==== Secondary Structure Definition by the program DSSP, CMBI version 3.0 ==== DATE=2017-09-12 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 27-MAY-13 4KXQ . COMPND MOL_ID: 1; MOLECULE: NAD-DEPENDENT PROTEIN DEACETYLASE SIRTUIN-1; CHAI . SOURCE MOL_ID: 1; ORGANISM_SCIENTIFIC: HOMO SAPIENS; ORGANISM_COMMON: HUMAN; . AUTHOR A.M.DAVENPORT,F.M.HUBER,A.HOELZ . 305 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15908.4 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 188 61.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 32 10.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 19 6.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 18 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 43 14.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 66 21.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.3 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 1 2 3 0 1 0 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 2 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 0 PARALLEL BRIDGES PER LADDER . 1 0 2 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 1 0 0 0 0 1 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 CHAIN AUTHCHAIN 1 232 A H 0 0 137 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 101.8 44.5 -39.4 11.9 A A 2 233 A M - 0 0 110 1,-0.1 2,-0.6 239,-0.0 220,-0.1 -0.118 360.0 -89.6 -71.6 163.4 44.2 -35.6 11.9 A A 3 234 A R - 0 0 7 1,-0.0 239,-0.3 222,-0.0 -1,-0.1 -0.587 39.6-154.3 -79.9 117.2 46.5 -33.2 10.2 A A 4 235 A K - 0 0 140 -2,-0.6 2,-0.2 1,-0.1 238,-0.1 -0.431 27.2 -95.3 -81.4 161.1 49.5 -32.0 12.3 A A 5 236 A K - 0 0 44 -2,-0.1 2,-0.4 238,-0.1 238,-0.1 -0.532 35.4-114.8 -75.9 141.0 51.3 -28.7 11.8 A A 6 237 A R > - 0 0 77 -2,-0.2 3,-1.1 236,-0.2 -1,-0.1 -0.634 16.2-152.0 -74.8 126.4 54.4 -28.5 9.6 A A 7 238 A K T 3 S+ 0 0 178 -2,-0.4 -1,-0.1 1,-0.2 -2,-0.0 0.680 92.2 56.4 -72.2 -19.0 57.4 -27.5 11.7 A A 8 239 A D T 3 S+ 0 0 98 1,-0.1 2,-0.5 2,-0.1 -1,-0.2 0.355 96.6 67.1 -99.3 3.3 59.2 -25.9 8.8 A A 9 240 A I < + 0 0 11 -3,-1.1 -1,-0.1 1,-0.1 -3,-0.1 -0.968 58.3 119.1-127.3 116.1 56.4 -23.5 7.9 A A 10 241 A N + 0 0 27 -2,-0.5 236,-0.3 1,-0.1 -1,-0.1 0.600 45.4 74.1-141.7 -43.4 55.8 -20.7 10.5 A A 11 242 A T S > S- 0 0 34 234,-0.1 4,-2.3 1,-0.1 5,-0.1 -0.363 73.6-117.5-100.2 167.0 56.3 -17.1 9.5 A A 12 243 A I H > S+ 0 0 0 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.852 