.08 -999 ? MG MG A 1 >ALA~A 103 43.33 21.55 138.90 41.87 21.08 139.08 42.60 21.31 138.99 2 0 34.04 -999 ? MG MG A 1 >TRP~A 104 43.57 25.17 134.50 47.16 25.67 133.03 45.37 25.42 133.77 3 0 26.46 -999 ? MG MG A 1 >CYH~A 105 47.87 22.47 136.10 48.10 25.17 136.35 47.98 23.82 136.23 2 0 26.81 -999 ? MG MG A 1 >THR~A 106 48.31 19.20 137.96 47.81 18.46 139.90 48.06 18.83 138.93 2 0 33.75 -999 ? MG MG A 1 >GLU~A 107 44.17 17.04 135.58 42.18 17.40 134.83 43.17 17.22 135.21 2 0 34.31 -999 ? MG MG A 1 >VAL~A 108 48.91 18.89 132.54 48.57 20.43 131.02 48.74 19.66 131.78 3 0 28.29 -999 ? MG MG A 1 >ASN~A 109 52.08 19.12 136.28 52.56 21.15 136.74 52.32 20.13 136.51 2 0 28.46 -999 ? MG MG A 1 >TYR~A 110 50.80 14.88 137.81 51.09 15.59 140.48 50.94 15.24 139.14 3 0 34.86 -999 ? MG MG A 1 >MET?A 111 49.79 13.84 132.03 52.80 13.13 129.09 51.29 13.48 130.56 2 0 31.94 -999 ? MG MG A 1 >THR~A 112 46.71 12.62 133.94 47.44 12.82 135.95 47.08 12.72 134.94 2 0 36.23 -999 ? MG MG A 1 >TRP~A 113 44.57 14.81 128.80 48.38 15.78 128.53 46.47 15.29 128.66 3 0 31.80 -999 ? MG MG A 1 >THR~A 114 40.89 13.19 130.81 39.81 12.87 132.66 40.35 13.03 131.73 2 0 38.14 -999 ? MG MG A 1 >THR~A 115 38.26 14.66 128.50 37.01 13.05 127.76 37.64 13.85 128.13 2 0 38.20 -999 ? MG MG A 1 >ASN~A 116 37.60 16.98 132.80 36.41 15.69 133.96 37.01 16.34 133.38 2 0 38.38 -999 ? MG MG A 1 >LYS~A 117 37.76 20.62 130.05 34.11 25.36 129.37 35.94 22.99 129.71 2 0 32.27 -999 ? MG MG A 1 >VAL~A 118 41.32 21.96 130.47 43.02 20.69 130.75 42.17 21.32 130.61 3 0 29.70 -999 ? MG MG A 1 >GLU~A 119 42.33 28.17 130.38 43.22 29.18 132.04 42.78 28.68 131.21 2 0 24.54 -999 ? MG MG A 1 >PRO~A 120 46.02 24.81 129.54 44.39 25.57 128.18 45.21 25.19 128.86 3 0 24.49 -999 ? MG MG A 1 >ILE~A 121 43.04 21.28 126.11 43.12 19.85 126.27 43.08 20.56 126.19 3 0 28.44 -999 ? MG MG A 1 >GLU~A 122 38.66 24.33 126.62 37.22 23.28 125.55 37.94 23.81 126.08 2 0 30.21 -999 ? MG MG A 1 >GLY~A 123 42.55 27.78 124.01 42.54 27.06 123.66 42.55 27.42 123.84 1 0 23.07 -999 ? MG MG A 1 >VAL~A 124 44.79 26.10 121.47 46.72 25.01 121.53 45.75 25.55 121.50 3 0 22.18 -999 ? MG MG A 1 >TYR~A 125 40.11 22.55 119.44 38.35 21.21 117.74 39.23 21.88 118.59 3 0 29.20 -999 ? MG MG A 1 >GLN~A 126 37.79 26.75 121.45 36.05 26.01 120.43 36.92 26.38 120.94 2 0 28.87 -999 ? MG MG A 1 >ARG~A 127 42.73 32.63 120.00 41.38 34.51 122.06 42.05 33.57 121.03 2 0 20.04 -999 ? MG MG A 1 >CYH~A 128 43.70 27.46 115.71 46.02 26.25 116.56 44.86 26.86 116.14 2 0 21.64 -999 ? MG MG A 1 >MET?A 129 40.21 26.77 114.32 39.90 23.61 113.33 40.05 25.19 113.83 2 0 28.22 -999 ? MG MG A 1 >TYR~A 130 39.41 32.84 115.52 38.85 35.56 115.27 39.13 34.20 115.40 3 0 22.51 -999 ? MG MG A 1 >ILE~A 131 44.13 30.67 112.52 45.44 30.85 112.80 44.78 30.76 112.66 3 0 20.33 -999 ? MG MG A 1 >VAL~A 132 41.29 28.52 109.84 41.34 26.31 109.77 41.32 27.42 109.80 3 0 25.85 -999 ? MG MG A 1 >ALA~A 133 37.85 30.28 109.88 36.91 30.51 111.08 37.38 30.39 110.48 2 0 27.14 -999 ? MG MG A 1 >LEU~A 134 40.40 34.47 110.09 39.92 35.87 111.71 40.16 35.17 110.90 3 0 22.58 -999 ? MG MG A 1 >VAL~A 135 41.57 32.41 106.35 43.53 31.44 106.12 42.55 31.92 106.24 3 0 24.27 -999 ? MG MG A 1 >ASN~A 136 37.75 29.52 105.36 38.73 27.65 105.67 38.24 28.58 105.52 2 0 29.34 -999 ? MG MG A 1 >GLU~A 137 34.92 35.71 105.71 33.15 35.03 104.66 34.03 35.37 105.19 2 0 31.31 -999 ? MG MG A 1 >PHE~A 138 41.86 36.70 103.51 43.79 38.30 102.28 42.83 37.50 102.90 3 0 24.28 -999 ? MG MG A 1 >LEU~A 139 40.50 31.99 100.71 42.59 31.39 100.73 41.55 31.69 100.72 3 0 28.44 -999 ? MG MG A 1 >LYS~A 140 36.33 33.56 99.78 30.44 33.53 101.75 33.38 33.54 100.77 2 0 35.40 -999 ? MG MG A 1 >ASN~A 141 36.39 38.32 100.81 34.50 38.19 101.80 35.44 38.25 101.30 2 0 31.09 -999 ? MG MG A 1 >ILE~A 142 41.25 37.22 98.40 42.01 37.55 98.27 41.63 37.39 98.34 3 0 28.40 -999 ? MG MG A 1 >PRO~A 143 38.07 35.42 94.83 38.90 37.49 95.07 38.49 36.46 94.95 3 0 33.11 -999 ? MG MG A 1 >ASN~A 144 35.43 40.97 95.62 34.14 39.31 95.39 34.78 40.14 95.51 2 0 35.30 -999 ? MG MG A 1 >ALA~A 145 39.81 42.78 96.07 41.15 42.16 96.54 40.48 42.47 96.30 2 0 29.57 -999 ? MG MG A 1 >PRO~A 146 39.72 47.16 96.32 40.39 45.60 94.84 40.05 46.38 95.58 3 0 31.17 -999 ? MG MG A 1 >GLU~A 147 43.81 46.07 89.22 42.59 44.36 88.84 43.20 45.21 89.03 2 0 35.24 -999 ? MG MG A 1 >SER~A 148 45.88 47.74 94.28 45.10 48.63 96.41 45.49 48.18 95.34 2 0 27.98 -999 ? MG MG A 1 >ILE~A 149 44.75 43.86 97.02 45.18 43.87 98.42 44.96 43.87 97.72 3 0 26.38 -999 ? MG MG A 1 >ASP~A 150 49.94 41.83 95.71 51.08 40.31 94.82 50.51 41.07 95.27 2 0 26.44 -999 ? MG MG A 1 >LYS~A 151 45.98 38.89 95.32 41.62 40.87 91.86 43.80 39.88 93.59 2 0 33.17 -999 ? MG MG A 1 >SER~A 153 50.75 37.28 97.52 52.23 38.59 98.86 51.49 37.93 98.19 2 0 22.54 -999 ? MG MG A 1 >TYR~A 154 47.09 40.18 100.30 47.72 42.74 101.22 47.41 41.46 100.76 3 0 22.53 -999 ? MG MG A 1 >ILE~A 155 45.96 33.76 97.61 45.14 33.30 96.63 45.55 33.53 97.12 3 0 28.18 -999 ? MG MG A 1 >ALA~A 156 49.76 32.62 99.51 51.03 32.91 98.70 50.40 32.76 99.10 2 0 24.80 -999 ? MG MG A 1 >GLN~A 