==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/DNA 17-NOV-09 3KQK . COMPND 2 MOLECULE: SERINE PROTEASE/NTPASE/HELICASE NS3; . SOURCE 2 ORGANISM_SCIENTIFIC: HEPATITIS C VIRUS; . AUTHOR M.GU,C.M.RICE . 872 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 37209.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 577 66.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 129 14.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 30 3.4 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 0.7 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 . 4 0.5 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 . 71 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 84 9.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 215 24.7 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 0 2 1 3 3 4 1 1 4 2 1 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 8 2 3 8 8 1 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 . 3 2 0 0 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 ANTIPARALLEL BRIDGES PER LADDER . 2 3 0 0 2 2 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 1 189 A S 0 0 172 0, 0.0 3,-0.1 0, 0.0 25,-0.0 0.000 360.0 360.0 360.0 -44.1 26.8 4.3 -3.7 2 190 A P - 0 0 34 0, 0.0 3,-0.1 0, 0.0 12,-0.1 -0.484 360.0 -76.4 -75.4 146.7 24.8 3.5 -6.9 3 191 A P - 0 0 32 0, 0.0 9,-0.1 0, 0.0 11,-0.0 -0.128 57.7-115.1 -43.3 116.6 26.5 1.4 -9.7 4 192 A A - 0 0 87 1,-0.1 26,-0.0 -3,-0.1 0, 0.0 -0.147 26.2-109.4 -55.4 150.8 29.0 3.6 -11.4 5 193 A V - 0 0 21 -3,-0.1 -1,-0.1 124,-0.1 124,-0.1 -0.757 37.8-144.2 -88.6 108.1 28.3 4.4 -15.1 6 194 A P - 0 0 40 0, 0.0 4,-0.1 0, 0.0 -1,-0.0 -0.092 17.9-114.7 -66.4 166.8 31.0 2.6 -17.2 7 195 A Q S S+ 0 0 170 2,-0.1 2,-0.1 0, 0.0 3,-0.1 0.991 100.8 40.1 -65.2 -61.0 32.6 3.9 -20.4 8 196 A T S S- 0 0 88 1,-0.1 2,-0.1 -3,-0.0 120,-0.1 -0.459 110.8 -76.0 -86.4 161.6 31.1 1.2 -22.6 9 197 A F + 0 0 26 -2,-0.1 2,-0.3 118,-0.1 120,-0.2 -0.362 60.6 170.1 -59.4 127.1 27.5 -0.1 -22.4 10 198 A Q E -a 129 0A 88 118,-0.9 120,-1.6 -2,-0.1 2,-0.6 -0.964 31.3-134.3-140.4 155.1 27.1 -2.6 -19.4 11 199 A V E -a 130 0A 55 -2,-0.3 2,-0.3 118,-0.2 120,-0.2 -0.939 29.2-177.3-112.8 117.6 24.3 -4.3 -17.6 12 200 A A E -a 131 0A 28 118,-2.8 120,-2.4 -2,-0.6 2,-0.2 -0.882 17.8-136.9-119.8 149.7 24.5 -4.2 -13.8 13 201 A H E -a 132 0A 67 -2,-0.3 2,-0.2 118,-0.2 120,-0.2 -0.504 10.2-162.4 -93.6 165.8 22.4 -5.7 -11.1 14 202 A L E -a 133 0A 35 118,-1.4 120,-2.0 -2,-0.2 2,-0.6 -0.752 6.0-175.8-153.9 100.5 21.2 -4.0 -7.9 15 203 A H E +a 134 0A 104 -2,-0.2 120,-0.2 118,-0.2 118,-0.1 -0.885 19.4 149.3-105.1 113.5 20.0 -6.0 -4.9 16 204 A A - 0 0 39 118,-1.2 6,-0.1 -2,-0.6 3,-0.1 -0.999 38.8-120.3-145.5 139.2 18.7 -4.0 -1.9 17 205 A P S S+ 0 0 109 0, 0.0 3,-0.2 0, 0.0 119,-0.1 -0.127 87.5 36.8 -70.4 171.5 16.1 -4.6 0.8 18 206 A T S > S- 0 0 77 1,-0.2 3,-0.7 117,-0.1 2,-0.1 0.959 88.7-130.6 47.9 66.6 13.0 -2.4 1.5 19 207 A G T 3 S+ 0 0 39 1,-0.2 -1,-0.2 2,-0.1 116,-0.0 -0.263 79.0 84.1 -49.4 112.0 12.3 -1.6 -2.2 20 208 A S T 3 S+ 0 0 12 -3,-0.2 3,-0.4 -2,-0.1 -1,-0.2 0.133 75.8 55.4-175.7 -47.8 11.9 2.1 -2.3 21 209 A G S X>>S+ 0 0 12 -3,-0.7 5,-1.8 1,-0.2 3,-1.3 0.806 95.8 69.1 -75.0 -30.0 15.2 4.0 -2.5 22 210 A K T 345S+ 0 0 11 1,-0.3 -1,-0.2 3,-0.2 -3,-0.1 0.784 106.7 39.8 -58.6 -28.0 16.3 2.2 -5.6 23 211 A S T 345S+ 0 0 0 -3,-0.4 -1,-0.3 3,-0.1 -2,-0.2 0.399 131.8 23.1-103.2 1.5 13.6 4.0 -7.5 24 212 A T T <>5S+ 0 0 1 -3,-1.3 4,-1.2 -4,-0.2 -3,-0.2 0.609 127.2 34.9-128.0 -59.7 13.9 7.4 -5.9 25 213 A K H X5S+ 0 0 66 -4,-1.2 4,-2.3 -5,-0.2 3,-0.4 0.980 117.8 50.1 -65.3 -58.7 17.4 7.9 -4.4 26 214 A V H > S+ 0 0 0 0, 0.0 4,-1.9 0, 0.0 -1,-0.3 0.858 112.1 55.9 -57.5 -30.3 17.9 7.7 -10.0 28 216 A A H X S+ 0 0 15 -4,-1.2 4,-1.3 -3,-0.4 -2,-0.2 0.891 103.6 52.8 -68.1 -41.1 18.3 11.0 -8.2 29 217 A A H >X S+ 0 0 32 -4,-2.3 3,-1.2 -3,-0.3 4,-0.8 0.980 109.7 47.7 -57.3 -59.5 22.1 10.5 -7.6 30 218 A Y H ><>S+ 0 0 1 -4,-1.8 3,-2.0 1,-0.3 5,-0.9 0.909 108.2 54.3 -48.7 -50.3 22.7 9.8 -11.3 31 219 A A H ><5S+ 0 0 19 -4,-1.9 3,-1.4 1,-0.3 -1,-0.3 0.810 99.7 63.2 -57.7 -27.6 20.7 12.8 -12.4 32 220 A A H <<5S+ 0 0 86 -4,-1.3 -1,-0.3 -3,-1.2 -2,-0.2 0.766 99.1 55.7 -66.3 -25.5 22.9 14.9 -10.1 33 221 A Q T <<5S- 0 0 118 -3,-2.0 -1,-0.3 -4,-0.8 -2,-0.2 0.018 129.4 -95.5 -95.7 24.9 25.9 13.9 -12.3 34 222 A G T < 5S+ 0 0 67 -3,-1.4 2,-0.3 1,-0.2 -3,-0.2 0.896 77.7 148.6 63.8 40.4 24.2 15.3 -15.4 35 223 A Y < - 0 0 62 -5,-0.9 2,-0.6 -6,-0.1 -1,-0.2 -0.821 47.9-130.9-108.7 148.3 22.8 11.9 -16.4 36 224 A K - 0 0 110 -2,-0.3 62,-2.3 41,-0.1 61,-1.9 -0.867 33.5-168.7 -96.3 123.5 19.6 11.1 -18.3 37 225 A V E -bc 77 98A 0 39,-3.4 41,-2.3 -2,-0.6 2,-0.5 -0.937 20.6-167.2-124.3 141.1 17.6 8.4 -16.5 38 226 A L E -bc 78 99A 7 60,-2.3 62,-3.1 -2,-0.4 2,-0.7 -0.984 9.7-164.1-122.1 119.3 14.6 6.2 -17.3 39 227 A V E -bc 79 100A 0 39,-3.3 41,-2.3 -2,-0.5 2,-0.4 -0.903 7.5-160.1-110.3 109.9 13.0 4.3 -14.4 40 228 A L E +bc 80 101A 0 60,-3.2 62,-2.3 -2,-0.7 41,-0.2 -0.738 13.2 175.7 -92.8 132.5 10.7 1.5 -15.5 41 229 A N E -b 81 0A 3 39,-2.5 41,-0.9 -2,-0.4 42,-0.2 -0.994 30.7-141.8-136.6 140.2 8.1 0.2 -13.1 42 230 A P S S+ 0 0 41 0, 0.0 41,-0.3 0, 0.0 -1,-0.1 0.931 82.1 75.3 -66.4 -44.2 5.4 -2.4 -13.6 43 231 A S > - 0 0 39 1,-0.1 4,-1.7 38,-0.1 -2,-0.1 -0.403 63.8-155.4 -72.2 141.7 2.7 -0.6 -11.5 44 232 A V H > S+ 0 0 62 2,-0.2 4,-2.1 3,-0.1 5,-0.2 0.862 97.4 54.4 -81.1 -37.2 0.9 2.5 -12.8 45 233 A A H > S+ 0 0 38 2,-0.2 4,-3.0 1,-0.2 -1,-0.1 0.911 111.1 45.5 -60.6 -45.3 0.2 3.6 -9.2 46 234 A A H > S+ 0 0 26 2,-0.2 4,-2.5 1,-0.2 5,-0.4 0.988 108.5 54.3 -63.8 -56.8 3.9 3.5 -8.4 47 235 A T H X S+ 0 0 0 -4,-1.7 4,-0.9 1,-0.3 -1,-0.2 0.850 115.8 41.4 -45.5 -38.9 5.0 5.2 -11.6 48 236 A L H X S+ 0 0 46 -4,-2.1 4,-1.5 2,-0.2 -1,-0.3 0.903 111.0 57.3 -75.3 -42.1 2.7 8.0 -10.7 49 237 A G H X S+ 0 0 42 -4,-3.0 4,-2.0 1,-0.2 3,-0.3 0.923 105.0 49.7 -52.9 -52.1 3.6 7.9 -7.0 50 238 A F H X S+ 0 0 34 -4,-2.5 4,-2.8 1,-0.2 5,-0.3 0.829 102.7 63.3 -57.8 -36.8 7.3 8.5 -7.6 51 239 A G H X S+ 0 0 6 -4,-0.9 4,-1.0 -5,-0.4 -1,-0.2 0.944 108.5 38.9 -56.2 -49.9 6.5 11.4 -9.8 52 240 A A H X S+ 0 0 69 -4,-1.5 4,-1.6 -3,-0.3 5,-0.2 0.900 115.7 53.0 -69.3 -39.5 5.0 13.4 -7.0 53 241 A Y H X S+ 0 0 35 -4,-2.0 4,-3.0 1,-0.2 5,-0.3 0.921 103.8 55.0 -61.8 -47.0 7.5 12.3 -4.4 54 242 A M H X S+ 0 0 0 -4,-2.8 4,-2.5 2,-0.2 6,-1.3 0.853 104.7 57.8 -55.5 -35.5 10.6 13.3 -6.5 55 243 A S H X S+ 0 0 27 -4,-1.0 4,-1.2 -5,-0.3 -1,-0.2 0.991 116.4 29.6 -59.6 -62.1 9.1 16.7 -6.7 56 244 A K H < S+ 0 0 54 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.762 125.3 48.3 -71.6 -23.4 8.9 17.4 -3.0 57 245 A A H < S+ 0 0 6 -4,-3.0 -1,-0.2 -5,-0.2 -3,-0.2 0.792 131.9 12.2 -88.7 -29.0 11.9 15.2 -2.1 58 246 A H H < S- 0 0 62 -4,-2.5 -2,-0.2 -5,-0.3 -3,-0.2 0.108 97.0-116.8-134.6 20.3 14.4 16.4 -4.7 59 247 A G S < S+ 0 0 70 -4,-1.2 2,-0.4 1,-0.1 -4,-0.2 0.709 77.5 119.2 50.4 24.6 12.8 19.6 -6.0 60 248 A I - 0 0 50 -6,-1.3 -2,-0.2 -5,-0.1 -3,-0.2 -0.982 59.9-141.6-126.7 132.4 12.5 18.1 -9.5 61 249 A D - 0 0 105 -2,-0.4 14,-0.4 -6,-0.1 16,-0.1 -0.766 28.2-154.3 -89.3 99.5 9.4 17.4 -11.6 62 250 A P - 0 0 4 0, 0.0 2,-0.3 0, 0.0 16,-0.2 -0.186 22.7 -99.5 -70.5 163.8 10.1 14.1 -13.4 63 251 A N E -d 78 0A 12 14,-2.4 16,-3.5 12,-0.1 2,-0.5 -0.681 36.3-151.8 -83.2 138.9 8.5 13.0 -16.6 64 252 A I E +dE 79 71A 8 7,-2.1 7,-4.0 -2,-0.3 2,-0.5 -0.961 16.0 178.5-118.0 125.9 5.6 10.7 -16.2 65 253 A R E +dE 80 70A 60 14,-2.3 16,-1.5 -2,-0.5 2,-0.3 -0.922 20.0 137.6-130.4 105.7 4.7 8.2 -18.9 66 254 A T - 0 0 0 3,-1.2 -2,-0.0 -2,-0.5 -22,-0.0 -0.868 63.4 -98.2-137.5 171.0 1.8 5.8 -18.3 67 255 A G S S+ 0 0 59 -2,-0.3 -1,-0.1 1,-0.1 3,-0.1 0.965 118.5 31.7 -55.5 -55.4 -1.1 4.4 -20.2 68 256 A V S S+ 0 0 120 1,-0.2 2,-0.4 -3,-0.1 -1,-0.1 1.000 125.2 23.7 -67.1 -75.2 -3.6 6.9 -18.8 69 257 A R - 0 0 125 2,-0.0 -3,-1.2 -4,-0.0 2,-0.4 -0.771 61.1-168.2-102.1 141.3 -1.8 10.1 -18.0 70 258 A T E -E 65 0A 60 -2,-0.4 2,-0.4 -5,-0.2 -5,-0.2 -0.991 3.2-172.6-127.6 134.3 1.4 11.4 -19.6 71 259 A I E -E 64 0A 68 -7,-4.0 -7,-2.1 -2,-0.4 2,-0.6 -0.988 4.3-167.4-130.3 124.5 3.5 14.3 -18.3 72 260 A T + 0 0 110 -2,-0.4 -9,-0.1 -9,-0.2 6,-0.0 -0.941 21.4 154.4-113.9 121.7 6.4 15.9 -20.1 73 261 A T - 0 0 57 -2,-0.6 -1,-0.1 2,-0.1 -10,-0.1 0.667 54.0-120.6-114.7 -28.5 8.6 18.3 -18.1 74 262 A G + 0 0 69 1,-0.3 4,-0.1 3,-0.1 -2,-0.1 0.455 61.0 148.7 97.9 2.0 11.9 18.0 -19.8 75 263 A A - 0 0 24 -14,-0.4 -1,-0.3 2,-0.2 -12,-0.1 -0.246 61.5-113.7 -68.9 158.7 13.7 16.9 -16.6 76 264 A P S S+ 0 0 62 0, 0.0 -39,-3.4 0, 0.0 2,-0.4 0.515 99.0 69.7 -70.2 -3.9 16.7 14.5 -16.7 77 265 A I E -b 37 0A 0 -41,-0.2 -14,-2.4 -16,-0.1 2,-0.4 -0.954 61.5-173.6-119.9 136.7 14.6 11.8 -15.0 78 266 A T E -bd 38 63A 5 -41,-2.3 -39,-3.3 -2,-0.4 2,-0.5 -0.985 7.3-161.0-132.8 125.0 11.7 9.9 -16.5 79 267 A Y E +bd 39 64A 0 -16,-3.5 -14,-2.3 -2,-0.4 2,-0.3 -0.899 25.6 153.8-104.3 131.9 9.3 7.5 -14.7 80 268 A S E -bd 40 65A 2 -41,-2.3 -39,-2.5 -2,-0.5 2,-0.2 -0.978 39.8-113.4-152.7 160.4 7.3 5.1 -16.8 81 269 A T E > -b 41 0A 7 -16,-1.5 4,-2.3 -2,-0.3 5,-0.1 -0.615 30.0-120.2 -92.4 155.4 5.6 1.7 -16.8 82 270 A Y H > S+ 0 0 0 -41,-0.9 4,-2.8 -2,-0.2 5,-0.3 0.947 114.2 56.4 -61.1 -44.4 6.8 -1.2 -18.9 83 271 A G H > S+ 0 0 19 -41,-0.3 4,-2.3 1,-0.2 -1,-0.2 0.930 110.8 42.0 -51.3 -50.7 3.4 -1.3 -20.6 84 272 A K H > S+ 0 0 41 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.850 112.0 56.6 -66.4 -33.4 3.7 2.3 -21.7 85 273 A F H ><>S+ 0 0 10 -4,-2.3 5,-2.0 2,-0.2 3,-0.6 0.933 110.0 43.9 -61.6 -48.1 7.4 1.8 -22.6 86 274 A L H ><5S+ 0 0 6 -4,-2.8 3,-2.1 1,-0.2 -2,-0.2 0.914 109.5 57.2 -63.0 -44.8 6.5 -1.0 -25.0 87 275 A A H 3<5S+ 0 0 61 -4,-2.3 -1,-0.2 -5,-0.3 -2,-0.2 0.701 102.1 56.7 -61.1 -20.8 3.6 1.0 -26.3 88 276 A D T <<5S- 0 0 68 -4,-0.9 -1,-0.3 -3,-0.6 -2,-0.2 0.472 126.1 -99.5 -90.3 -1.8 6.1 3.8 -27.2 89 277 A G T < 5 - 0 0 47 -3,-2.1 2,-0.3 -4,-0.2 -3,-0.2 0.390 57.7 -96.4 100.8 -1.8 8.1 1.4 -29.3 90 278 A G S -cf 40 132A 0 30,-3.6 32,-0.9 -2,-0.5 3,-0.7 -0.833 19.5-160.5-102.5 95.8 14.4 -1.8 -14.5 102 290 A D T 3 + 0 0 0 -62,-2.3 32,-0.2 -2,-1.0 30,-0.0 -0.446 69.5 13.4 -78.1 150.1 12.7 -1.6 -11.2 103 291 A E T > S+ 0 0 51 30,-0.4 3,-2.6 1,-0.2 -1,-0.2 0.850 74.1 168.7 55.0 36.2 11.0 -4.7 -9.6 104 292 A C T < + 0 0 3 29,-2.1 -1,-0.2 -3,-0.7 30,-0.1 0.420 63.1 76.1 -61.2 3.2 12.8 -6.8 -12.2 105 293 A H T 3 + 0 0 28 28,-0.2 -1,-0.3 229,-0.1 191,-0.2 0.617 67.7 115.8 -89.6 -11.8 11.8 -9.9 -10.2 106 294 A S < - 0 0 22 -3,-2.6 6,-0.0 1,-0.1 0, 0.0 -0.374 51.0-163.0 -58.9 123.5 8.3 -9.6 -11.6 107 295 A T + 0 0 51 -2,-0.2 2,-0.3 4,-0.1 -1,-0.1 -0.080 46.0 122.8-101.4 35.2 7.4 -12.5 -13.8 108 296 A D S > S- 0 0 63 1,-0.1 4,-2.6 190,-0.1 3,-0.4 -0.715 72.4-114.5 -96.1 149.3 4.5 -11.0 -15.6 109 297 A S H > S+ 0 0 19 -2,-0.3 4,-3.1 1,-0.2 5,-0.4 0.900 112.0 52.6 -46.7 -53.8 4.4 -10.8 -19.4 110 298 A T H > S+ 0 0 43 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.886 113.3 42.9 -53.1 -44.9 4.5 -7.0 -19.5 111 299 A T H > S+ 0 0 0 -3,-0.4 4,-3.4 2,-0.2 5,-0.3 0.955 114.8 50.2 -67.3 -47.5 7.5 -6.7 -17.3 112 300 A I H X S+ 0 0 0 -4,-2.6 4,-2.7 1,-0.2 -2,-0.2 0.908 112.8 44.7 -59.7 -45.2 9.3 -9.5 -19.0 113 301 A L H X S+ 0 0 1 -4,-3.1 4,-1.4 -5,-0.3 -1,-0.2 0.878 115.1 51.3 -66.8 -33.2 8.8 -8.2 -22.5 114 302 A G H X S+ 0 0 0 -4,-1.7 4,-2.2 -5,-0.4 3,-0.4 0.968 112.4 43.0 -66.3 -52.2 9.7 -4.8 -21.3 115 303 A I H X S+ 0 0 0 -4,-3.4 4,-2.3 1,-0.3 -2,-0.2 0.913 112.9 53.3 -59.9 -43.5 12.9 -5.9 -19.7 116 304 A G H < S+ 0 0 0 -4,-2.7 4,-0.4 -5,-0.3 -1,-0.3 0.815 107.9 52.4 -62.7 -28.3 13.7 -8.1 -22.7 117 305 A T H >X S+ 0 0 0 -4,-1.4 4,-1.8 -3,-0.4 3,-0.8 0.906 108.2 49.3 -73.6 -42.1 13.2 -5.0 -24.9 118 306 A V H 3X S+ 0 0 0 -4,-2.2 4,-2.5 1,-0.2 3,-0.2 0.918 107.7 54.7 -63.3 -42.0 15.6 -2.9 -22.9 119 307 A L H 3< S+ 0 0 27 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.648 115.8 40.3 -68.7 -10.5 18.3 -5.6 -23.0 120 308 A D H <4 S+ 0 0 67 -3,-0.8 -1,-0.2 -4,-0.4 -2,-0.2 0.648 126.5 28.7-109.5 -21.4 18.0 -5.6 -26.7 121 309 A Q H X S+ 0 0 41 -4,-1.8 4,-1.8 -3,-0.2 6,-0.2 0.488 94.8 90.6-117.5 -8.9 17.7 -2.0 -27.6 122 310 A A H X>S+ 0 0 1 -4,-2.5 5,-1.5 -5,-0.3 4,-0.8 0.956 91.8 38.4 -53.5 -62.3 19.6 -0.3 -24.7 123 311 A E H >45S+ 0 0 124 1,-0.2 3,-1.3 -5,-0.2 -1,-0.2 0.922 117.0 49.2 -58.7 -49.5 23.1 -0.2 -26.2 124 312 A T H 345S+ 0 0 130 1,-0.3 -1,-0.2 -4,-0.2 -2,-0.2 0.805 107.1 58.9 -61.8 -27.3 22.0 0.7 -29.7 125 313 A A H 3<5S- 0 0 12 -4,-1.8 -31,-4.1 -3,-0.3 -30,-0.3 0.685 123.0-103.8 -75.8 -17.7 19.8 3.4 -28.2 126 314 A G T <<5 + 0 0 24 -3,-1.3 -3,-0.2 -4,-0.8 -2,-0.1 0.197 70.0 146.5 115.0 -14.9 22.8 5.1 -26.7 127 315 A A < - 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0 0 52 -2,-0.3 3,-1.8 -53,-0.2 4,-0.6 -0.361 24.7-117.8 -77.9 156.0 5.7 -20.8 -16.3 300 488 A S H >> S+ 0 0 1 1,-0.3 4,-1.8 2,-0.2 3,-0.8 0.776 110.1 73.0 -61.1 -28.6 6.1 -21.3 -20.1 301 489 A S H 3> S+ 0 0 0 1,-0.3 4,-1.5 2,-0.2 -1,-0.3 0.789 89.6 62.3 -59.3 -23.4 2.5 -20.0 -20.5 302 490 A V H <> S+ 0 0 14 -3,-1.8 4,-1.7 2,-0.2 -1,-0.3 0.887 100.1 50.8 -69.0 -38.5 3.9 -16.6 -19.6 303 491 A L H S+ 0 0 12 -4,-3.3 4,-2.8 1,-0.2 5,-2.0 0.853 110.1 56.9 -64.7 -35.3 0.5 -9.3 -26.3 310 498 A G H <5S+ 0 0 0 -4,-2.3 6,-3.8 -5,-0.2 -1,-0.2 0.871 115.5 38.0 -64.0 -32.4 3.1 -8.7 -28.9 311 499 A C H <5S+ 0 0 27 -4,-1.8 -2,-0.2 -3,-0.3 -1,-0.2 0.871 125.3 35.6 -84.6 -40.4 0.5 -9.6 -31.5 312 500 A A H <5S+ 0 0 6 -4,-3.2 -3,-0.2 -5,-0.2 -2,-0.2 0.804 134.0 13.9 -85.1 -31.4 -2.5 -8.0 -29.9 313 501 A W T <5S+ 0 0 137 -4,-2.8 -3,-0.2 -5,-0.3 -4,-0.1 0.810 126.2 36.7-114.1 -44.4 -1.0 -4.9 -28.3 314 502 A Y S - 0 0 68 -2,-0.5 4,-2.6 1,-0.1 5,-0.2 -0.286 30.6-107.8 -64.7 156.2 5.8 -10.1 -35.2 318 506 A P H > S+ 0 0 19 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.932 122.2 51.8 -51.2 -45.5 6.5 -13.4 -33.5 319 507 A A H > S+ 0 0 48 1,-0.2 4,-1.3 2,-0.2 3,-0.3 0.955 109.3 49.0 -55.2 -53.1 10.1 -13.2 -34.7 320 508 A E H >> S+ 0 0 87 1,-0.3 4,-1.4 2,-0.2 3,-0.6 0.903 109.3 52.9 -52.4 -46.8 10.5 -9.7 -33.3 321 509 A T H 3X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 -1,-0.3 0.884 103.1 58.5 -60.4 -36.8 9.1 -10.8 -30.0 322 510 A S H 3X S+ 0 0 0 -4,-2.2 4,-2.9 -3,-0.3 -1,-0.2 0.841 99.4 58.4 -64.2 -31.2 11.6 -13.7 -29.9 323 511 A V H < S+ 0 0 2 -4,-1.6 3,-1.1 1,-0.2 -1,-0.2 0.913 113.2 46.5 -61.2 -43.9 15.9 -11.6 -21.3 329 517 A L H 3< S+ 0 0 48 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.660 109.6 54.9 -75.3 -13.9 16.5 -15.4 -21.2 330 518 A N T 3< S+ 0 0 137 -4,-1.4 -1,-0.2 -3,-0.3 -2,-0.2 0.313 90.9 89.7 -99.3 7.1 20.2 -14.9 -22.1 331 519 A T S X S- 0 0 30 -3,-1.1 3,-0.5 -4,-0.2 -1,-0.0 -0.920 73.3-134.9-112.1 116.1 20.8 -12.5 -19.2 332 520 A P T 3 S+ 0 0 101 0, 0.0 -2,-0.1 0, 0.0 -3,-0.0 -0.158 81.8 43.0 -64.5 155.1 21.9 -14.0 -15.8 333 521 A G T 3 S+ 0 0 36 1,-0.3 3,-0.0 -320,-0.0 0, 0.0 0.644 91.6 104.7 85.8 13.0 20.4 -12.9 -12.5 334 522 A L S < S- 0 0 5 -3,-0.5 -1,-0.3 -6,-0.1 -229,-0.1 -0.824 83.8 -74.0-122.4 163.6 16.8 -12.8 -13.8 335 523 A P - 0 0 6 0, 0.0 2,-0.2 0, 0.0 -38,-0.2 -0.282 55.0-139.0 -56.7 137.6 13.8 -15.2 -13.3 336 524 A V B +q 297 0G 91 -40,-2.0 -38,-1.6 -3,-0.0 2,-0.3 -0.648 25.7 168.3-104.9 159.7 14.2 -18.4 -15.3 337 525 A C - 0 0 23 -2,-0.2 -38,-0.1 -40,-0.2 3,-0.0 -0.978 47.2 -75.5-163.9 149.7 11.9 -20.5 -17.4 338 526 A Q - 0 0 130 -40,-0.3 2,-1.0 -2,-0.3 0, 0.0 -0.270 54.6-113.6 -52.1 129.5 12.0 -23.3 -19.9 339 527 A D + 0 0 104 1,-0.2 -1,-0.1 -10,-0.1 4,-0.1 -0.540 57.8 147.3 -71.2 101.6 13.2 -22.0 -23.2 340 528 A H > + 0 0 38 -2,-1.0 4,-2.7 1,-0.1 5,-0.4 0.081 27.6 118.1-123.1 23.6 10.2 -22.3 -25.5 341 529 A L H > S+ 0 0 1 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.903 76.6 51.0 -56.7 -43.4 10.7 -19.3 -27.7 342 530 A E H > S+ 0 0 165 2,-0.2 4,-2.0 3,-0.2 -1,-0.2 0.903 114.4 43.2 -62.6 -43.5 11.1 -21.4 -30.8 343 531 A F H > S+ 0 0 30 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.978 116.7 43.9 -65.8 -61.0 7.8 -23.3 -30.1 344 532 A W H X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 5,-0.2 0.900 114.1 52.5 -54.2 -40.8 5.7 -20.4 -29.1 345 533 A E H X S+ 0 0 47 -4,-2.6 4,-1.8 -5,-0.4 -1,-0.2 0.928 109.0 48.9 -62.8 -43.6 7.1 -18.3 -32.0 346 534 A S H X S+ 0 0 32 -4,-2.0 4,-0.9 -5,-0.2 -1,-0.2 0.906 109.4 53.6 -63.6 -40.0 6.3 -21.0 -34.5 347 535 A V H >X S+ 0 0 0 -4,-2.5 3,-1.3 1,-0.2 4,-0.5 0.969 110.6 44.5 -60.0 -52.6 2.7 -21.4 -33.2 348 536 A F H >< S+ 0 0 4 -4,-2.4 3,-1.1 1,-0.3 -1,-0.2 0.803 102.0 67.7 -64.2 -25.6 1.9 -17.7 -33.5 349 537 A T H 3< S+ 0 0 68 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.810 100.8 50.0 -62.6 -28.3 3.5 -17.5 -36.9 350 538 A G H << S+ 0 0 14 -3,-1.3 2,-1.7 -4,-0.9 -1,-0.3 0.604 86.7 87.4 -87.8 -11.2 0.7 -19.7 -38.1 351 539 A L << + 0 0 1 -3,-1.1 3,-0.4 -4,-0.5 2,-0.2 -0.437 64.5 154.1 -88.1 67.8 -2.1 -17.6 -36.6 352 540 A T + 0 0 74 -2,-1.7 -2,-0.0 1,-0.2 -3,-0.0 -0.564 45.4 25.6 -97.2 158.5 -2.5 -15.3 -39.5 353 541 A H S S- 0 0 157 -2,-0.2 -1,-0.2 1,-0.1 3,-0.1 0.829 74.3-178.2 62.9 37.5 -5.4 -13.2 -40.8 354 542 A I - 0 0 30 -3,-0.4 2,-0.6 1,-0.1 -1,-0.1 -0.199 38.6 -92.5 -61.2 160.3 -7.2 -12.9 -37.5 355 543 A D > - 0 0 48 19,-0.3 4,-2.6 1,-0.2 5,-0.2 -0.697 28.8-148.4 -80.7 119.1 -10.5 -11.0 -37.5 356 544 A A H > S+ 0 0 81 -2,-0.6 4,-2.2 1,-0.2 -1,-0.2 0.882 96.0 49.0 -52.0 -46.7 -9.9 -7.4 -36.7 357 545 A H H > S+ 0 0 119 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.957 111.4 47.1 -61.9 -53.1 -13.2 -7.0 -34.9 358 546 A F H > S+ 0 0 19 1,-0.2 4,-2.4 2,-0.2 5,-0.3 0.913 111.1 52.6 -54.6 -45.7 -12.9 -10.1 -32.8 359 547 A L H X S+ 0 0 24 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.909 108.4 51.6 -56.7 -46.1 -9.4 -9.1 -31.7 360 548 A S H X S+ 0 0 57 -4,-2.2 4,-2.6 -5,-0.2 -1,-0.2 0.894 110.3 48.7 -56.4 -45.4 -10.6 -5.7 -30.7 361 549 A Q H X S+ 0 0 55 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.868 110.3 47.9 -66.9 -42.4 -13.4 -7.2 -28.6 362 550 A T H <>S+ 0 0 7 -4,-2.4 5,-1.6 2,-0.2 4,-0.4 0.891 114.6 48.3 -68.0 -35.4 -11.2 -9.7 -26.7 363 551 A K H ><5S+ 0 0 54 -4,-2.1 3,-1.5 -5,-0.3 -2,-0.2 0.951 112.7 47.6 -66.6 -47.0 -8.7 -6.9 -26.0 364 552 A Q H 3<5S+ 0 0 167 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.793 107.0 57.5 -62.9 -30.7 -11.4 -4.6 -24.9 365 553 A A T 3<5S- 0 0 40 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.578 107.3-128.8 -76.5 -10.5 -12.9 -7.3 -22.7 366 554 A G T < 5 + 0 0 60 -3,-1.5 -3,-0.2 -4,-0.4 2,-0.1 0.724 49.4 163.3 69.2 22.3 -9.5 -7.5 -20.9 367 555 A D < - 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0 0 4 -24,-1.1 28,-1.2 1,-0.1 2,-0.2 0.007 31.4-131.1 -54.3 163.5 18.3 17.6 20.9 703 454 B D B > -i 730 0N 36 26,-0.2 4,-2.3 -24,-0.0 5,-0.2 -0.433 35.4 -82.2-108.0-175.1 20.3 14.4 21.3 704 455 B A H > S+ 0 0 1 26,-1.2 4,-2.4 -127,-0.3 5,-0.2 0.923 125.9 49.6 -56.0 -50.7 20.5 11.2 19.2 705 456 B V H > S+ 0 0 15 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.898 111.6 47.8 -56.8 -48.1 17.4 9.6 20.8 706 457 B S H > S+ 0 0 10 2,-0.2 4,-3.1 1,-0.2 5,-0.2 0.936 112.1 49.3 -59.3 -49.4 15.2 12.7 20.3 707 458 B R H X S+ 0 0 9 -4,-2.3 4,-2.5 1,-0.2 5,-0.2 0.879 111.4 50.5 -58.6 -40.6 16.3 13.1 16.7 708 459 B S H X S+ 0 0 32 -4,-2.4 4,-2.4 -5,-0.2 -1,-0.2 0.906 113.6 43.5 -66.4 -42.5 15.6 9.5 16.0 709 460 B Q H < S+ 0 0 113 -4,-2.3 4,-0.4 2,-0.2 -2,-0.2 0.953 113.6 50.8 -67.6 -49.3 12.1 9.6 17.5 710 461 B R H >< S+ 0 0 4 -4,-3.1 3,-1.3 1,-0.2 -2,-0.2 0.959 118.5 38.5 -50.7 -56.5 11.3 12.9 15.8 711 462 B R H >< S+ 0 0 20 -4,-2.5 3,-1.9 1,-0.3 -1,-0.2 0.840 104.5 69.4 -63.5 -36.8 12.4 11.5 12.4 712 463 B G T 3< S+ 0 0 32 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.493 78.7 81.2 -63.5 -2.1 11.0 8.1 13.1 713 464 B R T < S+ 0 0 39 -3,-1.3 -42,-0.8 -4,-0.4 -43,-0.4 0.505 97.2 43.7 -81.4 -3.3 7.5 9.6 12.9 714 465 B T B < S+f 671 0L 3 -3,-1.9 6,-0.2 1,-0.1 3,-0.1 -0.780 92.5 43.9-132.7 175.5 7.8 9.4 9.1 715 466 B G + 0 0 1 -44,-0.7 2,-1.1 -2,-0.2 -131,-0.2 0.826 65.8 167.4 56.9 34.1 9.0 6.9 6.4 716 467 B R S S- 0 0 69 -45,-0.2 2,-0.5 1,-0.2 -1,-0.2 -0.696 76.5 -30.2 -84.5 100.1 7.2 4.1 8.2 717 468 B G S S+ 0 0 50 -2,-1.1 -1,-0.2 1,-0.3 2,-0.1 -0.129 140.4 46.0 85.5 -39.4 7.2 1.2 5.6 718 469 B R S S- 0 0 84 -2,-0.5 2,-0.5 1,-0.1 -1,-0.3 -0.005 105.0 -57.3-110.4-145.0 7.1 3.7 2.8 719 470 B M + 0 0 20 -3,-0.1 2,-0.3 -2,-0.1 -4,-0.2 -0.907 51.6 168.1-111.8 131.0 8.9 6.9 1.9 720 471 B G E -y 585 0J 0 -136,-1.5 -134,-2.1 -2,-0.5 2,-0.4 -0.898 25.9-128.8-134.1 163.8 9.1 10.0 4.1 721 472 B I E -yc 586 673J 9 -49,-1.4 -47,-3.1 -2,-0.3 2,-0.5 -0.933 11.3-159.3-118.3 139.6 11.0 13.3 4.2 722 473 B Y E -yc 587 674J 0 -136,-3.5 -134,-1.2 -2,-0.4 2,-0.5 -0.938 7.6-171.6-122.0 109.7 12.8 14.8 7.2 723 474 B R E +yc 588 675J 14 -49,-2.9 -47,-2.8 -2,-0.5 2,-0.2 -0.878 13.5 177.7-103.0 125.5 13.5 18.5 7.2 724 475 B F E -y 589 0J 24 -136,-0.8 -134,-2.6 -2,-0.5 -47,-0.2 -0.721 34.4-147.9-123.1 173.7 15.7 19.9 10.0 725 476 B V S S+ 0 0 18 -49,-0.4 -48,-0.1 1,-0.3 -1,-0.1 0.723 88.4 37.7-107.2 -40.0 17.3 23.1 11.2 726 477 B T - 0 0 58 1,-0.2 -1,-0.3 -50,-0.2 -50,-0.0 -0.958 62.9-161.5-120.2 136.8 20.5 21.7 12.8 727 478 B P + 0 0 88 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.987 67.2 58.1 -76.0 -77.5 22.6 18.8 11.4 728 479 B G - 0 0 55 1,-0.1 2,-0.3 0, 0.0 -2,-0.0 -0.041 66.6-159.1 -55.7 158.9 24.8 17.5 14.1 729 480 B E - 0 0 39 -150,-0.1 -26,-0.2 -28,-0.0 -27,-0.1 -0.941 21.8-105.8-139.3 159.1 23.5 16.1 17.4 730 481 B R B -i 703 0N 92 -28,-1.2 -26,-1.2 -2,-0.3 -154,-0.1 -0.779 41.8-110.4 -92.4 122.5 24.9 15.5 20.9 731 482 B P - 0 0 61 0, 0.0 -153,-0.2 0, 0.0 3,-0.1 -0.210 35.1-127.0 -51.7 132.6 25.5 11.8 21.8 732 483 B S S S+ 0 0 10 -155,-1.0 -156,-1.6 -158,-0.2 3,-0.1 0.002 72.4 90.9 -71.3-178.1 23.1 10.5 24.3 733 484 B G S S+ 0 0 12 1,-0.3 40,-3.1 -158,-0.3 2,-0.3 0.604 71.0 90.9 102.2 16.2 23.9 8.7 27.6 734 485 B M B -j 773 0O 102 38,-0.3 2,-0.3 -3,-0.1 -1,-0.3 -1.000 45.1-177.6-144.6 141.8 24.1 11.7 29.9 735 486 B F - 0 0 21 38,-2.1 40,-0.3 -2,-0.3 5,-0.1 -0.981 31.0 -98.5-141.0 153.2 21.7 13.6 32.2 736 487 B D >> - 0 0 45 -2,-0.3 3,-1.4 -53,-0.2 4,-0.5 -0.232 29.6-118.5 -67.1 156.1 21.7 16.6 34.5 737 488 B S H >> S+ 0 0 1 1,-0.3 4,-1.7 2,-0.2 3,-0.8 0.774 108.7 76.2 -63.9 -26.9 22.2 16.4 38.2 738 489 B S H 3> S+ 0 0 1 1,-0.3 4,-2.0 2,-0.2 -1,-0.3 0.803 87.9 60.3 -56.5 -27.4 18.7 17.9 38.6 739 490 B V H <> S+ 0 0 15 -3,-1.4 4,-1.9 2,-0.2 -1,-0.3 0.900 100.0 53.1 -68.4 -39.1 17.3 14.5 37.6 740 491 B L H