121.0 56.5 -65.6 -31.1 54.6 -14.4 7.5 A A 13 244 A E H > S+ 0 0 90 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.901 105.4 50.2 -65.0 -40.9 57.7 -14.5 5.3 A A 14 245 A D H > S+ 0 0 38 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.915 109.2 52.6 -58.7 -44.6 57.1 -18.3 4.8 A A 15 246 A A H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.909 108.8 48.8 -59.1 -46.9 53.5 -17.4 3.8 A A 16 247 A V H X S+ 0 0 12 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.907 110.0 51.6 -58.9 -45.3 54.7 -14.9 1.2 A A 17 248 A K H X S+ 0 0 105 -4,-2.2 4,-2.5 1,-0.2 5,-0.2 0.914 109.8 49.8 -59.4 -43.2 57.1 -17.4 -0.2 A A 18 249 A L H X S+ 0 0 23 -4,-2.3 4,-2.9 1,-0.2 -1,-0.2 0.891 110.0 50.1 -61.8 -41.1 54.4 -20.0 -0.6 A A 19 250 A L H < S+ 0 0 15 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.852 113.0 48.5 -66.8 -31.1 52.1 -17.4 -2.3 A A 20 251 A Q H < S+ 0 0 106 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.897 122.6 30.6 -72.0 -41.3 55.1 -16.7 -4.6 A A 21 252 A E H < S+ 0 0 135 -4,-2.5 -2,-0.2 -5,-0.1 -3,-0.2 0.760 97.4 89.7 -95.0 -30.6 55.9 -20.3 -5.4 A A 22 253 A C < + 0 0 12 -4,-2.9 3,-0.1 -5,-0.2 182,-0.0 -0.420 41.6 177.5 -76.5 150.0 52.5 -22.2 -5.2 A A 23 254 A K S S+ 0 0 131 1,-0.1 -1,-0.1 -2,-0.1 -4,-0.0 0.290 70.5 55.6-138.7 8.8 50.4 -22.5 -8.4 A A 24 255 A K S S+ 0 0 70 84,-0.1 179,-2.3 2,-0.1 180,-0.8 -0.499 73.5 169.5-139.7 65.2 47.4 -24.6 -7.4 A A 25 256 A I E -ab 108 204A 3 82,-2.8 84,-2.2 177,-0.2 85,-1.6 -0.614 25.2-153.1 -88.3 135.1 46.0 -22.8 -4.4 A A 26 257 A I E -ab 110 205A 0 178,-3.0 180,-2.5 -2,-0.3 2,-0.6 -0.939 8.6-164.8 -98.9 127.6 42.7 -23.4 -2.7 A A 27 258 A V E -ab 111 206A 2 83,-2.4 85,-1.6 -2,-0.5 2,-0.6 -0.972 2.8-164.8-107.8 117.3 41.2 -20.4 -1.0 A A 28 259 A L E -ab 112 207A 0 178,-2.8 180,-2.7 -2,-0.6 2,-0.3 -0.925 15.4-172.8-104.2 113.8 38.4 -21.4 1.4 A A 29 260 A T E -ab 113 208A 1 83,-2.3 85,-1.6 -2,-0.6 180,-0.2 -0.823 12.4-179.0-112.9 149.1 36.3 -18.4 2.3 A A 30 261 A G > - 0 0 1 178,-1.8 3,-1.9 -2,-0.3 4,-0.2 -0.595 54.7 -65.6-125.6-165.2 33.5 -17.7 4.8 A A 31 262 A A G > S+ 0 0 17 1,-0.3 3,-1.7 -2,-0.2 4,-0.5 0.721 116.7 76.9 -63.1 -20.6 31.3 -14.7 5.8 A A 32 263 A G G > S+ 0 0 18 177,-2.4 3,-0.6 1,-0.3 4,-0.5 0.754 82.9 64.4 -60.4 -26.8 34.3 -12.8 7.2 A A 33 264 A V G < S+ 0 0 1 -3,-1.9 60,-0.3 176,-0.4 63,-0.3 0.637 106.9 43.4 -76.1 -10.4 35.6 -11.8 3.7 A A 34 265 A S G X >S+ 0 0 1 -3,-1.7 5,-1.9 -4,-0.2 3,-0.7 0.426 86.4 91.8-110.3 -2.5 32.4 -9.8 3.1 A A 35 266 A V G X 5S+ 0 0 33 -3,-0.6 3,-1.6 -4,-0.5 -2,-0.1 0.922 87.1 50.9 -58.8 -45.4 32.2 -8.1 6.5 A A 36 267 A S G 3 5S+ 0 0 72 -4,-0.5 -1,-0.3 1,-0.3 -2,-0.1 0.706 103.1 62.1 -66.3 -20.6 34.3 -5.1 5.3 A A 37 268 A C G < 5S- 0 0 24 -3,-0.7 54,-0.3 2,-0.2 -1,-0.3 0.603 128.7 -95.9 -76.4 -15.7 31.8 -4.9 2.4 A A 38 269 A G T < 5S+ 0 0 47 -3,-1.6 -3,-0.2 -4,-0.5 -2,-0.2 0.572 89.6 120.1 106.4 16.2 29.0 -4.2 4.8 A A 39 270 A I < - 0 0 39 -5,-1.9 -1,-0.2 -8,-0.1 -2,-0.2 -0.916 56.9-138.1-114.0 106.3 27.6 -7.8 5.2 A A 40 271 A P - 0 0 57 0, 0.0 7,-0.1 0, 0.0 8,-0.1 -0.278 19.0-120.4 -63.0 152.1 27.7 -9.1 8.7 A A 41 272 A D - 0 0 22 6,-0.1 7,-2.8 -9,-0.1 8,-0.1 0.071 22.0-109.0 -76.7-170.0 28.8 -12.7 9.4 A A 42 273 A F S S+ 0 0 61 5,-0.3 7,-2.1 6,-0.2 8,-0.5 0.873 101.5 31.4 -90.6 -43.6 26.8 -15.4 11.0 A A 43 274 A R S S+ 0 0 102 5,-0.1 2,-0.1 6,-0.1 -1,-0.1 0.454 89.2 100.7-108.6 -1.0 28.3 -16.1 14.5 A A 44 275 A S S > S- 0 0 34 1,-0.1 3,-2.8 2,-0.0 6,-0.4 -0.375 87.9 -96.2 -82.7 165.1 29.9 -12.8 15.7 A A 45 276 A R T 3 S+ 0 0 170 1,-0.3 -1,-0.1 -2,-0.1 0, 0.0 0.813 128.3 37.3 -47.8 -37.6 28.2 -10.5 18.3 A A 46 277 A D T 3 S+ 0 0 109 4,-0.1 -1,-0.3 5,-0.0 -3,-0.1 0.114 101.8 114.5-102.9 22.5 26.8 -8.3 15.5 A A 47 278 A G S <> S- 0 0 0 -3,-2.8 4,-2.2 -7,-0.1 -5,-0.3 -0.230 81.0 -90.0 -95.4 179.0 26.1 -11.2 13.1 A A 48 279 A I H > S+ 0 0 12 -7,-2.8 4,-2.7 1,-0.2 -6,-0.2 0.849 119.9 50.5 -54.5 -46.2 23.0 -12.9 11.6 A A 49 280 A Y H > S+ 0 0 18 -7,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.903 110.3 49.5 -68.0 -38.7 22.3 -15.4 14.3 A A 50 281 A A H > S+ 0 0 42 -8,-0.5 4,-0.9 -6,-0.4 -1,-0.2 0.919 112.9 48.2 -62.5 -45.2 22.5 -12.8 17.1 A A 51 282 A R H >X S+ 0 0 100 -4,-2.2 4,-3.1 1,-0.2 3,-1.1 0.928 109.0 53.0 -59.6 -46.6 20.1 -10.6 15.2 A A 52 283 A L H 3X S+ 0 0 1 -4,-2.7 4,-2.5 1,-0.3 -1,-0.2 0.855 101.2 60.4 -59.4 -35.7 17.7 -13.5 14.5 A A 53 284 A A H 3< S+ 0 0 55 -4,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.818 115.6 35.1 -61.7 -28.7 17.6 -14.3 18.3 A A 54 285 A V H << S+ 0 0 108 -3,-1.1 -2,-0.2 -4,-0.9 -1,-0.2 0.881 123.9 39.5 -89.2 -46.9 16.2 -10.8 18.7 A A 55 286 A D H < S+ 0 0 82 -4,-3.1 -3,-0.2 1,-0.2 -2,-0.2 0.653 127.8 30.8 -83.8 -17.6 14.0 -10.4 15.6 A A 56 287 A F >< + 0 0 38 -4,-2.5 3,-1.8 -5,-0.3 -1,-0.2 -0.418 66.8 156.3-138.0 59.5 12.6 -14.0 15.5 A A 57 288 A P T 3 + 0 0 91 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.651 66.4 70.2 -66.1 -16.4 12.5 -15.1 19.2 A A 58 289 A D T 3 S+ 0 0 157 -3,-0.1 -5,-0.1 3,-0.0 -2,-0.0 0.703 75.8 101.7 -74.3 -19.1 9.8 -17.6 18.4 A A 59 290 A L S < S- 0 0 16 -3,-1.8 4,-0.1 -7,-0.2 -3,-0.0 -0.343 84.0-124.1 -62.3 145.1 12.3 -19.8 16.5 A A 60 291 A P S S- 0 0 97 0, 0.0 -1,-0.1 0, 0.0 3,-0.0 0.865 91.8 -20.9 -58.0 -35.8 13.5 -22.8 18.6 A A 61 292 A D S > S- 0 0 75 -5,-0.1 3,-1.5 1,-0.0 4,-0.4 -0.947 73.1 -98.9-162.4 163.0 17.0 -21.4 17.8 A A 62 293 A P G > S+ 0 0 28 0, 0.0 3,-1.5 0, 0.0 4,-0.2 0.845 118.5 63.7 -57.7 -31.9 18.5 -19.0 15.2 A A 63 294 A Q G > S+ 0 0 64 1,-0.3 3,-2.2 2,-0.2 120,-0.3 0.760 85.5 74.5 -61.9 -26.9 19.8 -22.0 13.2 A A 64 295 A A G X S+ 0 0 7 -3,-1.5 3,-1.6 1,-0.3 -1,-0.3 0.783 81.1 70.5 -60.7 -25.9 16.2 -23.1 12.6 A A 65 296 A M G < S+ 0 0 4 -3,-1.5 -1,-0.3 -4,-0.4 -2,-0.2 0.791 110.5 32.2 -57.6 -28.2 15.9 -20.2 10.1 A A 66 297 A F G < S+ 0 0 14 -3,-2.2 117,-3.0 -4,-0.2 2,-0.5 -0.086 95.8 111.9-121.2 31.2 18.2 -22.2 7.8 A A 67 298 A D B <> -h 183 0B 49 -3,-1.6 4,-2.6 115,-0.3 5,-0.2 -0.918 57.9-148.9-112.8 128.4 17.1 -25.7 8.9 A A 68 299 A I H > S+ 0 0 9 115,-2.5 4,-2.0 -2,-0.5 5,-0.1 0.866 96.2 52.5 -69.1 -34.3 15.3 -27.9 6.3 A A 69 300 A E H > S+ 0 0 108 114,-0.3 4,-1.1 2,-0.2 -1,-0.2 0.864 114.3 43.6 -71.9 -32.2 13.2 -29.8 8.8 A A 70 301 A Y H > S+ 0 0 47 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.915 111.0 53.8 -74.3 -43.1 12.0 -26.6 10.4 A A 71 302 A F H < S+ 0 0 3 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.857 106.5 53.9 -57.0 -37.8 11.4 -24.9 7.0 A A 72 303 A R H < S+ 0 0 111 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.879 110.6 46.1 -64.6 -39.3 9.2 -27.9 6.1 A A 73 304 A K H < S- 0 0 168 -4,-1.1 -2,-0.2 1,-0.3 -1,-0.2 0.891 138.0 -3.3 -67.0 -42.6 7.1 -27.3 9.2 A A 74 305 A D < + 0 0 34 -4,-2.6 4,-0.3 -5,-0.1 -1,-0.3 -0.777 55.5 177.0-160.4 104.3 6.8 -23.6 8.7 A A 75 306 A P > + 0 0 20 0, 0.0 4,-1.7 0, 0.0 5,-0.2 0.405 62.9 94.5 -90.3 0.4 8.5 -21.6 5.9 A A 76 307 A R H > S+ 0 0 147 1,-0.2 4,-1.6 2,-0.2 5,-0.2 0.917 80.8 51.1 -63.3 -46.8 6.9 -18.3 6.8 A A 77 308 A P H > S+ 0 0 15 0, 0.0 4,-1.9 0, 0.0 3,-0.3 0.936 108.8 52.3 -57.9 -44.0 9.8 -17.0 9.0 A A 78 309 A F H > S+ 0 0 4 -4,-0.3 4,-2.6 1,-0.2 -2,-0.2 0.905 