157 51.80 36.15 102.60 52.08 38.22 102.89 51.94 37.18 102.75 2 0 19.00 -999 ? MG MG A 1 >ALA~A 158 46.59 33.52 104.14 45.28 33.92 103.48 45.93 33.72 103.81 2 0 23.38 -999 ? MG MG A 1 >ARG~A 159 46.34 29.10 99.35 47.12 26.79 97.49 46.73 27.95 98.42 2 0 30.14 -999 ? MG MG A 1 >PHE~A 160 52.56 30.33 106.10 54.07 29.45 108.26 53.32 29.89 107.18 3 0 19.14 -999 ? MG MG A 1 >ASN~A 161 47.97 32.18 108.37 49.40 33.70 108.78 48.69 32.94 108.58 2 0 17.51 -999 ? MG MG A 1 >ARG~A 162 42.89 27.02 105.51 42.53 27.06 102.46 42.71 27.04 103.99 2 0 28.93 -999 ? MG MG A 1 >ALA~A 163 48.47 25.50 106.94 49.48 25.50 105.81 48.98 25.50 106.37 2 0 24.46 -999 ? MG MG A 1 >PHE~A 164 52.03 27.74 111.56 53.63 27.83 113.82 52.83 27.78 112.69 3 0 17.99 -999 ? MG MG A 1 >ALA~A 165 47.23 26.40 112.25 46.03 27.34 112.06 46.63 26.87 112.16 2 0 21.96 -999 ? MG MG A 1 >TYR~A 166 44.31 22.60 109.37 41.51 22.65 109.28 42.91 22.63 109.33 3 0 28.18 -999 ? MG MG A 1 >TYR~A 167 52.42 21.83 111.87 54.35 20.52 113.45 53.39 21.18 112.66 3 0 23.69 -999 ? MG MG A 1 >VAL~A 168 49.62 22.76 115.20 49.94 24.53 116.40 49.78 23.65 115.80 3 0 21.94 -999 ? MG MG A 1 >LEU~A 169 45.01 21.44 114.59 43.49 22.93 115.20 44.25 22.19 114.90 3 0 26.17 -999 ? MG MG A 1 >MET?A 170 47.66 17.86 113.61 49.59 16.40 110.17 48.63 17.13 111.89 2 0 29.90 -999 ? MG MG A 1 >ASP~A 171 51.77 18.70 115.98 53.07 18.33 117.56 52.42 18.52 116.77 2 0 25.52 -999 ? MG MG A 1 >MET?A 172 48.67 18.35 119.19 48.48 21.84 121.70 48.57 20.10 120.44 2 0 23.85 -999 ? MG MG A 1 >PHE~A 173 44.00 18.93 119.42 43.89 20.80 121.49 43.94 19.86 120.45 3 0 27.80 -999 ? MG MG A 1 >ALA~A 174 45.72 14.64 115.43 45.80 13.19 116.00 45.76 13.92 115.72 2 0 32.94 -999 ? MG MG A 1 >LEU~A 175 41.37 13.42 114.56 41.95 11.42 114.02 41.66 12.42 114.29 3 0 35.74 -999 ? MG MG A 1 >PRO~A 176 42.62 18.84 112.92 41.08 17.63 113.95 41.85 18.24 113.43 3 0 30.97 -999 ? MG MG A 1 >PRO~A 177 37.00 20.50 113.48 38.07 18.93 112.31 37.53 19.72 112.89 3 0 32.64 -999 ? MG MG A 1 >PHE~A 178 39.98 18.98 106.03 41.22 19.78 103.65 40.60 19.38 104.84 3 0 33.65 -999 ? MG MG A 1 >ILE~A 179 36.28 23.57 107.97 35.71 24.18 107.73 36.00 23.88 107.85 3 0 32.47 -999 ? MG MG A 1 >THR~A 180 38.37 24.92 103.90 39.16 23.38 102.59 38.76 24.15 103.24 2 0 32.99 -999 ? MG MG A 1 >GLU~A 181 38.24 28.53 99.70 40.12 27.50 99.82 39.18 28.02 99.76 2 0 31.77 -999 ? MG MG A 1 >LYS~A 182 35.88 24.77 99.26 41.21 24.08 95.72 38.54 24.42 97.49 2 0 35.58 -999 ? MG MG A 1 >ASN~A 183 34.85 21.08 101.90 36.16 21.37 103.55 35.50 21.23 102.72 2 0 35.63 -999 ? MG MG A 1 >TYR~A 184 30.33 26.37 104.56 28.57 27.16 106.63 29.45 26.76 105.60 3 0 36.88 -999 ? MG MG A 1 >SER~A 185 29.63 22.39 106.11 29.69 19.90 106.18 29.66 21.15 106.15 2 0 39.99 -999 ? MG MG A 1 >ILE~A 186 26.44 22.98 109.93 25.16 23.57 110.38 25.80 23.27 110.15 3 0 40.11 -999 ? MG MG A 1 >GLU~A 187 27.36 19.29 112.00 26.02 17.77 112.69 26.69 18.53 112.35 2 0 42.42 -999 ? MG MG A 1 >PRO~A 188 33.52 21.21 110.05 32.29 19.44 109.38 32.90 20.32 109.71 3 0 36.27 -999 ? MG MG A 1 >ALA~A 189 34.52 15.73 109.23 34.26 14.59 108.26 34.39 15.16 108.75 2 0 39.61 -999 ? MG MG A 1 >PRO~A 190 37.32 13.53 111.78 37.41 15.18 110.22 37.37 14.36 111.00 3 0 37.15 -999 ? MG MG A 1 >LEU~A 191 41.66 14.44 106.97 41.32 15.45 105.02 41.49 14.94 105.99 3 0 35.99 -999 ? MG MG A 1 >SER~A 192 42.92 10.90 108.97 44.04 10.02 107.01 43.48 10.46 107.99 2 0 38.51 -999 ? MG MG A 1 >ARG~A 193 48.49 12.25 113.50 50.02 12.84 116.13 49.25 12.55 114.82 2 0 31.75 -999 ? MG MG A 1 >GLU~A 194 49.17 9.65 105.75 49.66 7.71 105.11 49.42 8.68 105.43 2 0 39.40 -999 ? MG MG A 1 >ASP~A 195 44.17 12.36 104.70 43.95 10.56 103.58 44.06 11.46 104.14 2 0 39.38 -999 ? MG MG A 1 >LEU~A 196 45.40 16.28 108.37 44.91 18.30 109.13 45.15 17.29 108.75 3 0 31.35 -999 ? MG MG A 1 >PHE~A 197 51.93 14.91 106.90 54.66 15.29 106.43 53.29 15.10 106.66 3 0 31.38 -999 ? MG MG A 1 >ASN~A 198 48.76 14.10 102.30 49.81 12.28 102.56 49.28 13.19 102.43 2 0 36.46 -999 ? MG MG A 1 >TRP~A 199 44.20 19.68 101.46 44.43 22.80 103.85 44.32 21.24 102.66 3 0 31.50 -999 ? MG MG A 1 >ILE~A 200 49.57 20.51 106.11 49.57 20.98 107.49 49.57 20.74 106.80 3 0 27.54 -999 ? MG MG A 1 >GLU~A 201 53.94 17.92 101.56 54.25 15.90 101.06 54.09 16.91 101.31 2 0 33.30 -999 ? MG MG A 1 >ALA~A 202 50.52 20.19 99.34 49.36 19.33 98.75 49.94 19.76 99.04 2 0 33.18 -999 ? MG MG A 1 >GLU~A 203 47.25 23.65 101.97 46.07 24.78 100.64 46.66 24.21 101.31 2 0 29.56 -999 ? MG MG A 1 >LEU~A 204 53.74 24.08 102.72 53.40 24.76 104.79 53.57 24.42 103.75 3 0 25.18 -999 ? MG MG A 1 >ASN~A 205 54.55 21.80 97.79 55.78 20.45 98.89 55.17 21.12 98.34 2 0 30.92 -999 ? MG MG A 1 >GLU~A 206 49.97 25.43 94.80 48.02 24.81 94.27 49.00 25.12 94.53 2 0 33.31 -999 ? MG MG A 1 >ILE~A 207 51.47 28.86 99.19 50.81 28.54 100.46 51.14 28.70 99.82 3 0 25.87 -999 ? MG MG A 1 >LYS~A 208 55.94 28.62 98.32 60.04 24.54 100.05 57.99 26.58 99.19 2 0 26.99 -999 ? MG MG A 1 >PRO~A 209 55.82 28.35 93.83 56.61 29.71 95.47 56.22 29.03 94.65 3 0 28.90 -999 ? MG MG A 1 >ASN~A 210 52.71 32.63 