==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/RNA 15-SEP-08 2JLX . COMPND 2 MOLECULE: SERINE PROTEASE SUBUNIT NS3; . SOURCE 2 ORGANISM_SCIENTIFIC: DENGUE VIRUS 4; . AUTHOR D.H.LUO,T.XU,R.P.WATSON,D.S.BECKER,A.SAMPATH,W.JAHNKE,S.S.YE . 902 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 40603.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 581 64.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 108 12.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 36 4.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 87 9.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 99 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 203 22.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 1.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 2 0 0 2 6 2 5 5 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 2 12 6 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 2 2 2 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 4 0 2 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 168 A G 0 0 71 0, 0.0 8,-1.2 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 166.8 30.4 -30.0 -10.9 2 169 A S - 0 0 55 6,-0.2 2,-0.2 7,-0.1 6,-0.1 -0.928 360.0-120.3-144.9 170.4 27.7 -28.3 -9.0 3 170 A A - 0 0 57 -2,-0.3 3,-0.2 1,-0.2 2,-0.1 -0.527 59.6 -67.2 -93.9 177.9 24.2 -26.9 -9.4 4 171 A M S S+ 0 0 164 -2,-0.2 2,-1.0 1,-0.2 -1,-0.2 -0.388 121.4 17.3 -56.6 142.3 23.4 -23.2 -8.7 5 172 A G S S+ 0 0 55 1,-0.1 -1,-0.2 -3,-0.1 26,-0.0 -0.264 105.2 91.2 91.7 -49.8 23.8 -22.4 -5.0 6 173 A E S S- 0 0 73 -2,-1.0 -1,-0.1 -3,-0.2 3,-0.1 -0.589 81.7-106.8 -87.3 142.3 25.9 -25.4 -3.9 7 174 A P - 0 0 26 0, 0.0 -4,-0.1 0, 0.0 29,-0.1 -0.314 40.2 -98.0 -63.6 145.8 29.7 -25.4 -3.9 8 175 A D - 0 0 61 27,-0.2 -6,-0.2 1,-0.1 0, 0.0 -0.378 19.0-146.5 -63.6 138.9 31.6 -27.4 -6.6 9 176 A Y S S+ 0 0 171 -8,-1.2 2,-0.5 -3,-0.1 -1,-0.1 0.687 85.1 71.4 -76.5 -20.0 32.8 -30.9 -5.4 10 177 A E + 0 0 152 -9,-0.1 2,-0.4 2,-0.0 -2,-0.1 -0.876 62.1 180.0-103.5 121.8 35.8 -30.4 -7.7 11 178 A V - 0 0 25 -2,-0.5 2,-0.1 28,-0.1 -2,-0.0 -0.993 33.9-110.1-124.9 129.2 38.5 -27.9 -6.7 12 179 A D > - 0 0 110 -2,-0.4 3,-0.9 1,-0.1 4,-0.2 -0.322 14.3-148.4 -54.9 124.1 41.7 -27.3 -8.8 13 180 A E G > S+ 0 0 128 1,-0.2 3,-1.7 2,-0.1 4,-0.4 0.830 91.8 75.5 -60.0 -35.1 44.9 -28.6 -7.1 14 181 A D G > S+ 0 0 47 1,-0.3 3,-1.2 2,-0.2 -1,-0.2 0.790 84.8 62.1 -45.5 -40.0 46.7 -25.8 -8.9 15 182 A I G < S+ 0 0 8 -3,-0.9 -1,-0.3 1,-0.3 7,-0.2 0.652 97.8 55.0 -72.0 -16.7 45.3 -23.1 -6.5 16 183 A F G < S+ 0 0 19 -3,-1.7 2,-0.4 -4,-0.2 -1,-0.3 0.480 78.8 121.2 -95.5 -3.6 46.9 -24.6 -3.3 17 184 A R S X S- 0 0 125 -3,-1.2 3,-2.3 -4,-0.4 127,-0.2 -0.483 70.1-119.2 -64.8 115.8 50.5 -24.5 -4.7 18 185 A K T 3 S+ 0 0 115 -2,-0.4 125,-0.3 1,-0.3 3,-0.1 -0.274 104.4 33.4 -44.4 138.3 52.9 -22.5 -2.7 19 186 A K T 3 S+ 0 0 150 123,-2.2 2,-0.5 1,-0.2 -1,-0.3 0.267 95.7 116.4 82.8 -7.6 54.2 -19.7 -5.0 20 187 A R < - 0 0 93 -3,-2.3 124,-2.4 122,-0.2 2,-0.5 -0.820 41.9-174.6 -96.5 126.3 50.8 -19.5 -6.8 21 188 A L E -a 144 0A 46 -2,-0.5 2,-0.5 122,-0.2 124,-0.2 -0.979 11.8-163.0-114.2 118.0 48.7 -16.4 -6.7 22 189 A T E -a 145 0A 25 122,-2.8 124,-2.9 -2,-0.5 2,-0.6 -0.881 7.0-158.5-103.6 125.9 45.3 -16.9 -8.3 23 190 A I E -a 146 0A 71 -2,-0.5 2,-0.9 122,-0.2 124,-0.2 -0.930 3.4-165.6-100.4 115.2 43.1 -14.0 -9.3 24 191 A M E +a 147 0A 36 122,-2.2 124,-2.0 -2,-0.6 -2,-0.0 -0.862 12.4 174.7 -98.0 98.3 39.5 -15.0 -9.7 25 192 A D + 0 0 101 -2,-0.9 -1,-0.1 122,-0.2 124,-0.1 -0.162 14.4 157.2-100.3 39.8 38.0 -12.0 -11.6 26 193 A L - 0 0 73 1,-0.1 3,-0.1 124,-0.0 4,-0.1 -0.314 49.6 -93.0 -66.3 147.2 34.4 -13.4 -12.2 27 194 A H > - 0 0 36 1,-0.1 3,-1.9 2,-0.1 5,-0.2 -0.022 57.1 -75.0 -56.6 160.3 31.6 -10.8 -12.8 28 195 A P T 3 S+ 0 0 8 0, 0.0 134,-0.4 0, 0.0 -1,-0.1 -0.354 121.2 21.8 -62.9 138.2 29.5 -9.5 -9.8 29 196 A G T 3 S+ 0 0 15 -3,-0.1 -2,-0.1 132,-0.1 132,-0.1 0.415 83.7 123.4 85.9 1.9 27.0 -12.1 -8.6 30 197 A A S < S- 0 0 11 -3,-1.9 -3,-0.1 -4,-0.1 131,-0.0 0.740 87.7-100.6 -65.3 -25.4 29.0 -15.0 -10.2 31 198 A G S >>S+ 0 0 13 -4,-0.2 5,-3.0 -5,-0.1 4,-1.5 0.700 73.8 141.7 110.4 31.5 29.2 -16.7 -6.8 32 199 A K T 4>S+ 0 0 16 -5,-0.2 5,-2.3 3,-0.2 -5,-0.0 0.941 79.9 31.3 -67.9 -48.3 32.7 -15.9 -5.6 33 200 A T T 45S+ 0 0 15 3,-0.2 -1,-0.2 1,-0.1 34,-0.1 0.882 130.3 33.6 -77.6 -40.4 31.8 -15.4 -1.9 34 201 A K T 45S+ 0 0 63 3,-0.1 -2,-0.2 2,-0.1 -1,-0.1 0.477 132.4 17.5-105.9 -4.4 28.9 -17.9 -1.6 35 202 A R T X5S+ 0 0 60 -4,-1.5 4,-1.2 -29,-0.1 -27,-0.2 0.600 127.0 40.4-126.2 -50.3 29.8 -20.8 -3.9 36 203 A I H > S+ 0 0 1 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.878 108.7 52.4 -55.8 -38.6 33.0 -22.6 0.5 39 206 A S H X S+ 0 0 9 -4,-1.2 4,-2.0 -3,-0.4 -2,-0.2 0.892 111.6 45.8 -60.6 -43.6 34.5 -25.1 -2.0 40 207 A I H X S+ 0 0 3 -4,-1.8 4,-3.1 2,-0.2 5,-0.2 0.946 113.4 49.2 -65.8 -47.2 38.0 -23.7 -1.4 41 208 A V H X S+ 0 0 0 -4,-2.9 4,-2.3 2,-0.2 -2,-0.2 0.932 111.2 48.5 -60.8 -50.2 37.6 -23.8 2.4 42 209 A R H X S+ 0 0 124 -4,-2.6 4,-1.7 1,-0.2 -1,-0.2 0.918 115.6 45.4 -51.1 -49.6 36.2 -27.4 2.5 43 210 A E H X S+ 0 0 35 -4,-2.0 4,-1.5 1,-0.2 -2,-0.2 0.886 111.2 51.4 -66.8 -40.0 39.2 -28.5 0.3 44 211 A A H <>S+ 0 0 0 -4,-3.1 5,-2.8 1,-0.2 -1,-0.2 0.841 108.0 54.3 -64.1 -33.3 41.8 -26.5 2.3 45 212 A L H ><5S+ 0 0 34 -4,-2.3 3,-1.0 -5,-0.2 -2,-0.2 0.890 106.8 50.1 -64.9 -42.8 40.4 -28.2 5.4 46 213 A K H 3<5S+ 0 0 161 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.813 112.0 47.7 -62.8 -33.3 40.9 -31.6 3.8 47 214 A R T 3<5S- 0 0 112 -4,-1.5 -1,-0.2 -5,-0.1 -2,-0.2 0.420 110.8-126.9 -88.4 2.1 44.5 -30.7 3.0 48 215 A R T < 5 + 0 0 183 -3,-1.0 2,-0.4 1,-0.2 -3,-0.2 0.857 47.9 168.7 51.4 42.1 44.9 -29.4 6.6 49 216 A L < - 0 0 31 -5,-2.8 2,-0.8 -6,-0.1 -1,-0.2 -0.703 42.4-122.1 -84.8 131.0 46.1 -26.0 5.3 50 217 A R - 0 0 63 -2,-0.4 62,-2.2 60,-0.2 63,-2.0 -0.656 47.5-168.2 -69.0 110.0 46.4 -23.1 7.8 51 218 A T E -bc 90 113A 0 38,-2.4 40,-2.5 -2,-0.8 2,-0.4 -0.808 25.3-163.1-119.2 145.6 44.0 -20.7 6.1 52 219 A L E -bc 91 114A 0 61,-2.0 63,-3.3 -2,-0.3 2,-0.5 -0.995 5.3-165.2-126.5 124.6 43.1 -17.0 6.3 53 220 A I E -bc 92 115A 0 38,-3.3 40,-2.4 -2,-0.4 2,-0.5 -0.936 11.3-161.8-108.6 130.1 39.9 -15.6 4.8 54 221 A L E -bc 93 116A 0 61,-2.8 63,-2.3 -2,-0.5 40,-0.2 -0.955 8.4-171.6-121.8 127.9 39.8 -11.8 4.5 55 222 A A E -b 94 0A 0 38,-2.4 40,-2.0 -2,-0.5 41,-0.2 -0.893 22.1-140.4-110.2 142.5 36.7 -9.6 4.0 56 223 A P S S+ 0 0 11 0, 0.0 40,-0.3 0, 0.0 2,-0.3 0.881 83.3 7.2 -66.6 -37.6 36.9 -5.8 3.3 57 224 A T S > S- 0 0 18 37,-0.1 4,-2.0 38,-0.1 3,-0.2 -0.877 80.0-101.2-141.2 166.0 33.9 -4.9 5.5 58 225 A R H > S+ 0 0 40 -2,-0.3 4,-2.4 1,-0.2 5,-0.1 0.746 118.4 64.5 -63.2 -25.1 31.5 -6.5 8.0 59 226 A V H > S+ 0 0 0 184,-0.3 4,-1.6 2,-0.2 -1,-0.2 0.951 106.3 40.6 -60.9 -52.6 29.0 -6.7 5.2 60 227 A V H > S+ 0 0 0 183,-0.2 4,-2.3 -3,-0.2 -2,-0.2 0.868 113.4 55.5 -64.2 -39.5 31.1 -9.1 3.2 61 228 A A H X S+ 0 0 0 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.896 107.7 49.2 -57.2 -44.2 32.0 -10.9 6.5 62 229 A A H X S+ 0 0 13 -4,-2.4 4,-1.4 2,-0.2 -1,-0.2 0.820 110.8 49.7 -64.5 -36.9 28.3 -11.5 7.1 63 230 A E H X S+ 0 0 0 -4,-1.6 4,-1.2 2,-0.2 -2,-0.2 0.865 110.8 50.3 -68.3 -40.1 27.7 -12.8 3.6 64 231 A M H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 3,-0.4 0.919 106.4 54.7 -61.6 -48.0 30.7 -15.2 4.0 65 232 A E H X S+ 0 0 32 -4,-2.3 4,-0.9 1,-0.2 -1,-0.2 0.879 104.8 54.1 -55.2 -42.8 29.3 -16.5 7.3 66 233 A E H < S+ 0 0 64 -4,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.869 115.8 39.7 -57.4 -39.0 26.0 -17.4 5.6 67 234 A A H < S+ 0 0 27 -4,-1.2 -2,-0.2 -3,-0.4 -1,-0.2 0.744 120.6 42.6 -82.2 -29.5 27.9 -19.4 3.0 68 235 A L H >< S+ 0 0 0 -4,-2.5 3,-2.1 -5,-0.1 -2,-0.2 0.375 80.8 140.1 -99.5 2.5 30.4 -21.0 5.4 69 236 A R T 3< + 0 0 120 -4,-0.9 -3,-0.1 1,-0.2 -4,-0.0 -0.245 66.6 27.3 -56.1 124.8 27.9 -21.7 8.1 70 237 A G T 3 S+ 0 0 80 1,-0.4 -1,-0.2 3,-0.1 -2,-0.0 0.176 94.8 111.4 108.0 -14.5 28.6 -25.1 9.7 71 238 A L S < S- 0 0 33 -3,-2.1 2,-1.7 1,-0.1 -1,-0.4 -0.682 81.3-102.3 -94.2 147.4 32.4 -25.2 9.0 72 239 A P + 0 0 70 0, 0.0 18,-0.6 0, 0.0 17,-0.4 -0.462 64.3 149.6 -71.0 83.2 35.1 -25.0 11.8 73 240 A I E -d 90 0A 5 -2,-1.7 2,-0.8 10,-0.1 18,-0.2 -0.954 45.2-138.8-122.6 132.8 36.1 -21.3 11.3 74 241 A R E -d 91 0A 93 16,-3.0 18,-2.4 -2,-0.4 2,-0.6 -0.835 23.1-152.7 -89.0 107.1 37.5 -18.9 13.9 75 242 A Y E -d 92 0A 29 -2,-0.8 2,-0.3 16,-0.2 7,-0.2 -0.741 13.1-172.0 -85.2 120.3 35.7 -15.5 13.1 76 243 A Q E +d 93 0A 44 16,-3.9 18,-0.5 -2,-0.6 -1,-0.1 -0.426 56.0 86.5-110.1 57.4 37.8 -12.5 14.2 77 244 A T S > S- 0 0 12 3,-0.4 3,-1.8 -2,-0.3 -2,-0.1 -0.974 76.9-128.5-153.8 135.7 35.1 -9.9 13.5 78 245 A P T 3 S+ 0 0 67 0, 0.0 3,-0.1 0, 0.0 -2,-0.0 0.403 103.8 75.3 -63.4 3.0 32.2 -8.4 15.5 79 246 A A T 3 S+ 0 0 14 1,-0.2 2,-0.5 454,-0.0 454,-0.1 0.730 99.2 45.5 -82.9 -23.1 30.0 -9.1 12.5 80 247 A V < - 0 0 12 -3,-1.8 2,-0.6 2,-0.0 -3,-0.4 -0.980 66.8-163.3-127.2 123.4 30.0 -12.8 13.4 81 248 A K + 0 0 56 -2,-0.5 2,-0.3 -3,-0.1 595,-0.1 -0.929 31.5 157.0-104.7 120.9 29.5 -14.2 16.9 82 249 A S - 0 0 59 -2,-0.6 2,-0.7 -7,-0.2 -2,-0.0 -0.987 50.7 -99.2-149.6 151.0 30.7 -17.9 17.1 83 250 A D - 0 0 141 -2,-0.3 2,-0.7 590,-0.1 -10,-0.1 -0.612 37.5-161.1 -62.2 108.8 31.9 -20.8 19.2 84 251 A H - 0 0 100 -2,-0.7 -10,-0.1 1,-0.1 -1,-0.0 -0.907 8.9-169.2 -98.8 112.4 35.6 -20.8 18.7 85 252 A T - 0 0 77 -2,-0.7 -1,-0.1 1,-0.1 -11,-0.0 0.713 34.1-128.5 -70.5 -22.2 36.9 -24.2 19.7 86 253 A G S S+ 0 0 54 -3,-0.1 -1,-0.1 1,-0.0 -2,-0.0 0.224 95.7 83.3 88.9 -12.6 40.5 -22.9 19.6 87 254 A R + 0 0 123 2,-0.0 2,-0.2 0, 0.0 -3,-0.0 0.123 59.8 124.2-110.2 18.0 41.5 -25.8 17.4 88 255 A E - 0 0 19 1,-0.1 -15,-0.1 2,-0.1 -38,-0.0 -0.538 43.4-166.3 -74.7 143.2 40.4 -24.2 14.1 89 256 A I S S+ 0 0 28 -17,-0.4 -38,-2.4 -2,-0.2 2,-0.5 0.375 70.8 79.7-107.0 -1.3 42.9 -23.9 11.3 90 257 A V E -bd 51 73A 0 -18,-0.6 -16,-3.0 -40,-0.2 2,-0.4 -0.944 61.3-170.9-108.7 122.0 40.7 -21.4 9.3 91 258 A D E -bd 52 74A 6 -40,-2.5 -38,-3.3 -2,-0.5 2,-0.4 -0.909 2.9-165.9-108.6 142.8 40.7 -17.7 10.4 92 259 A L E +bd 53 75A 0 -18,-2.4 -16,-3.9 -2,-0.4 2,-0.3 -0.996 24.0 137.8-130.3 127.8 38.3 -15.1 9.1 93 260 A M E -bd 54 76A 0 -40,-2.4 -38,-2.4 -2,-0.4 -16,-0.2 -0.957 50.8 -81.2-155.0 173.8 38.8 -11.4 9.5 94 261 A C E > -b 55 0A 13 -18,-0.5 4,-1.5 -2,-0.3 3,-0.1 -0.465 41.7-113.1 -79.8 157.5 38.6 -8.0 7.9 95 262 A H H > S+ 0 0 0 -40,-2.0 4,-1.6 1,-0.2 3,-0.1 0.884 117.8 45.6 -51.7 -48.1 41.4 -6.7 5.7 96 263 A A H > S+ 0 0 33 -40,-0.3 4,-2.4 1,-0.2 -1,-0.2 0.770 106.3 60.0 -72.8 -28.6 42.3 -3.9 8.1 97 264 A T H > S+ 0 0 52 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.876 106.4 48.5 -62.0 -39.5 42.2 -6.3 11.1 98 265 A F H X S+ 0 0 1 -4,-1.5 4,-2.5 2,-0.2 -2,-0.2 0.900 111.0 47.7 -71.0 -43.7 44.9 -8.3 9.5 99 266 A T H X S+ 0 0 0 -4,-1.6 4,-1.7 2,-0.2 -2,-0.2 0.923 110.6 53.5 -62.2 -44.3 47.2 -5.3 8.7 100 267 A T H X S+ 0 0 34 -4,-2.4 4,-1.1 2,-0.2 3,-0.3 0.917 110.1 47.6 -52.2 -47.0 46.6 -4.2 12.3 101 268 A R H < S+ 0 0 50 -4,-1.9 3,-0.4 1,-0.2 -2,-0.2 0.896 109.2 53.6 -63.2 -44.1 47.7 -7.6 13.5 102 269 A L H < S+ 0 0 18 -4,-2.5 230,-0.4 1,-0.2 -1,-0.2 0.785 113.1 44.1 -57.7 -31.8 50.8 -7.5 11.2 103 270 A L H < S+ 0 0 2 -4,-1.7 -1,-0.2 -3,-0.3 -2,-0.2 0.641 102.7 83.7 -89.6 -16.0 51.8 -4.1 12.7 104 271 A S S < S- 0 0 34 -4,-1.1 260,-0.0 -3,-0.4 -3,-0.0 -0.387 91.6-101.5 -94.7 164.6 51.2 -5.1 16.4 105 272 A S S