110.4 46.6 -58.9 -42.3 12.3 -17.6 6.3 A A 79 310 A F H < S+ 0 0 0 -4,-1.7 4,-0.3 1,-0.2 -1,-0.2 0.719 109.8 54.6 -79.3 -15.5 10.4 -15.7 3.6 A A 80 311 A K H < S+ 0 0 100 -4,-1.6 -1,-0.2 -3,-0.3 -2,-0.2 0.855 120.7 32.6 -70.7 -35.0 9.9 -12.9 6.1 A A 81 312 A F H >< S+ 0 0 1 -4,-1.9 3,-2.2 -5,-0.2 4,-0.5 0.715 93.5 88.6 -95.2 -25.0 13.7 -12.8 6.5 A A 82 313 A A G >< S+ 0 0 0 -4,-2.6 3,-1.5 1,-0.3 4,-0.5 0.769 80.4 60.5 -55.9 -36.3 15.1 -13.8 3.1 A A 83 314 A K G > S+ 0 0 76 73,-0.4 3,-0.6 -4,-0.3 -1,-0.3 0.782 95.1 66.0 -64.9 -23.6 15.2 -10.3 1.6 A A 84 315 A E G < S+ 0 0 76 -3,-2.2 -1,-0.3 1,-0.2 -2,-0.2 0.770 111.8 32.7 -65.8 -25.6 17.6 -9.3 4.4 A A 85 316 A I G < S+ 0 0 26 -3,-1.5 -1,-0.2 -4,-0.5 -2,-0.2 0.281 88.4 122.1-116.4 8.6 20.2 -11.7 3.0 A A 86 317 A Y S < S- 0 0 19 -3,-0.6 31,-0.1 -4,-0.5 -3,-0.0 -0.417 81.1 -86.0 -67.8 145.9 19.4 -11.4 -0.7 A A 87 318 A P - 0 0 30 0, 0.0 -1,-0.1 0, 0.0 31,-0.1 -0.344 58.6-178.5 -56.7 133.1 22.4 -10.3 -2.8 A A 88 319 A G - 0 0 43 29,-0.2 2,-0.1 -3,-0.1 -3,-0.0 0.110 42.2 -72.4-107.9-142.7 22.5 -6.5 -2.8 A A 89 320 A Q S S+ 0 0 186 2,-0.0 2,-0.2 -2,-0.0 0, 0.0 -0.483 72.8 142.3-120.9 58.7 24.7 -3.8 -4.4 A A 90 321 A F - 0 0 81 27,-0.2 -52,-0.1 -2,-0.1 -53,-0.1 -0.624 47.8-122.5 -93.9 157.6 27.8 -4.2 -2.4 A A 91 322 A Q - 0 0 132 -54,-0.3 28,-0.1 -2,-0.2 -2,-0.0 -0.817 32.1-102.2 -99.1 141.8 31.3 -3.9 -3.8 A A 92 323 A P - 0 0 9 0, 0.0 -58,-0.1 0, 0.0 -1,-0.1 -0.290 38.4-121.5 -57.8 142.7 33.9 -6.7 -3.4 A A 93 324 A S > - 0 0 8 -60,-0.3 4,-2.1 1,-0.1 5,-0.2 -0.218 29.4 -96.0 -73.5 171.3 36.6 -6.3 -0.8 A A 94 325 A L H > S+ 0 0 29 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.852 125.9 56.8 -53.0 -39.9 40.3 -6.3 -1.2 A A 95 326 A C H > S+ 0 0 0 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.917 105.7 49.1 -63.9 -41.8 40.3 -10.1 -0.4 A A 96 327 A H H > S+ 0 0 1 -63,-0.3 4,-2.4 1,-0.2 -1,-0.2 0.920 112.5 49.1 -59.3 -43.5 37.9 -10.8 -3.2 A A 97 328 A K H X S+ 0 0 85 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.839 109.0 52.7 -66.8 -34.3 40.1 -8.8 -5.5 A A 98 329 A F H X S+ 0 0 7 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.908 110.2 47.3 -65.5 -44.3 43.2 -10.7 -4.3 A A 99 330 A I H X S+ 0 0 1 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.904 110.3 53.7 -65.6 -39.3 41.5 -14.0 -5.1 A A 100 331 A A H X S+ 0 0 15 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.898 