95.35 52.28 32.15 93.32 52.49 32.39 94.34 2 0 29.45 -999 ? MG MG A 1 >LEU~A 211 55.71 32.79 100.19 54.30 31.82 101.50 55.00 32.31 100.84 3 0 22.16 -999 ? MG MG A 1 >PRO~A 212 55.98 37.68 101.07 57.14 36.34 99.70 56.56 37.01 100.38 3 0 20.48 -999 ? MG MG A 1 >SER~A 213 61.45 36.20 99.26 62.36 38.31 98.54 61.90 37.25 98.90 2 0 21.94 -999 ? MG MG A 1 >PRO~A 214 64.17 33.38 101.19 63.08 35.27 101.75 63.62 34.32 101.47 3 0 20.67 -999 ? MG MG A 1 >ARG~A 215 67.07 37.03 106.54 69.88 36.58 105.53 68.47 36.81 106.04 2 0 18.80 -999 ? MG MG A 1 >SER~A 216 61.99 40.62 102.91 60.21 39.59 101.63 61.10 40.11 102.27 2 0 18.47 -999 ? MG MG A 1 >GLU~A 217 57.66 42.76 106.46 55.83 43.56 105.70 56.74 43.16 106.08 2 0 14.53 -999 ? MG MG A 1 >TYR~A 218 61.37 40.56 111.86 61.62 39.50 114.40 61.49 40.03 113.13 3 0 7.55 -999 ? MG MG A 1 >GLY~A 219 57.15 38.67 110.70 57.36 38.55 109.94 57.25 38.61 110.32 1 0 10.28 -999 ? MG MG A 1 >VAL~A 220 55.74 37.80 107.25 55.32 38.95 105.42 55.53 38.37 106.34 3 0 14.71 -999 ? MG MG A 1 >ALA~A 221 55.53 34.15 106.16 54.25 33.31 106.15 54.89 33.73 106.16 2 0 17.47 -999 ? MG MG A 1 >ASP~A 222 59.49 35.07 103.57 60.93 34.36 104.91 60.21 34.71 104.24 2 0 17.24 -999 ? MG MG A 1 >GLN~A 223 59.50 32.16 98.96 60.45 32.47 97.10 59.98 32.31 98.03 2 0 25.00 -999 ? MG MG A 1 >ALA~A 224 62.03 30.27 104.00 63.22 31.10 104.46 62.63 30.69 104.23 2 0 19.73 -999 ? MG MG A 1 >VAL~A 225 59.31 30.25 106.69 58.17 31.76 107.79 58.74 31.01 107.24 3 0 17.33 -999 ? MG MG A 1 >ALA~A 226 57.31 27.76 104.57 56.79 28.01 103.15 57.05 27.89 103.86 2 0 22.50 -999 ? MG MG A 1 >SER~A 227 60.48 25.63 104.23 61.55 26.01 102.10 61.02 25.82 103.17 2 0 24.58 -999 ? MG MG A 1 >ALA~A 228 61.18 25.78 108.03 61.44 27.03 108.92 61.31 26.41 108.47 2 0 19.37 -999 ? MG MG A 1 >LEU~A 229 56.33 25.28 108.40 54.40 24.76 109.27 55.37 25.02 108.84 3 0 21.39 -999 ? MG MG A 1 >LEU~A 230 58.31 21.86 104.66 56.90 21.84 102.96 57.60 21.85 103.81 3 0 26.52 -999 ? MG MG A 1 >ALA~A 231 61.38 20.75 107.82 62.63 21.65 108.10 62.01 21.20 107.96 2 0 24.51 -999 ? MG MG A 1 >ARG~A 232 57.89 22.43 114.14 59.05 24.56 116.03 58.47 23.50 115.09 2 0 18.77 -999 ? MG MG A 1 >MET?A 233 56.74 18.51 109.59 53.80 20.62 107.43 55.27 19.56 108.51 2 0 26.13 -999 ? MG MG A 1 >TYR~A 234 59.22 16.76 105.30 57.91 17.34 102.90 58.56 17.05 104.10 3 0 30.29 -999 ? MG MG A 1 >LEU~A 235 61.83 16.58 111.78 63.55 16.30 113.07 62.69 16.44 112.42 3 0 27.71 -999 ? MG MG A 1 >ASN~A 236 57.36 15.40 113.46 58.68 16.27 114.90 58.02 15.84 114.18 2 0 27.13 -999 ? MG MG A 1 >ALA~A 237 56.45 12.58 109.68 56.86 12.63 108.18 56.66 12.61 108.93 2 0 32.56 -999 ? MG MG A 1 >GLU~A 238 57.96 6.85 111.41 59.75 5.72 111.55 58.85 6.29 111.48 2 0 38.13 -999 ? MG MG A 1 >ILE~A 239 55.05 11.30 115.07 55.04 10.52 116.22 55.04 10.91 115.65 3 0 32.60 -999 ? MG MG A 1 >TYR~A 240 52.82 14.38 112.12 54.03 16.32 113.74 53.43 15.35 112.93 3 0 29.06 -999 ? MG MG A 1 >THR~A 241 51.91 9.49 108.97 53.13 10.56 107.53 52.52 10.03 108.25 2 0 35.19 -999 ? MG MG A 1 >GLY~A 242 53.57 6.22 109.94 53.93 6.79 109.48 53.75 6.50 109.71 1 0 38.47 -999 ? MG MG A 1 >LYS~A 243 56.28 6.89 107.30 51.67 5.63 104.34 53.98 6.26 105.82 2 0 41.12 -999 ? MG MG A 1 >ALA~A 244 59.67 8.64 107.79 60.96 7.86 108.21 60.31 8.25 108.00 2 0 36.98 -999 ? MG MG A 1 >ARG~A 245 57.99 11.07 103.72 56.10 12.98 102.25 57.05 12.02 102.99 2 0 34.88 -999 ? MG MG A 1 >TYR~A 246 64.31 11.07 108.83 63.03 10.55 111.25 63.67 10.81 110.04 3 0 33.86 -999 ? MG MG A 1 >THR~A 247 65.44 13.12 103.17 66.01 12.03 101.44 65.72 12.58 102.30 2 0 36.55 -999 ? MG MG A 1 >GLU~A 248 60.83 14.43 101.24 60.75 12.33 101.70 60.79 13.38 101.47 2 0 35.59 -999 ? MG MG A 1 >CYH~A 249 63.44 17.16 106.03 64.09 17.39 108.70 63.76 17.27 107.36 2 0 28.26 -999 ? MG MG A 1 >ILE~A 250 68.04 16.55 104.49 69.20 15.75 104.58 68.62 16.15 104.53 3 0 32.18 -999 ? MG MG A 1 >ASN~A 251 64.93 18.54 100.49 65.82 16.88 99.48 65.38 17.71 99.98 2 0 33.66 -999 ? MG MG A 1 >ALA~A 252 63.64 21.74 103.42 62.35 21.47 104.21 63.00 21.60 103.81 2 0 26.70 -999 ? MG MG A 1 >CYH~A 253 66.52 22.53 105.85 66.46 20.87 108.18 66.49 21.70 107.01 2 0 25.92 -999 ? MG MG A 1 >ASN~A 254 69.36 22.19 101.83 70.90 20.86 102.54 70.13 21.53 102.18 2 0 30.28 -999 ? MG MG A 1 >GLU~A 255 64.51 24.58 99.83 65.41 25.45 98.13 64.96 25.01 98.98 2 0 28.48 -999 ? MG MG A 1 >VAL~A 256 66.48 27.62 104.63 65.36 27.55 106.50 65.92 27.58 105.56 3 0 21.92 -999 ? MG MG A 1 >ILE~A 257 71.06 26.00 105.11 71.91 25.09 105.73 71.48 25.54 105.42 3 0 25.59 -999 ? MG MG A 1 >ALA~A 259 68.67 31.68 102.10 67.22 31.69 102.58 67.94 31.69 102.34 2 0 21.99 -999 ? MG MG A 1 >GLY~A 260 71.62 33.25 104.04 71.05 32.94 104.48 71.34 33.10 104.26 1 0 22.16 -999 ? MG MG A 1 >TYR~A 261 68.02 32.52 107.72 65.51 33.19 106.71 66.76 32.86 107.21 3 0 17.72 -999 ? MG MG A 1 >GLN~A 262 74.97 33.61 108.39 75.98 31.85 107.59 75.48 32.73 107.99 2 0 23.37 -999 ? MG MG A 1 >LEU~A 263 74.52 30.94 114.51 73.93 28.81 114.77 74.22 29.88 114.64 3 0 20.42 -999 ? MG MG A 1 >ALA~A 264 73.47 35.05 116.25 72.32 35.32 