S+ 0 0 121 -2,-0.1 -1,-0.1 2,-0.1 -4,-0.1 0.845 95.2 88.2 -47.4 -45.6 53.3 -6.9 19.0 106 273 A T S S- 0 0 80 1,-0.1 2,-0.3 0, 0.0 -2,-0.2 -0.243 81.6-115.3 -67.2 148.4 51.4 -10.2 18.5 107 274 A R - 0 0 221 1,-0.0 -1,-0.1 3,-0.0 -5,-0.1 -0.639 19.0-132.2 -90.2 134.7 52.5 -12.7 15.9 108 275 A V - 0 0 28 -2,-0.3 -1,-0.0 1,-0.1 2,-0.0 -0.581 33.3-102.1 -79.0 141.9 50.3 -13.7 12.9 109 276 A P - 0 0 29 0, 0.0 2,-1.7 0, 0.0 -1,-0.1 -0.362 36.0-108.9 -58.5 146.7 49.9 -17.4 12.2 110 277 A N - 0 0 73 -3,-0.1 -60,-0.2 -2,-0.0 2,-0.1 -0.609 43.9-153.5 -81.8 84.0 52.1 -18.7 9.3 111 278 A Y - 0 0 7 -2,-1.7 -60,-0.2 1,-0.1 3,-0.1 -0.360 20.8-164.7 -66.9 133.8 49.2 -19.2 6.9 112 279 A N S S+ 0 0 42 -62,-2.2 31,-2.2 1,-0.3 2,-0.4 0.790 82.5 27.4 -79.6 -35.6 49.6 -21.8 4.1 113 280 A L E -ce 51 143A 1 -63,-2.0 -61,-2.0 29,-0.2 2,-0.4 -0.995 66.1-169.5-134.0 134.0 46.7 -20.4 2.2 114 281 A I E -ce 52 144A 3 29,-2.2 31,-2.6 -2,-0.4 2,-0.6 -0.989 1.7-168.5-128.3 125.6 45.3 -16.9 2.1 115 282 A V E -ce 53 145A 0 -63,-3.3 -61,-2.8 -2,-0.4 2,-0.7 -0.954 4.1-170.9-112.9 114.2 42.0 -15.9 0.5 116 283 A M E -ce 54 146A 0 29,-2.9 31,-2.9 -2,-0.6 3,-0.5 -0.911 7.8-156.9-108.7 109.5 41.2 -12.2 0.0 117 284 A D E S+ e 0 147A 0 -63,-2.3 31,-0.2 -2,-0.7 -57,-0.0 -0.622 80.3 17.7 -78.5 144.7 37.7 -11.4 -1.1 118 285 A E S > S+ 0 0 8 29,-1.6 3,-1.6 -2,-0.3 30,-0.2 0.957 74.9 177.9 54.6 58.5 37.4 -8.0 -2.8 119 286 A A T 3 + 0 0 1 28,-1.7 29,-0.2 -3,-0.5 -1,-0.1 0.288 69.0 67.8 -77.7 10.5 41.1 -7.8 -3.5 120 287 A H T 3 + 0 0 19 27,-0.2 -1,-0.3 31,-0.1 -2,-0.1 0.511 66.6 132.4 -98.6 -14.6 40.7 -4.5 -5.4 121 288 A F < - 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0 0 42 -29,-1.8 -26,-3.3 -2,-0.9 -21,-0.2 -0.667 32.7-159.5-148.8 75.7 37.6 -45.5 33.8 878 593 B P - 0 0 2 0, 0.0 -30,-0.3 0, 0.0 -26,-0.2 -0.280 22.9-130.4 -73.3 150.5 37.7 -42.1 35.5 879 594 B K S S+ 0 0 105 -32,-2.3 2,-0.4 -28,-0.2 -27,-0.2 0.809 98.4 40.0 -62.9 -35.1 38.4 -41.7 39.3 880 595 B W S S- 0 0 49 -33,-0.2 2,-0.5 -29,-0.1 -1,-0.1 -0.976 79.0-144.2-120.8 134.3 35.3 -39.5 39.6 881 596 B L + 0 0 16 -157,-0.4 -155,-2.4 -2,-0.4 2,-0.4 -0.854 23.4 166.4-102.7 121.8 32.0 -40.2 37.9 882 597 B D B > -b 726 0H 0 -2,-0.5 3,-2.2 -157,-0.2 4,-0.3 -0.945 25.3-153.2-131.9 112.0 29.8 -37.3 36.6 883 598 B A