109.1 48.4 -61.7 -40.1 40.5 -12.7 -8.5 A A 101 332 A L H X S+ 0 0 18 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.893 107.9 53.5 -68.3 -41.3 44.1 -11.7 -9.4 A A 102 333 A S H <>S+ 0 0 4 -4,-2.1 5,-2.3 2,-0.2 6,-0.8 0.910 111.8 46.7 -57.3 -39.8 45.4 -15.1 -8.3 A A 103 334 A D H ><5S+ 0 0 16 -4,-1.9 3,-1.7 4,-0.2 -2,-0.2 0.932 109.0 53.9 -70.4 -43.4 42.8 -16.7 -10.6 A A 104 335 A K H 3<5S+ 0 0 181 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.893 107.8 51.7 -56.1 -38.8 43.8 -14.3 -13.4 A A 105 336 A E T 3<5S- 0 0 73 -4,-2.4 -1,-0.3 -5,-0.1 -2,-0.2 0.481 117.5-113.4 -79.9 -2.1 47.4 -15.4 -13.0 A A 106 337 A G T < 5S+ 0 0 57 -3,-1.7 -3,-0.2 -4,-0.2 -2,-0.1 0.564 89.1 109.8 85.6 10.4 46.5 -19.1 -13.2 A A 107 338 A K < + 0 0 56 -5,-2.3 -82,-2.8 -6,-0.2 2,-0.7 0.543 48.8 91.8 -98.4 -12.3 47.5 -19.8 -9.6 A A 108 339 A L E -a 25 0A 4 -6,-0.8 -82,-0.2 -84,-0.2 3,-0.2 -0.789 44.6-178.6 -90.3 113.8 44.0 -20.4 -8.1 A A 109 340 A L E S- 0 0A 16 -84,-2.2 2,-0.3 -2,-0.7 -83,-0.2 0.929 72.0 -27.3 -70.4 -45.6 42.9 -24.0 -8.2 A A 110 341 A R E -a 26 0A 39 -85,-1.6 -83,-2.4 2,-0.1 2,-0.6 -0.947 42.0-141.0-167.5 144.3 39.6 -23.0 -6.6 A A 111 342 A N E -ac 27 128A 0 16,-2.6 18,-2.5 -2,-0.3 2,-0.8 -0.954 23.3-164.6-104.1 104.1 37.8 -20.6 -4.4 A A 112 343 A Y E -ac 28 129A 0 -85,-1.6 -83,-2.3 -2,-0.6 2,-0.4 -0.832 15.3-171.4 -84.0 110.4 35.4 -22.6 -2.3 A A 113 344 A T E -ac 29 130A 0 16,-2.8 18,-2.3 -2,-0.8 19,-0.6 -0.866 28.5-166.5-109.4 141.4 33.1 -20.0 -0.9 A A 114 345 A Q + 0 0 19 -85,-1.6 2,-0.1 -2,-0.4 -84,-0.1 0.446 62.8 102.8 -95.3 -3.5 30.4 -20.6 1.8 A A 115 346 A N - 0 0 7 -86,-0.2 17,-0.2 -85,-0.1 3,-0.2 -0.456 54.6-161.8 -87.9 153.7 28.8 -17.2 1.0 A A 116 347 A I + 0 0 24 -2,-0.1 19,-0.4 1,-0.1 -1,-0.1 0.205 68.6 98.5-112.7 13.1 25.7 -16.5 -0.9 A A 117 348 A D S S- 0 0 17 17,-0.1 -27,-0.2 -31,-0.1 -29,-0.2 0.575 80.0-137.3 -80.4 -9.1 26.4 -12.8 -1.6 A A 118 349 A T > + 0 0 35 -3,-0.2 4,-1.6 1,-0.1 3,-0.4 0.605 60.5 134.3 63.0 17.9 27.7 -13.5 -5.1 A A 119 350 A L H > + 0 0 5 1,-0.2 4,-1.9 2,-0.2 6,-0.2 0.768 63.2 64.4 -70.2 -21.0 30.6 -11.0 -4.6 A A 120 351 A E H >>S+ 0 0 0 2,-0.2 5,-2.2 1,-0.2 4,-0.5 0.924 103.5 47.4 -65.3 -42.2 33.1 -13.5 -6.1 A A 121 352 A Q H >45S+ 0 0 99 -3,-0.4 3,-1.3 1,-0.2 -2,-0.2 0.932 110.4 51.5 -61.2 -45.3 31.2 -13.2 -9.4 A A 122 353 A V H 3<5S+ 0 0 84 