117.27 72.90 35.19 116.76 2 0 15.21 -999 ? MG MG A 1 >ASP~A 265 77.55 37.08 117.94 78.34 37.59 116.03 77.95 37.34 116.99 2 0 20.03 -999 ? MG MG A 1 >ASN~A 266 74.94 37.34 121.84 74.77 37.39 123.93 74.86 37.36 122.89 2 0 16.86 -999 ? MG MG A 1 >TYR~A 267 72.00 30.80 123.31 69.95 29.01 123.99 70.97 29.90 123.65 3 0 17.86 -999 ? MG MG A 1 >ALA~A 268 71.03 34.91 125.15 71.69 35.42 126.51 71.36 35.17 125.83 2 0 15.90 -999 ? MG MG A 1 >ASP~A 269 71.07 38.78 122.19 72.47 39.84 123.38 71.77 39.31 122.78 2 0 13.91 -999 ? MG MG A 1 >LEU~A 270 68.17 34.15 120.55 69.09 33.47 118.71 68.63 33.81 119.63 3 0 12.99 -999 ? MG MG A 1 >PHE~A 271 66.00 33.37 123.78 67.03 31.25 122.31 66.51 32.31 123.04 3 0 13.20 -999 ? MG MG A 1 >LYS~A 272 65.82 39.43 124.89 71.72 39.63 127.19 68.77 39.53 126.04 2 0 14.75 -999 ? MG MG A 1 >ALA~A 273 63.51 42.47 124.44 63.56 43.67 125.36 63.54 43.07 124.90 2 0 7.00 -999 ? MG MG A 1 >ASP~A 274 66.20 44.87 121.43 68.10 44.04 121.93 67.15 44.45 121.68 2 0 9.02 -999 ? MG MG A 1 >ASN~A 275 65.11 38.96 120.00 63.04 38.70 120.48 64.08 38.83 120.24 2 0 5.64 -999 ? MG MG A 1 >GLY~A 276 63.42 41.61 116.65 64.01 42.04 116.95 63.71 41.83 116.80 1 0 5.26 -999 ? MG MG A 1 >GLU~A 277 63.51 46.40 116.97 62.23 44.80 117.63 62.87 45.60 117.30 2 0 4.00 -999 ? MG MG A 1 >ASN~A 278 69.30 42.73 118.13 71.37 42.28 118.47 70.34 42.51 118.30 2 0 12.05 -999 ? MG MG A 1 >PRO~A 279 71.66 44.96 113.67 70.49 43.10 114.21 71.07 44.03 113.94 3 0 13.09 -999 ? MG MG A 1 >ASP~A 280 73.50 40.19 116.62 74.43 38.36 117.20 73.97 39.28 116.91 2 0 15.92 -999 ? MG MG A 1 >THR~A 281 69.59 38.04 116.32 69.01 38.85 118.20 69.30 38.45 117.26 2 0 10.56 -999 ? MG MG A 1 >LYS~A 282 67.58 38.89 113.18 64.36 44.13 112.33 65.97 41.51 112.75 2 0 9.02 -999 ? MG MG A 1 >LYS~A 283 70.25 36.97 111.19 75.81 37.25 113.14 73.03 37.11 112.17 2 0 18.58 -999 ? MG MG A 1 >GLU~A 284 69.26 31.97 114.68 70.45 31.14 116.23 69.86 31.56 115.46 2 0 16.55 -999 ? MG MG A 1 >ILE^A 285 64.53 35.41 114.39 63.92 35.80 115.68 64.23 35.61 115.03 3 0 9.99 -999 ? MG MG A 1 >ILE^A 286 63.33 31.36 110.03 63.78 30.23 109.46 63.56 30.80 109.74 3 0 16.30 -999 ? MG MG A 1 >TYR^A 287 57.35 32.66 111.13 54.70 33.31 110.58 56.03 32.99 110.85 3 0 13.80 -999 ? MG MG A 1 >PRO^A 288 59.23 37.36 113.48 59.05 35.22 114.15 59.14 36.29 113.82 3 0 8.94 -999 ? MG MG A 1 >ILE^A 289 54.80 35.10 117.63 53.79 34.78 116.78 54.30 34.94 117.20 3 0 9.85 -999 ? MG MG A 1 >ILE~A 290 56.03 40.74 115.89 56.63 41.68 114.94 56.33 41.21 115.41 3 0 5.62 -999 ? MG MG A 1 >PHE~A 291 54.93 39.72 121.67 53.29 37.47 121.71 54.11 38.59 121.69 3 0 -7.12 -999 ? MG MG A 1s >ASP~A 292 56.18 46.09 119.72 57.14 47.95 119.88 56.66 47.02 119.80 2 0 5.49 -999 ? MG MG A 1 >GLY~A 293 55.44 47.57 124.10 55.28 47.72 123.34 55.36 47.64 123.72 1 0 7.47 -999 ? MG MG A 1 >ASP~A 294 54.42 51.28 121.16 55.80 52.13 122.55 55.11 51.71 121.86 2 0 10.25 -999 ? MG MG A 1 >SER~A 298 48.16 41.79 124.21 49.86 40.96 122.71 49.01 41.38 123.46 2 0 10.19 -999 ? MG MG A 1 >GLY~A 300 50.79 36.37 125.18 51.18 36.88 125.59 50.98 36.62 125.39 1 0 12.12 -999 ? MG MG A 1 >MET?A 301 54.61 36.72 125.53 57.99 35.88 124.07 56.30 36.30 124.80 2 0 8.40 -999 ? MG MG A 1 >ALA~A 302 54.17 38.90 128.67 53.13 40.01 128.86 53.65 39.45 128.76 2 0 11.42 -999 ? MG MG A 1 >ALA~A 303 52.55 35.88 130.36 51.18 35.26 129.98 51.87 35.57 130.17 2 0 15.20 -999 ? MG MG A 1 >ILE~A 304 55.87 33.11 127.96 56.14 32.17 126.88 56.01 32.64 127.42 3 0 13.28 -999 ? MG MG A 1 >ILE~A 305 58.47 37.25 130.27 59.37 38.14 129.68 58.92 37.69 129.97 3 0 11.49 -999 ? MG MG A 1 >ILE~A 306 54.86 37.93 133.90 54.14 39.18 134.21 54.50 38.55 134.05 3 0 15.73 -999 ? MG MG A 1 >GLY~A 307 54.86 33.46 134.52 55.62 33.72 134.53 55.24 33.59 134.53 1 0 18.12 -999 ? MG MG A 1 >ALA~A 308 58.46 32.31 135.05 59.38 32.09 133.79 58.92 32.20 134.42 2 0 17.73 -999 ? MG MG A 1 >ARG~A 309 60.72 36.13 135.28 62.40 35.94 132.73 61.56 36.04 134.01 2 0 15.03 -999 ? MG MG A 1 >GLY~A 310 58.53 34.76 141.35 58.58 35.50 141.00 58.56 35.13 141.17 1 0 23.09 -999 ? MG MG A 1 >ALA~A 311 56.90 37.06 143.85 55.86 36.59 144.87 56.38 36.82 144.36 2 0 26.13 -999 ? MG MG A 1 >GLU~A 312 61.97 37.79 143.63 63.70 37.60 142.37 62.84 37.70 143.00 2 0 23.62 -999 ? MG MG A 1 >ASP~A 313 61.51 43.71 145.68 61.20 43.76 147.80 61.35 43.73 146.74 2 0 28.10 -999 ? MG MG A 1 >LYS~A 314 59.29 45.02 141.71 54.46 47.95 142.03 56.87 46.49 141.87 2 0 23.34 -999 ? MG MG A 1 >ASP~A 315 63.37 47.55 142.49 62.15 49.23 142.92 62.76 48.39 142.70 2 0 24.14 -999 ? MG MG A 1 >VAL~A 316 64.61 43.29 141.70 64.41 42.19 143.64 64.51 42.74 142.67 3 0 23.46 -999 ? MG MG A 1 >LEU~A 317 60.68 41.80 139.06 59.52 40.07 139.73 60.10 40.94 139.40 3 0 19.74 -999 ? MG MG A 1 >LEU~A 318 62.54 46.38 137.11 61.01 47.51 136.10 61.78 46.94 136.60 3 0 17.46 -999 ? MG MG A 1 >ALA~A 319 66.69 44.65 137.61 67.23 44.40 139.05 66.96 44.53 138.33 2 0 20.85 -999 ? MG MG A 1 >HIS~A 320 66.15 39.50 138.08 64.41 38.74 138.97 65.28 39.12 138.52 3 0 20.02 -999 ? MG MG A 1 >SER~A 321 64.03 40.85 133.89 63.70 38.72 