X>S+ 0 0 8 -4,-2.9 4,-3.4 1,-0.2 5,-1.1 0.966 107.7 58.3 -63.5 -54.0 9.8 11.6 44.2 747 498 B G H 3<5S+ 0 0 0 -4,-3.5 6,-4.9 1,-0.3 -1,-0.2 0.804 114.5 41.3 -47.4 -27.3 11.0 9.0 46.7 748 499 B C H 3<5S+ 0 0 31 -4,-1.2 -1,-0.3 -3,-0.4 -2,-0.2 0.738 123.3 35.8 -92.6 -25.6 9.8 11.5 49.3 749 500 B A H <<5S+ 0 0 8 -4,-1.6 -2,-0.2 -3,-0.7 -3,-0.2 0.803 133.2 12.0 -98.0 -33.9 6.5 12.5 47.7 750 501 B W T <5S+ 0 0 134 -4,-3.4 -3,-0.2 -5,-0.2 -4,-0.1 0.814 127.3 37.7-113.1 -47.7 5.3 9.4 46.0 751 502 B Y S - 0 0 65 -2,-0.5 4,-2.4 1,-0.1 5,-0.2 -0.392 31.9-107.0 -69.8 154.2 13.8 8.0 52.8 755 506 B P H > S+ 0 0 20 0, 0.0 4,-2.1 0, 0.0 -1,-0.1 0.834 123.0 54.5 -49.3 -35.4 16.7 9.9 51.2 756 507 B A H > S+ 0 0 49 2,-0.2 4,-1.9 1,-0.2 26,-0.1 0.938 105.9 49.0 -65.9 -48.4 18.9 7.1 52.4 757 508 B E H > S+ 0 0 83 1,-0.2 4,-1.7 -3,-0.2 -1,-0.2 0.914 111.9 50.5 -57.8 -42.3 16.8 4.4 50.8 758 509 B T H X S+ 0 0 0 -4,-2.4 4,-2.8 1,-0.2 5,-0.3 0.894 104.9 57.2 -63.3 -40.4 16.9 6.3 47.5 759 510 B S H X S+ 0 0 12 -4,-2.1 4,-3.1 -5,-0.2 -1,-0.2 0.920 103.9 52.3 -58.9 -44.9 20.6 6.7 47.6 760 511 B V H X S+ 0 0 75 -4,-1.9 4,-2.4 2,-0.2 -1,-0.2 0.955 112.3 44.2 -55.4 -54.7 21.2 3.0 47.8 761 512 B R H X S+ 0 0 19 -4,-1.7 4,-1.4 1,-0.2 -1,-0.2 0.916 116.3 46.8 -57.9 -45.9 19.0 2.4 44.7 762 513 B L H X S+ 0 0 2 -4,-2.8 4,-2.1 1,-0.2 -1,-0.2 0.869 109.4 55.9 -65.0 -34.8 20.6 5.3 42.8 763 514 B R H X S+ 0 0 83 -4,-3.1 4,-2.0 -5,-0.3 -2,-0.2 0.932 104.1 52.0 -62.7 -45.8 24.0 4.1 43.9 764 515 B A H X S+ 0 0 17 -4,-2.4 4,-0.8 1,-0.2 -1,-0.2 0.864 110.2 51.0 -57.9 -35.3 23.4 0.6 42.3 765 516 B Y H < S+ 0 0 3 -4,-1.4 3,-0.4 1,-0.2 -1,-0.2 0.906 110.2 47.6 -68.7 -41.6 22.4 2.4 39.1 766 517 B L H < S+ 0 0 45 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.743 108.7 55.2 -72.1 -24.4 25.6 4.5 39.1 767 518 B N H < S+ 0 0 107 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.689 89.8 91.2 -80.7 -19.5 27.8 1.4 39.8 768 519 B T S >< S- 0 0 25 -4,-0.8 3,-0.8 -3,-0.4 -212,-0.0 -0.651 72.2-142.5 -82.8 118.8 26.3 -0.3 36.7 769 520 B P T 3 S+ 0 0 103 0, 0.0 -2,-0.1 0, 0.0 -1,-0.0 -0.260 79.4 44.6 -72.2 167.4 28.3 0.3 33.5 770 521 B G T 3 S+ 0 0 41 1,-0.3 3,-0.1 -37,-0.0 -2,-0.0 0.446 91.0 109.3 80.7 -2.4 26.5 0.7 30.1 771 522 B L S < S- 0 0 6 -3,-0.8 -1,-0.3 -6,-0.1 -229,-0.1 -0.738 82.5 -80.1-108.5 158.8 23.9 3.0 31.6 772 523 B P - 0 0 4 0, 0.0 -38,-0.3 0, 0.0 2,-0.2 -0.184 55.6-147.2 -51.0 140.9 23.4 6.8 31.1 773 524 B V B +j 734 0O 84 -40,-3.1 -38,-2.1 -3,-0.1 2,-0.3 -0.562 25.6 161.5-112.2 174.8 25.8 8.7 33.3 774 525 B C - 0 0 27 -40,-0.2 -38,-0.1 -2,-0.2 -40,-0.0 -0.939 50.3 -56.0-177.8 166.7 25.8 12.0 35.2 775 526 B Q - 0 0 119 -40,-0.3 2,-1.5 -2,-0.3 3,-0.0 -0.222 54.5-115.4 -56.5 142.6 27.7 13.7 38.0 776 527 B D + 0 0 91 1,-0.2 3,-0.2 2,-0.0 -1,-0.1 -0.601 59.7 141.6 -84.8 87.2 27.8 11.8 41.3 777 528 B H > + 0 0 38 -2,-1.5 4,-2.5 1,-0.1 5,-0.3 0.024 26.5 118.4-112.9 25.3 25.8 14.1 43.6 778 529 B L H > S+ 0 0 1 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.962 76.1 49.0 -57.9 -53.2 24.0 11.4 45.6 779 530 B E H > S+ 0 0 154 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.884 113.0 49.8 -54.5 -38.8 25.5 12.3 48.9 780 531 B F H >> S+ 0 0 33 2,-0.2 4,-2.2 1,-0.2 3,-0.6 0.982 113.2 41.4 -64.8 -60.8 24.7 15.9 48.3 781 532 B W H 3X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.3 5,-0.3 0.883 112.4 57.2 -56.2 -36.8 21.0 15.6 47.4 782 533 B E H 3X S+ 0 0 53 -4,-2.8 4,-1.8 -5,-0.3 -1,-0.3 0.884 107.0 49.4 -64.0 -33.9 20.6 13.0 50.1 783 534 B S H < S+ 0 0 0 -4,-2.2 3,-1.1 1,-0.2 4,-0.5 0.955 114.0 41.3 -53.9 -56.9 19.5 18.3 51.4 785 536 B F H >< S+ 0 0 5 -4,-2.4 3,-1.6 1,-0.2 -1,-0.2 0.862 103.4 67.5 -65.5 -32.4 16.3 16.2 51.6 786 537 B T H 3< S+ 0 0 70 -4,-1.8 -1,-0.2 -5,-0.3 -2,-0.2 0.811 102.3 48.2 -58.6 -24.8 17.2 14.6 54.8 787 538 B G T << S+ 0 0 18 -3,-1.1 2,-1.7 -4,-1.0 -1,-0.3 0.588 86.5 90.3 -91.5 -8.8 16.8 18.0 56.5 788 539 B L < + 0 0 2 -3,-1.6 3,-0.3 -4,-0.5 2,-0.2 -0.493 62.8 156.7 -86.3 69.1 13.5 18.8 54.9 789 540 B T + 0 0 75 -2,-1.7 -2,-0.0 1,-0.2 -3,-0.0 -0.542 44.1 26.3 -97.7 161.2 11.4 17.2 57.7 790 541 B H S S- 0 0 153 -2,-0.2 -1,-0.2 1,-0.1 2,-0.1 0.928 74.2-175.8 57.7 55.1 7.8 17.8 58.8 791 542 B I - 0 0 29 -3,-0.3 2,-1.1 1,-0.1 -1,-0.1 -0.381 39.6 -92.2 -77.6 158.5 6.4 19.1 55.5 792 543 B D >> - 0 0 38 19,-0.3 4,-2.3 1,-0.2 3,-0.6 -0.614 34.8-156.9 -75.7 100.7 2.8 20.4 55.3 793 544 B A H 3> S+ 0 0 77 -2,-1.1 4,-1.9 1,-0.3 -1,-0.2 0.844 92.4 54.2 -44.3 -43.8 0.9 17.2 54.3 794 545 B H H 3> S+ 0 0 123 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.927 109.4 46.7 -60.8 -45.4 -1.9 19.3 52.9 795 546 B F H <> S+ 0 0 13 -3,-0.6 4,-2.6 1,-0.2 -2,-0.2 0.853 109.1 54.3 -66.0 -35.1 0.5 21.3 50.7 796 547 B L H X S+ 0 0 21 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.871 107.4 53.0 -66.2 -35.5 2.3 18.1 49.5 797 548 B S H X S+ 0 0 52 -4,-1.9 4,-1.3 -5,-0.3 -2,-0.2 0.948 110.9 44.5 -63.1 -51.6 -1.1 16.8 48.4 798 549 B Q H >X S+ 0 0 54 -4,-2.0 4,-2.1 1,-0.2 3,-1.1 0.970 113.5 49.0 -58.0 -57.2 -1.9 19.9 46.4 799 550 B T H 3X>S+ 0 0 5 -4,-2.6 5,-0.9 1,-0.3 4,-0.6 0.838 106.6 56.7 -52.8 -40.4 1.5 20.2 44.7 800 551 B K H 3<5S+ 0 0 61 -4,-2.1 3,-0.4 -5,-0.2 -1,-0.3 0.840 109.5 46.8 -62.2 -32.2 1.5 16.5 43.8 801 552 B Q H <<5S+ 0 0 151 -4,-1.3 -2,-0.2 -3,-1.1 -1,-0.2 0.882 99.0 66.5 -76.7 -38.8 -1.8 17.1 41.9 802 553 B A H <5S- 0 0 35 -4,-2.1 -1,-0.2 -5,-0.1 -2,-0.2 0.709 102.6-134.2 -54.2 -19.9 -0.6 20.2 40.2 803 554 B G T <5 + 0 0 59 -4,-0.6 -3,-0.1 -3,-0.4 2,-0.1 0.664 46.5 158.6 73.3 17.2 1.8 17.8 38.4 804 555 B D < - 0 0 48 -5,-0.9 -1,-0.2 1,-0.1 6,-0.1 -0.455 49.8-116.9 -74.8 147.5 4.8 20.1 38.8 805 556 B N S S+ 0 0 88 1,-0.3 3,-0.2 -2,-0.1 -1,-0.1 0.820 106.4 36.3 -53.7 -42.8 8.3 18.5 38.6 806 557 B F > + 0 0 10 1,-0.2 4,-2.3 45,-0.1 -1,-0.3 -0.593 66.4 158.0-114.5 71.9 9.5 19.2 42.1 807 558 B P H > S+ 0 0 5 0, 0.0 4,-3.1 0, 0.0 5,-0.2 0.909 74.4 49.1 -58.3 -45.1 6.4 18.7 44.2 808 559 B Y H > S+ 0 0 23 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.896 112.7 46.1 -63.8 -44.3 8.2 18.1 47.5 809 560 B L H > S+ 0 0 0 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.900 115.8 47.0 -66.1 -40.2 10.6 21.0 47.1 810 561 B V H X S+ 0 0 5 -4,-2.3 4,-2.2 2,-0.2 5,-0.2 0.978 112.0 48.2 -66.0 -54.5 7.7 23.3 46.2 811 562 B A H X S+ 0 0 0 -4,-3.1 4,-3.1 -5,-0.2 -19,-0.3 0.874 114.0 50.0 -53.3 -36.8 5.4 22.1 49.0 812 563 B Y H X S+ 0 0 13 -4,-2.0 4,-2.7 2,-0.2 5,-0.3 0.968 107.1 50.6 -68.1 -53.2 8.4 22.5 51.4 813 564 B Q H X S+ 0 0 1 -4,-2.7 4,-1.6 1,-0.2 -1,-0.2 0.858 115.4 46.2 -51.5 -35.5 9.3 26.1 50.4 814 565 B A H X S+ 0 0 0 -4,-2.2 4,-3.4 2,-0.2 5,-0.3 0.945 107.2 56.2 -71.4 -50.3 5.6 26.8 50.9 815 566 B T H X S+ 0 0 3 -4,-3.1 4,-2.1 1,-0.3 -2,-0.2 0.872 109.3 47.7 -47.8 -43.1 5.5 25.0 54.3 816 567 B V H X S+ 0 0 8 -4,-2.7 4,-2.4 2,-0.2 -1,-0.3 0.899 114.3 47.1 -65.7 -42.7 8.3 27.3 55.4 817 568 B C H X>S+ 0 0 0 -4,-1.6 5,-2.0 -5,-0.3 4,-0.9 0.979 110.5 49.8 -64.8 -57.5 6.4 30.4 54.1 818 569 B A H ><5S+ 0 0 20 -4,-3.4 3,-1.8 1,-0.2 -2,-0.2 0.938 114.3 46.2 -45.7 -55.8 3.1 29.5 55.6 819 570 B R H 3<5S+ 0 0 145 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.941 114.8 46.1 -52.8 -51.3 4.7 28.9 59.0 820 571 B A H 3<5S- 0 0 47 -4,-2.4 -1,-0.3 -5,-0.2 -2,-0.2 0.489 108.7-127.0 -72.9 -0.6 6.7 32.1 58.7 821 572 B Q T <<5 + 0 0 131 -3,-1.8 21,-2.0 -4,-0.9 -3,-0.2 0.771 68.4 132.8 59.0 25.0 3.5 33.9 57.6 822 573 B A < - 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