G >> S+ 0 0 7 -157,-2.1 4,-3.2 -2,-0.4 3,-1.3 0.673 88.4 75.7 -59.7 -21.5 27.1 -38.4 34.3 884 599 B R G 34 S+ 0 0 58 1,-0.3 -1,-0.3 2,-0.2 4,-0.2 0.762 96.1 48.8 -63.9 -24.6 27.1 -35.0 32.6 885 600 B V G <4 S+ 0 0 11 -3,-2.2 10,-0.4 1,-0.1 -1,-0.3 0.540 127.1 21.9 -91.2 -3.9 30.3 -36.0 30.8 886 601 B Y T <4 S+ 0 0 55 -3,-1.3 -2,-0.2 -4,-0.3 6,-0.2 0.594 99.7 79.0-136.7 -13.2 29.0 -39.4 29.6 887 602 B A S < S+ 0 0 54 -4,-3.2 -3,-0.1 -5,-0.1 -2,-0.1 0.978 90.2 54.1 -66.8 -62.5 25.2 -39.6 29.5 888 603 B D S > S- 0 0 62 -5,-0.3 4,-2.3 -4,-0.2 3,-0.2 -0.596 87.8-130.9 -71.5 131.3 24.6 -37.8 26.2 889 604 B P H > S+ 0 0 71 0, 0.0 4,-1.9 0, 0.0 -1,-0.1 0.801 107.2 50.9 -55.4 -34.1 26.7 -39.4 23.4 890 605 B M H > S+ 0 0 101 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.860 108.6 52.0 -73.7 -36.4 28.0 -36.0 22.2 891 606 B A H > S+ 0 0 21 -3,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.912 109.7 50.4 -59.0 -44.5 29.1 -35.2 25.8 892 607 B L H X S+ 0 0 4 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.885 107.0 53.3 -63.9 -39.2 30.9 -38.5 25.9 893 608 B K H X S+ 0 0 99 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.934 110.4 48.1 -59.8 -44.6 32.7 -37.7 22.6 894 609 B D H X S+ 0 0 78 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.892 112.0 49.1 -57.9 -43.7 33.9 -34.4 24.1 895 610 B F H X S+ 0 0 4 -4,-2.2 4,-2.8 -10,-0.4 -1,-0.2 0.826 107.4 54.8 -71.3 -31.8 35.0 -36.2 27.2 896 611 B K H X S+ 0 0 50 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.898 108.4 49.5 -62.7 -43.1 36.8 -38.8 25.1 897 612 B E H X>S+ 0 0 71 -4,-2.1 5,-2.5 2,-0.2 4,-0.7 0.918 112.0 48.4 -60.4 -45.8 38.7 -35.9 23.4 898 613 B F H ><5S+ 0 0 1 -4,-2.3 3,-1.4 4,-0.2 5,-0.4 0.942 111.1 49.4 -56.6 -52.0 39.5 -34.5 26.9 899 614 B A H 3<5S+ 0 0 2 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.820 107.1 57.5 -57.5 -36.0 40.7 -38.0 28.1 900 615 B S H 3<5S- 0 0 8 -4,-2.0 -31,-1.7 -5,-0.1 -1,-0.3 0.675 117.6-111.0 -64.6 -23.1 42.9 -38.2 24.9 901 616 B G T <<5S+ 0 0 16 -3,-1.4 -3,-0.2 -4,-0.7 -2,-0.1 0.595 85.9 121.6 91.7 16.4 44.8 -35.0 25.7 902 617 B R < 0 0 118 -5,-2.5 -4,-0.2 -6,-0.2 -5,-0.1 0.354 360.0 360.0 -96.2 3.5 43.1 -33.2 22.7 903 618 B K 0 0 12 -6,-0.4 -5,-0.2 -5,-0.4 -1,-0.2 0.321 360.0 360.0-131.2 360.0 41.6 -30.5 25.0