134.98 63.87 39.78 134.44 2 0 16.36 -999 ? MG MG A 1 >GLY~A 322 62.41 44.12 132.70 62.06 43.58 133.15 62.24 43.85 132.93 1 0 13.33 -999 ? MG MG A 1 >VAL~A 323 58.99 43.26 134.24 58.83 41.19 133.33 58.91 42.22 133.79 3 0 14.04 -999 ? MG MG A 1 >ASP~A 324 55.46 45.07 137.24 55.39 46.86 136.26 55.43 45.97 136.75 2 0 17.41 -999 ? MG MG A 1 >GLN~A 325 53.09 42.29 137.94 51.51 42.60 136.56 52.30 42.44 137.25 2 0 18.56 -999 ? MG MG A 1 >GLY~A 326 56.12 37.44 138.67 55.35 37.70 139.04 55.74 37.57 138.86 1 0 19.96 -999 ? MG MG A 1 >TRP~A 327 51.62 37.19 137.89 50.31 37.06 134.18 50.97 37.12 136.04 3 0 19.23 -999 ? MG MG A 1 >ALA~A 328 55.38 32.03 140.26 55.10 32.24 141.80 55.24 32.14 141.03 2 0 24.87 -999 ? MG MG A 1 >GLY~A 329 54.18 29.45 137.73 54.97 29.56 137.76 54.57 29.50 137.74 1 0 23.07 -999 ? MG MG A 1 >PHE^A 330 55.32 28.97 133.15 52.98 30.00 132.08 54.15 29.48 132.62 3 0 19.34 -999 ? MG MG A 1 >ARG^A 331 59.52 24.63 139.03 57.17 23.77 140.83 58.35 24.20 139.93 2 0 28.58 -999 ? MG MG A 1 >ALA~A 332 62.44 23.88 135.65 63.94 24.23 135.58 63.19 24.06 135.62 2 0 24.92 -999 ? MG MG A 1 >THR~A 333 62.77 20.22 136.49 62.01 19.15 134.81 62.39 19.68 135.65 2 0 28.28 -999 ? MG MG A 1 >SER~A 334 65.97 18.54 137.62 65.56 16.23 138.24 65.76 17.38 137.93 2 0 33.06 -999 ? MG MG A 1 >ASN~A 335 65.17 16.19 133.42 64.62 14.31 134.31 64.90 15.25 133.87 2 0 32.54 -999 ? MG MG A 1 >LEU~A 336 65.47 21.42 132.44 65.47 23.05 131.00 65.47 22.23 131.72 3 0 24.68 -999 ? MG MG A 1 >VAL~A 337 69.26 21.52 134.72 69.29 22.47 136.67 69.28 21.99 135.70 3 0 28.11 -999 ? MG MG A 1 >HIS~A 338 70.96 16.94 136.55 70.96 16.95 138.64 70.96 16.94 137.60 3 0 33.58 -999 ? MG MG A 1 >LEU~A 339 70.23 19.00 129.67 68.83 17.84 128.48 69.53 18.42 129.08 3 0 28.12 -999 ? MG MG A 1 >PHE~A 340 72.38 23.25 130.52 70.20 24.05 128.98 71.29 23.65 129.75 3 0 24.77 -999 ? MG MG A 1 >ASP~A 341 78.79 21.10 131.00 78.99 19.29 129.91 78.89 20.20 130.46 2 0 32.35 -999 ? MG MG A 1 >PHE~A 342 76.33 23.05 136.19 73.69 23.82 135.76 75.01 23.44 135.98 3 0 29.78 -999 ? MG MG A 1 >GLN~A 343 83.69 24.60 138.23 84.44 26.46 138.91 84.06 25.53 138.57 2 0 35.56 -999 ? MG MG A 1 >ASN~A 344 81.13 21.45 140.93 80.93 19.85 142.35 81.03 20.65 141.64 2 0 38.81 -999 ? MG MG A 1 >ASP~A 345 78.74 17.63 136.82 79.07 18.65 134.98 78.91 18.14 135.90 2 0 34.77 -999 ? MG MG A 1 >GLU~A 346 79.98 15.32 141.56 78.92 13.75 140.67 79.45 14.53 141.11 2 0 40.87 -999 ? MG MG A 1 >GLU~A 347 76.68 21.63 144.95 77.16 21.51 146.98 76.92 21.57 145.96 2 0 38.92 -999 ? MG MG A 1 >PRO~A 348 74.36 20.42 139.24 75.40 21.92 140.51 74.88 21.17 139.88 3 0 33.44 -999 ? MG MG A 1 >ALA~A 350 73.59 28.65 138.07 72.36 29.52 138.25 72.98 29.08 138.16 2 0 26.26 -999 ? MG MG A 1 >SER~A 351 76.65 30.93 138.42 77.53 30.91 140.62 77.09 30.92 139.52 2 0 30.13 -999 ? MG MG A 1 >GLU~A 352 79.84 27.83 140.13 80.18 26.58 141.82 80.01 27.20 140.97 2 0 34.44 -999 ? MG MG A 1 >ILE~A 353 75.93 27.21 134.01 74.90 27.47 133.07 75.41 27.34 133.54 3 0 26.26 -999 ? MG MG A 1 >GLN~A 354 81.85 25.30 132.80 83.15 23.72 133.34 82.50 24.51 133.07 2 0 33.43 -999 ? MG MG A 1 >ASP~A 355 76.43 24.37 128.55 75.22 24.41 126.79 75.82 24.39 127.67 2 0 25.36 -999 ? MG MG A 1 >LYS~A 356 75.99 29.24 128.80 77.25 31.19 131.89 76.62 30.22 130.34 2 0 24.57 -999 ? MG MG A 1 >ARG~A 357 72.97 26.29 123.82 74.12 23.53 123.20 73.54 24.91 123.51 2 0 24.61 -999 ? MG MG A 1 >GLY~A 358 71.27 27.51 130.49 71.68 28.21 130.30 71.47 27.86 130.40 1 0 22.22 -999 ? MG MG A 1 >ILE~A 359 69.31 31.78 130.82 69.34 32.75 129.91 69.33 32.26 130.36 3 0 18.02 -999 ? MG MG A 1 >PHE^A 360 69.06 27.54 134.93 68.68 25.39 133.20 68.87 26.46 134.07 3 0 23.79 -999 ? MG MG A 1 >TYR^A 361 66.68 33.62 139.83 66.49 35.28 142.02 66.58 34.45 140.93 3 0 23.90 -999 ? MG MG A 1 >ASP~A 362 69.88 28.37 141.28 71.74 29.28 141.82 70.81 28.83 141.55 2 0 28.73 -999 ? MG MG A 1 >GLY~A 364 66.88 29.36 147.57 66.99 29.05 146.83 66.94 29.21 147.20 1 0 31.83 -999 ? MG MG A 1 >ARG~A 365 64.68 28.98 142.63 63.02 31.53 143.02 63.85 30.26 142.83 2 0 26.15 -999 ? MG MG A 1 >SER~A 366 66.65 22.82 145.13 64.57 21.67 145.64 65.61 22.24 145.39 2 0 33.90 -999 ? MG MG A 1 >ILE~A 367 68.65 20.55 141.31 69.87 20.45 140.41 69.26 20.50 140.86 3 0 32.34 -999 ? MG MG A 1 >ASP~A 368 64.86 17.35 143.07 66.51 16.19 142.56 65.68 16.77 142.82 2 0 35.86 -999 ? MG MG A 1 >ILE~A 369 59.85 19.36 141.62 58.97 20.24 140.92 59.41 19.80 141.27 3 0 31.59 -999 ? MG MG A 1 >THR~A 370 60.36 16.55 145.51 62.21 17.05 146.46 61.28 16.80 145.99 2 0 37.29 -999 ? MG MG A 1 >SER~A 371 57.53 17.35 147.99 57.65 19.71 148.53 57.59 18.53 148.26 2 0 37.02 -999 ? MG MG A 1 >SER~A 372 55.00 18.93 145.65 53.01 20.31 145.90 54.01 19.62 145.78 2 0 35.16 -999 ? MG MG A 1 >VAL~A 373 54.84 20.55 142.23 54.79 19.78 140.22 54.82 20.16 141.22 3 0 31.63 -999 ? MG MG A 1 >SER~A 374 52.43 23.25 143.38 50.47 22.21 144.25 51.45 22.73 143.82 2 0 33.31 -999 ? MG MG A 1 >GLY~A 375 53.16 25.84 146.01 53.73 25.50 145.55 53.44 25.67 145.78 1 0 31.94 -999 ? MG MG A 1 >THR~A 376 56.92 25.32 145.73 56.87 23.17 145.79 56.90 24.25 145.76 2 0 32.78 -999 ? MG MG A 1 >PHE~A 377 57.81 29.69 141.38 59.06 31.07 139.32 58.44 30.38 140.35 3 0 24.13 -999 ? MG MG A 1 >GLU~A 378 58.74 31.67 146.31 59.29 33.06 144.78 59.01 32.36 145.55 2 0 26.89 -999 ? MG MG A 1 >THR~A 379 61.93 26.54 146.89 60.65 26.43 148.61 61.29 26.49 147.75 2 0 33.26 -999 ? MG MG A 1 >GLU~A 380 60.97 22.25 146.54 59.74 20.66 147.22 60.36 21.46 146.88 2 0 35.36 -999 ? MG MG A 1 >GLY~A 381 63.00 23.70 140.86 63.28 24.28 141.46 63.14 23.99 141.16 1 0 28.78 -999 ? MG MG A 1 >TRP~A 382 67.67 25.22 140.83 71.16 25.20 139.03 69.41 25.21 139.93 3 0 28.66 -999 ? MG MG A 1 >SER^A 383 63.63 29.34 137.77 62.42 30.53 139.45 63.03 29.94 138.61 2 0 23.46 -999 ? MG MG A 1 >VAL^A 384 64.27 29.83 134.03 64.09 28.26 132.55 64.18 29.04 133.29 3 0 19.98 -999 ? MG MG A 1 >PHE~A 385 65.23 34.58 135.21 64.13 35.14 137.73 64.68 34.86 136.47 3 0 19.29 -999 ? MG MG A 1 >LYS~A 386 65.75 32.58 129.26 66.13 28.24 124.64 65.94 30.41 126.95 2 0 16.89 -999 ? MG MG A 1 >PHE~A 387 61.58 33.59 126.39 61.48 31.90 124.15 61.53 32.75 125.27 3 0 11.78 -999 ? MG MG A 1 >SER~A 388 63.81 38.42 129.25 65.63 39.76 130.18 64.72 39.09 129.72 2 0 12.54 -999 ? MG MG A 1 >ASN~A 389 61.02 42.36 129.27 60.16 43.99 128.15 60.59 43.17 128.71 2 0 8.47 -999 ? MG MG A 1 >LEU~A 390 66.95 43.07 130.21 67.23 43.53 132.31 67.09 43.30 131.26 3 0 13.82 -999 ? MG MG A 1 >ASN~A 391 67.06 45.73 125.16 68.30 47.34 125.75 67.68 46.54 125.46 2 0 11.58 -999 ? MG MG A 1 >SER~A 392 70.66 43.21 124.74 71.05 44.01 122.49 70.85 43.61 123.61 2 0 12.00 -999 ? MG MG A 1 >ASN~A 393 72.36 47.76 125.37 70.59 49.00 125.60 71.48 48.38 125.49 2 0 13.99 -999 ? MG MG A 1 >GLY~A 394 70.91 45.63 129.61 70.50 46.11 129.12 70.70 45.87 129.36 1 0 15.37 -999 ? MG MG A 1 >GLN~A 395 69.40 50.43 128.82 69.23 51.43 130.75 69.32 50.93 129.79 2 0 17.00 -999 ? MG MG A 1 >PRO~A 396 64.87 48.66 132.29 65.25 47.78 130.29 65.06 48.22 131.29 3 0 13.87 -999 ? MG MG A 1 >GLY~A 397 62.18 47.17 127.30 62.16 47.59 128.04 62.17 47.38 127.67 1 0 9.06 -999 ? MG MG A 1 >LYS~A 398 59.88 50.13 126.87 58.93 50.06 120.65 59.40 50.10 123.76 2 0 7.18 -999 ? MG MG A 1 >ASN~A 399 55.64 48.45 128.08 53.92 48.92 129.21 54.78 48.69 128.65 2 0 12.44 -999 ? MG MG A 1 >THR~A 400 57.09 46.87 132.24 56.98 48.47 133.76 57.03 47.67 133.00 2 0 15.23 -999 ? MG MG A 1 >LEU~A 401 52.72 45.08 131.84 51.35 43.62 132.74 52.03 44.35 132.29 3 0 14.59 -999 ? MG MG A 1 >TRP~A 402 51.13 47.17 127.91 48.59 44.23 128.57 49.86 45.70 128.24 3 0 13.05 -999 ? MG MG A 1 >VAL~A 403 56.97 43.15 126.63 56.96 41.08 127.36 56.97 42.11 127.00 3 0 7.67 -999 ? MG MG A 1 >ASP~A 404 60.26 44.87 123.47 59.72 46.91 123.89 59.99 45.89 123.68 2 0 -5.72 -999 ? MG MG A 1s >THR~A 405 60.51 40.31 123.36 61.46 39.22 125.03 60.98 39.76 124.19 2 0 6.77 -999 ? MG MG A 1 >ASP~A 406 60.08 38.69 118.79 59.74 40.71 118.23 59.91 39.70 118.51 2 0 -2.75 -999 ? MG MG A 1s >PHE^A 407 57.75 32.49 120.85 58.29 29.88 121.62 58.02 31.19 121.23 3 0 11.94 -999 ? MG MG A 1 >PRO^A 408 62.71 32.45 119.61 60.90 33.16 118.48 61.80 32.81 119.05 3 0 10.45 -999 ? MG MG A 1 >MET?A 409 58.78 30.27 116.33 56.17 28.39 116.78 57.47 29.33 116.56 2 0 15.21 -999 ? MG MG A 1 >PHE^A 410 59.74 28.10 112.22 57.35 26.65 111.94 58.55 27.38 112.08 3 0 17.39 -999 ? MG MG A 1 >ARG^A 411 66.30 30.32 117.68 68.25 28.51 119.29 67.27 29.42 118.48 2 0 16.94 -999 ? MG MG A 1 >LEU~A 412 69.44 29.40 111.68 70.68 28.99 109.92 70.06 29.19 110.80 3 0 19.58 -999 ? MG MG A 1 >GLY~A 413 69.54 26.78 115.41 68.88 26.62 114.92 69.21 26.70 115.17 1 0 19.58 -999 ? MG MG A 1 >ASP~A 414 65.11 24.89 115.25 63.65 23.33 115.43 64.38 24.11 115.34 2 0 20.54 -999 ? MG MG A 1 >ILE~A 415 67.30 25.04 110.34 66.35 24.67 109.25 66.82 24.85 109.80 3 0 21.96 -999 ? MG MG A 1 >TYR~A 416 72.58 24.76 112.21 74.06 26.70 110.83 73.32 25.73 111.52 3 0 23.63 -999 ? MG MG A 1 >LEU~A 417 69.03 20.61 116.06 70.05 20.99 117.93 69.54 20.80 117.00 3 0 24.52 -999 ? MG MG A 1 >MET?A 418 66.92 19.02 112.35 63.10 20.81 111.92 65.01 19.92 112.13 2 0 23.78 -999 ? MG MG A 1 >TYR~A 419 71.32 19.23 107.86 72.96 18.24 105.82 72.14 18.73 106.84 3 0 30.26 -999 ? MG MG A 1 >ALA~A 420 71.79 16.66 111.91 72.49 17.22 113.17 72.14 16.94 112.54 2 0 29.61 -999 ? MG MG A 1 >GLU~A 421 67.00 13.52 114.61 65.39 13.99 115.89 66.20 13.76 115.25 2 0 29.83 -999 ? MG MG A 1 >ALA~A 422 67.56 13.71 109.71 66.98 14.80 108.77 67.27 14.25 109.24 2 0 31.17 -999 ? MG MG A 1 >VAL~A 423 71.05 12.70 108.49 72.85 13.77 107.66 71.95 13.24 108.08 3 0 34.31 -999 ? MG MG A 1 >ALA~A 424 71.65 10.59 111.62 71.51 11.10 113.08 71.58 10.85 112.35 2 0 34.73 -999 ? MG MG A 1 >ARG~A 425 65.58 10.14 113.27 64.69 9.14 116.05 65.14 9.64 114.66 2 0 34.42 -999 ? MG MG A 1 >GLY~A 426 69.34 7.93 107.36 69.00 8.62 107.42 69.17 8.28 107.39 1 0 38.46 -999 ? MG MG A 1 >GLY~A 427 68.11 10.80 105.18 68.91 10.53 105.31 68.51 10.67 105.24 1 0 36.37 -999 ? MG MG A 1 >GLU~A 428 70.89 11.92 99.71 72.38 10.44 99.92 71.63 11.18 99.81 2 0 40.24 -999 ? MG MG A 1 >GLY~A 429 72.64 14.37 103.54 72.98 13.60 103.60 72.81 13.98 103.57 1 0 35.44 -999 ? MG MG A 1 >SER~A 430 76.12 14.95 104.92 78.25 16.15 104.88 77.19 15.55 104.90 2 0 35.99 -999 ? MG MG A 1 >LYS~A 431 77.45 13.64 108.20 78.32 7.89 107.96 77.88 10.76 108.08 2 0 41.55 -999 ? MG MG A 1 >ALA~A 432 80.41 16.08 107.97 81.44 16.21 106.82 80.93 16.15 107.40 2 0 36.99 -999 ? MG MG A 1 >SER~A 433 77.96 19.01 107.64 77.63 19.39 105.29 77.79 19.20 106.46 2 0 33.13 -999 ? MG MG A 1 >ALA~A 434 75.75 17.66 110.46 75.17 16.22 110.56 75.46 16.94 110.51 2 0 32.37 -999 ? MG MG A 1 >VAL~A 435 78.81 17.56 112.74 80.52 16.18 113.16 79.67 16.87 112.95 3 0 33.73 -999 ? MG MG A 1 >GLU~A 436 81.36 21.40 109.70 81.48 21.48 107.56 81.42 21.44 108.63 2 0 33.13 -999 ? MG MG A 1 >TYR~A 437 74.92 22.39 110.29 74.80 22.94 107.55 74.86 22.66 108.92 3 0 27.72 -999 ? MG MG A 1 >ILE~A 438 76.19 19.33 116.35 74.97 19.14 116.99 75.58 19.24 116.67 3 0 28.87 -999 ? MG MG A 1 >ASN~A 439 80.96 21.59 115.97 81.55 19.60 116.50 81.25 20.60 116.23 2 0 32.35 -999 ? MG MG A 1 >ALA~A 440 78.71 25.63 115.65 78.09 26.10 114.31 78.40 25.86 114.98 2 0 25.75 -999 ? MG MG A 1 >LEU~A 441 74.75 24.51 118.27 72.96 24.78 117.09 73.85 24.64 117.68 3 0 23.42 -999 ? MG MG A 1 >ARG~A 442 78.06 20.21 121.09 78.00 19.57 124.10 78.03 19.89 122.60 2 0 30.19 -999 ? MG MG A 1 >LYS~A 443 81.07 26.62 120.19 85.43 29.25 118.48 83.25 27.93 119.33 2 0 29.44 -999 ? MG MG A 1 >ARG~A 444 75.36 31.18 119.62 72.69 30.63 118.25 74.02 30.91 118.93 2 0 18.18 -999 ? MG MG A 1 >ALA~A 445 77.36 27.61 123.95 76.83 26.14 123.99 77.09 26.87 123.97 2 0 24.58 -999 ? MG MG A 1 >TYR~A 446 80.72 24.59 125.92 79.49 22.29 126.91 80.11 23.44 126.42 3 0 29.21 -999 ? MG MG A 1 >GLY~A 447 82.75 30.03 123.98 82.96 29.24 123.95 82.86 29.64 123.96 1 0 27.01 -999 ? MG MG A 1 >ASP~A 448 86.49 27.42 124.00 85.76 25.84 125.24 86.12 26.63 124.62 2 0 31.89 -999 ? MG MG A 1 >ASP~A 449 87.51 25.00 119.43 86.98 26.47 118.06 87.24 25.74 118.75 2 0 32.17 -999 ? MG MG A 1 >LYS~A 450 87.00 22.22 123.26 91.18 25.18 126.86 89.09 23.70 125.06 2 0 37.09 -999 ? MG MG A 1 >HIS~A 451 83.10 21.91 125.46 83.97 22.26 127.34 83.54 22.08 126.40 3 0 32.59 -999 ? MG MG A 1 >ASN~A 452 84.21 19.58 118.61 84.57 21.57 117.95 84.39 20.57 118.28 2 0 33.08 -999 ? MG MG A 1 >ILE~A 453 80.04 15.89 119.24 79.41 16.29 118.84 79.73 16.09 119.04 3 0 33.69 -999 ? MG MG A 1 >SER~A 454 82.16 13.71 115.98 82.93 11.87 117.27 82.55 12.79 116.62 2 0 39.06 -999 ? MG MG A 1 >GLU~A 455 81.07 12.14 111.36 81.59 11.53 109.37 81.33 11.84 110.36 2 0 39.84 -999 ? MG MG A 1 >ASN~A 456 80.56 7.83 116.64 81.79 6.68 115.32 81.17 7.26 115.98 2 0 42.85 -999 ? MG MG A 1 >TRP~A 457 78.34 12.81 121.36 75.66 15.57 120.60 77.00 14.19 120.98 3 0 33.74 -999 ? MG MG A 1 >LEU~A 458 75.09 11.94 114.55 75.68 13.85 113.66 75.39 12.90 114.10 3 0 34.51 -999 ? MG MG A 1 >GLU~A 459 74.00 7.55 113.65 74.89 6.51 112.05 74.44 7.03 112.85 2 0 40.34 -999 ? MG MG A 1 >GLU~A 460 76.39 8.03 120.93 78.37 8.48 121.66 77.38 8.25 121.29 2 0 39.39 -999 ? MG MG A 1 >ASN~A 461 72.58 6.25 123.50 71.10 5.77 124.99 71.84 6.01 124.25 2 0 39.33 -999 ? MG MG A 1 >ASN~A 462 68.22 4.82 120.11 66.42 5.24 118.91 67.32 5.03 119.51 2 0 38.36 -999 ? MG MG A 1 >PHE~A 463 68.91 8.43 116.47 69.11 6.54 114.40 69.01 7.49 115.43 3 0 37.00 -999 ? MG MG A 1 >ARG~A 464 67.22 8.75 123.98 66.79 7.79 126.83 67.00 8.27 125.41 2 0 36.61 -999 ? MG MG A 1 >ASN~A 465 73.91 12.69 121.50 75.08 11.33 122.57 74.50 12.01 122.04 2 0 35.41 -999 ? MG MG A 1 >LEU~A 466 69.95 14.36 118.13 71.38 14.45 116.51 70.67 14.41 117.32 3 0 30.78 -999 ? MG MG A 1 >LEU~A 467 66.65 13.60 122.46 64.69 13.71 123.34 65.67 13.66 122.90 3 0 30.12 -999 ? MG MG A 1 >ASP~A 468 70.94 15.39 125.17 70.60 13.61 126.24 70.77 14.50 125.70 2 0 32.06 -999 ? MG MG A 1 >GLU~A 469 72.91 19.74 120.78 74.44 20.26 122.18 73.67 20.00 121.48 2 0 27.33 -999 ? MG MG A 1 >ARG~A 470 65.91 17.92 118.40 64.48 20.19 116.92 65.20 19.05 117.66 2 0 23.50 -999 ? MG MG A 1 >GLY~A 471 66.99 20.29 125.01 67.60 20.63 124.54 67.29 20.46 124.78 1 0 24.47 -999 ? MG MG A 1 >ARG~A 472 73.32 20.54 126.50 73.72 17.56 125.79 73.52 19.05 126.14 2 0 29.76 -999 ? MG MG A 1 >GLU~A 473 69.88 25.23 120.03 71.44 26.67 120.18 70.66 25.95 120.11 2 0 20.25 -999 ? MG MG A 1 >LEU~A 474 65.22 24.05 121.08 65.67 24.22 118.97 65.45 24.13 120.03 3 0 19.77 -999 ? MG MG A 1 >TYR~A 475 66.01 25.34 127.63 67.47 27.47 128.63 66.74 26.40 128.13 3 0 19.94 -999 ? MG MG A 1 >TRP~A 476 61.78 25.57 129.27 60.44 27.98 132.04 61.11 26.78 130.66 3 0 19.57 -999 ? MG MG A 1 >GLU~A 477 63.10 28.49 122.28 64.83 28.58 121.05 63.97 28.53 121.67 2 0 15.42 -999 ? MG MG A 1 >GLY~A 478 57.69 25.22 122.45 58.36 24.87 122.22 58.03 25.04 122.33 1 0 18.01 -999 ? MG MG A 1 >ILE~A 479 60.10 22.44 119.64 60.07 21.94 118.96 60.09 22.19 119.30 3 0 20.78 -999 ? MG MG A 1 >ARG~A 480 62.15 18.55 125.18 64.70 16.98 125.55 63.43 17.77 125.37 2 0 27.13 -999 ? MG MG A 1 >ARG~A 481 52.72 17.74 123.63 51.75 17.11 120.81 52.24 17.42 122.22 2 0 26.98 -999 ? MG MG A 1 >THR~A 482 56.85 17.15 119.81 56.31 18.28 118.10 56.58 17.72 118.96 2 0 24.92 -999 ? MG MG A 1 >ASP~A 483 61.64 16.91 120.60 62.11 18.50 119.22 61.87 17.70 119.91 2 0 24.61 -999 ? MG MG A 1 >LEU~A 484 59.24 14.00 124.47 60.48 14.47 126.21 59.86 14.24 125.34 3 0 29.25 -999 ? MG MG A 1 >VAL~A 485 56.87 12.11 121.03 54.76 12.63 120.65 55.82 12.37 120.84 3 0 30.81 -999 ? MG MG A 1 >ARG~A 486 61.47 13.31 115.30 62.22 15.80 116.99 61.85 14.55 116.14 2 0 27.44 -999 ? MG MG A 1 >PHE~A 487 63.83 10.92 120.53 66.01 11.98 119.13 64.92 11.45 119.83 3 0 31.98 -999 ? MG MG A 1 >ASP~A 488 58.46 6.57 121.26 56.80 5.49 121.95 57.63 6.03 121.60 2 0 37.62 -999 ? MG MG A 1 >LEU~A 489 61.28 9.57 125.39 63.01 8.17 125.28 62.15 8.87 125.33 3 0 34.64 -999 ? MG MG A 1 >LEU~A 490 55.87 12.10 125.28 54.74 13.87 125.95 55.30 12.99 125.61 3 0 30.80 -999 ? MG MG A 1 >THR~A 491 54.76 8.57 127.58 53.33 8.31 126.01 54.05 8.44 126.80 2 0 35.72 -999 ? MG MG A 1 >SER~A 492 57.26 5.71 128.00 59.34 4.51 127.67 58.30 5.11 127.83 2 0 39.25 -999 ? MG MG A 1 >GLY~A 493 58.42 4.51 131.40 58.86 4.54 130.73 58.64 4.52 131.06 1 0 40.18 -999 ? MG MG A 1 >SER~A 494 62.00 4.21 130.10 62.22 4.70 127.71 62.11 4.46 128.91 2 0 39.17 -999 ? MG MG A 1 >TYR~A 495 63.53 10.15 129.46 64.38 12.78 130.01 63.95 11.46 129.74 3 0 33.34 -999 ? MG MG A 1 >THR~A 496 61.36 9.75 133.55 61.26 8.06 134.90 61.31 8.91 134.23 2 0 38.07 -999 ? MG MG A 1 >TRP~A 497 58.87 14.95 133.92 58.67 13.19 130.42 58.77 14.07 132.17 3 0 31.44 -999 ? MG MG A 1 >ASP~A 498 60.67 16.29 138.84 62.73 16.82 138.58 61.70 16.55 138.71 2 0 32.37 -999 ? MG MG A 1 >PHE~A 499 55.94 15.43 140.82 55.94 15.42 143.64 55.94 15.43 142.23 3 0 35.69 -999 ? MG MG A 1 >LYS~A 500 56.09 12.43 135.33 58.27 9.35 130.03 57.18 10.89 132.68 2 0 35.15 -999 ? MG MG A 1 >GLY~A 501 52.79 10.51 135.64 53.03 11.08 136.14 52.91 10.80 135.89 1 0 36.72 -999 ? MG MG A 1 >GLY~A 502 52.14 12.06 139.07 52.77 11.60 138.98 52.46 11.83 139.03 1 0 37.14 -999 ? MG MG A 1 >ILE~A 503 55.14 8.71 140.71 54.66 7.92 141.91 54.90 8.32 141.31 3 0 41.03 -999 ? MG MG A 1 >ASN~A 504 58.18 12.64 143.72 58.64 11.02 145.01 58.41 11.83 144.36 2 0 40.70 -999 ? MG MG A 1 >THR~A 505 60.46 9.90 140.91 60.83 8.41 142.44 60.64 9.16 141.68 2 0 41.34 -999 ? MG MG A 1 >GLY~A 506 58.45 9.62 137.66 58.47 8.96 138.14 58.46 9.29 137.90 1 0 37.84 -999 ? MG MG A 1 >VAL~A 507 56.55 6.83 135.88 55.15 6.39 137.52 55.85 6.61 136.70 3 0 40.25 -999 ? MG MG A 1 >GLY~A 508 55.32 6.19 132.35 54.88 6.20 133.06 55.10 6.19 132.71 1 0 39.07 -999 ? MG MG A 1 >VAL~A 509 51.78 6.94 131.27 51.97 9.15 131.28 51.87 8.05 131.27 3 0 37.52 -999 ? MG MG A 1 >ASN~A 510 47.75 5.98 129.00 46.36 5.22 127.57 47.05 5.60 128.29 2 0 40.68 -999 ? MG MG A 1 >LYS~A 511 50.24 6.20 125.06 48.63 1.99 120.87 49.44 4.10 122.96 2 0 42.37 -999 ? MG MG A 1 >ARG~A 512 44.34 7.88 127.32 42.80 8.04 129.95 43.57 7.96 128.64 2 0 39.98 -999 ? MG MG A 1 >TYR~A 513 48.41 10.86 128.62 46.43 10.65 130.53 47.42 10.75 129.58 3 0 35.73 -999 ? MG MG A 1 >ASN~A 514 51.56 10.47 122.05 53.12 9.32 122.95 52.34 9.90 122.50 2 0 34.36 -999 ? MG MG A 1 >VAL~A 515 47.99 13.66 121.82 47.29 12.59 120.01 47.64 13.13 120.91 3 0 32.08 -999 ? MG MG A 1 >TYR~A 516 46.82 17.83 124.54 49.05 18.78 126.03 47.94 18.30 125.29 3 0 27.74 -999 ? MG MG A 1 >PRO~A 517 41.79 15.32 125.91 42.43 15.27 123.75 42.11 15.30 124.83 3 0 33.01 -999 ? MG MG A 1 >ILE~A 518 38.77 16.38 119.94 39.14 17.07 118.65 38.96 16.72 119.29 3 0 33.26 -999 ? MG MG A 1 >PRO~A 519 38.65 21.13 122.59 37.72 19.07 122.66 38.18 20.10 122.62 3 0 31.32 -999 ? MG MG A 1 >VAL~A 520 33.88 17.73 124.12 33.20 16.50 125.85 33.54 17.12 124.98 3 0 36.93 -999 ? MG MG A 1 >THR~A 521 32.69 21.32 123.48 33.66 23.29 123.90 33.18 22.30 123.69 2 0 32.66 -999 ? MG MG A 1 >ASP~A 522 34.53 20.93 118.98 34.27 21.87 117.06 34.40 21.40 118.02 2 0 32.92 -999 ? MG MG A 1 >LEU~A 523 32.83 15.91 120.68 34.61 14.67 120.25 33.72 15.29 120.46 3 0 37.75 -999 ? MG MG A 1 >THR~A 524 28.71 18.06 121.23 27.92 18.92 123.07 28.32 18.49 122.15 2 0 39.75 -999 ? MG MG A 1 >VAL~A 525 27.89 20.29 118.20 28.50 22.33 118.83 28.20 21.31 118.51 3 0 38.00 -999 ? MG MG A 1 >ASN~A 526 31.13 18.90 115.01 31.79 18.26 113.07 31.46 18.58 114.04 2 0 37.64 -999 ? MG MG A 1 >GLY~A 527 28.50 14.72 114.97 29.09 15.03 114.55 28.80 14.87 114.76 1 0 42.13 -999 ? MG MG A 1 >ASN~A 528 31.21 14.51 110.97 29.35 14.37 109.93 30.28 14.44 110.45 2 0 42.63 -999 ? MG MG A 1 >LEU~A 529 34.11 15.94 115.43 35.81 17.26 115.55 34.96 16.60 115.49 3 0 36.20 -999 ? MG MG A 1 >GLN~A 530 34.41 9.99 115.25 32.40 9.66 115.93 33.40 9.83 115.59 2 0 43.04 -999 ? MG MG A 1 >GLN~A 531 38.00 11.55 122.63 38.57 13.57 122.70 38.28 12.56 122.66 2 0 36.14 -999 ? MG MG A 1 >ASN~A 532 42.39 11.43 120.47 42.78 12.96 119.04 42.58 12.19 119.76 2 0 34.30 -999 ? MG MG A 1 >GLU~A 533 42.60 4.51 120.10 44.23 3.48 119.08 43.42 4.00 119.59 2 0 42.29 -999 ? MG MG A 1 >GLY~A 534 42.06 5.88 124.42 41.51 6.44 124.25 41.79 6.16 124.33 1 0 41.19 -999 ? MG MG A 1 >TYR~A 535 41.70 10.73 125.56 44.29 11.80 125.78 43.00 11.26 125.67 3 0 36.17 -999 ? MG MG A 1