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.869 108.7 53.0 -60.7 -34.0 31.2 -9.4 -9.2 A A 123 354 A A H 3<5S- 0 0 26 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.2 0.552 116.6-114.0 -80.0 -9.8 35.0 -9.5 -8.6 A A 124 355 A G T <<5 + 0 0 45 -3,-1.3 2,-0.4 -4,-0.5 -3,-0.2 0.695 59.7 155.3 81.6 19.3 35.6 -11.6 -11.7 A A 125 356 A I < - 0 0 5 -5,-2.2 -1,-0.3 -6,-0.2 3,-0.2 -0.676 17.1-178.4 -71.0 130.3 36.8 -14.7 -9.8 A A 126 357 A Q + 0 0 165 -2,-0.4 2,-2.2 1,-0.2 -1,-0.2 0.846 65.2 66.0-100.8 -44.2 36.1 -17.6 -12.3 A A 127 358 A R S S+ 0 0 93 -19,-0.1 -16,-2.6 -27,-0.1 2,-0.3 -0.399 76.6 147.3 -83.3 63.6 37.1 -20.8 -10.5 A A 128 359 A I E -c 111 0A 29 -2,-2.2 2,-0.4 -18,-0.2 -16,-0.2 -0.743 35.4-166.5 -98.7 142.9 34.4 -20.5 -7.9 A A 129 360 A I E -c 112 0A 19 -18,-2.5 -16,-2.8 -2,-0.3 2,-1.4 -0.982 14.2-150.1-123.4 122.0 32.4 -23.2 -6.0 A A 130 361 A Q E > -c 113 0A 42 -2,-0.4 3,-1.7 1,-0.2 -16,-0.2 -0.723 17.8-175.4 -87.3 88.6 29.4 -21.9 -4.2 A A 131 362 A C T 3 S+ 0 0 0 -18,-2.3 -17,-0.2 -2,-1.4 -1,-0.2 0.799 79.6 39.6 -58.5 -34.6 29.5 -24.5 -1.5 A A 132 363 A H T 3 S- 0 0 34 -19,-0.6 49,-2.1 1,-0.4 -1,-0.3 0.019 110.1-123.1-112.4 27.2 26.3 -23.4 0.2 A A 133 364 A G E < -I 180 0C 7 -3,-1.7 -1,-0.4 47,-0.3 47,-0.3 -0.256 25.2-116.2 74.1-155.9 24.3 -22.6 -2.9 A A 134 365 A S E > - 0 0C 13 45,-1.6 3,-0.6 3,-0.2 45,-0.3 -0.970 23.9 -98.5-172.3 169.6 22.7 -19.3 -3.9 A A 135 366 A F E 3 S+ 0 0C 7 -19,-0.4 45,-0.1 -2,-0.3 -2,-0.0 0.393 89.3 105.6 -77.4 0.7 19.4 -17.5 -4.6 A A 136 367 A A E 3 S+ 0 0C 49 43,-0.1 13,-2.0 12,-0.1 2,-0.3 0.770 88.2 16.2 -61.9 -28.7 20.0 -17.9 -8.3 A A 137 368 A T E < - J 0 148C 40 -3,-0.6 42,-3.0 11,-0.2 2,-0.3 -0.934 66.4-149.5-136.7 163.1 17.4 -20.7 -8.6 A A 138 369 A A E -IJ 178 147C 0 9,-2.5 9,-2.4 -2,-0.3 2,-0.4 -0.955 9.7-158.1-133.0 155.6 14.5 -22.1 -6.5 A A 139 370 A S E -IJ 177 146C 23 38,-2.2 38,-2.4 -2,-0.3 2,-0.3 -0.995 24.0-112.3-140.2 133.9 13.1 -25.6 -6.3 A A 140 371 A C E > -I 176 0C 1 5,-2.4 4,-1.7 -2,-0.4 36,-0.2 -0.497 20.6-141.8 -68.1 128.4 9.7 -27.0 -5.3 A A 141 372 A L T 4 S+ 0 0 32 34,-2.1 33,-0.2 32,-0.3 -1,-0.1 0.763 97.6 37.8 -59.2 -27.4 10.0 -29.0 -2.0 A A 142 373 A I T 4 S+ 0 0 73 31,-0.2 -1,-0.2 33,-0.2 32,-0.1 0.899 133.7 14.3 -94.3 -49.2 7.5 -31.5 -3.3 A A 143 374 A C T 4 S- 0 0 35 2,-0.1 -2,-0.2 0, 0.0 31,-0.1 0.453 90.2-126.6-113.2 -6.0 8.1 -32.0 -7.1 A A 144 375 A K < + 0 0 158 -4,-1.7 -3,-0.1 1,-0.2 2,-0.1 0.585 44.8 167.8 67.5 14.1 11.5 -30.4 -7.5 A A 145 376 A Y - 0 0 86 -6,-0.1 -5,-2.4 1,-0.1 2,-0.3 -0.402 26.1-141.2 -54.7 130.2 10.3 -28.1 -10.3 A A 146 377 A K E +J 139 0C 119 -7,-0.2 2,-0.3 -2,-0.1 -7,-0.2 -0.772 23.1 176.9-100.8 142.8 13.1 -25.5 -10.8 A A 147 378 A V E -J 138 0C 19 -9,-2.4 -9,-2.5 -2,-0.3 2,-0.1 -0.972 33.0-103.7-138.4 158.4 12.8 -21.8 -11.6 A A 148 379 A D E > -J 137 0C 97 -2,-0.3 3,-1.6 -11,-0.2 4,-0.5 -0.331 41.0-105.1 -70.9 159.8 15.1 -18.9 -12.1 A A 149 380 A C G >> S+ 0 0 23 -13,-2.0 4,-1.4 1,-0.3 3,-1.3 0.819 116.9 66.6 -58.0 -32.9 15.5 -16.4 -9.2 A A 150 381 A E G 34 S+ 0 0 128 1,-0.3 4,-0.5 -14,-0.2 -1,-0.3 0.740 92.4 63.2 -64.8 -19.3 13.4 -13.8 -11.1 A A 151 382 A A G <4 S+ 0 0 66 -3,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.765 117.2 25.2 -75.9 -26.4 10.4 -16.0 -10.8 A A 152 383 A V T <> S+ 0 0 5 -3,-1.3 4,-2.1 -4,-0.5 -2,-0.2 0.426 96.7 95.2-115.0 -3.0 10.3 -15.9 -7.0 A A 153 384 A R H X S+ 0 0 94 -4,-1.4 4,-2.0 1,-0.2 5,-0.2 0.890 83.5 51.5 -58.5 -45.5 12.0 -12.5 -6.5 A A 154 385 A G H > S+ 0 0 47 -4,-0.5 4,-1.0 1,-0.2 -1,-0.2 0.901 111.2 47.7 -60.4 -43.2 8.8 -10.5 -6.2 A A 155 386 A D H 4>S+ 0 0 61 2,-0.2 5,-2.6 1,-0.2 -1,-0.2 0.879 107.7 56.9 -64.1 -40.1 7.4 -12.8 -3.6 A A 156 387 A I H ><5S+ 0 0 1 -4,-2.1 3,-1.5 1,-0.2 -73,-0.4 0.938 108.9 44.0 -59.7 -48.3 10.6 -12.7 -1.6 A A 157 388 A F H 3<5S+ 0 0 94 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.681 111.2 55.0 -75.6 -15.4 10.6 -8.9 -1.2 A A 158 389 A N T 3<5S- 0 0 121 -4,-1.0 -1,-0.3 -5,-0.2 -2,-0.2 0.337 113.1-123.1 -90.9 4.2 6.9 -9.0 -0.4 A A 159 390 A Q T < 5 + 0 0 91 -3,-1.5 2,-0.3 1,-0.2 -3,-0.2 0.762 65.8 136.1 60.5 30.3 7.7 -11.4 2.4 A A 160 391 A V < - 0 0 62 -5,-2.6 -1,-0.2 -6,-0.1 -2,-0.1 -0.842 63.4-109.2-111.6 145.7 5.3 -14.1 1.0 A A 161 392 A V - 0 0 42 -2,-0.3 2,-0.1 -3,-0.1 16,-0.1 -0.589 38.3-132.6 -71.1 110.9 5.9 -17.8 0.5 A A 162 393 A P - 0 0 1 0, 0.0 14,-1.9 0, 0.0 2,-0.3 -0.394 21.0-135.8 -70.8 144.7 6.2 -18.4 -3.2 A A 163 394 A R B -K 175 0D 97 12,-0.2 12,-0.3 -2,-0.1 6,-0.1 -0.760 15.0-109.9-107.0 142.2 4.1 -21.3 -4.6 A A 164 395 A C - 0 0 7 10,-2.9 10,-0.1 -2,-0.3 -1,-0.0 -0.496 22.5-154.7 -61.2 131.0 5.0 -24.1 -7.0 A A 165 396 A P S S+ 0 0 93 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.548 90.1 50.2 -85.9 -6.3 3.0 -23.3 -10.2 A A 166 397 A R S S+ 0 0 154 2,-0.1 3,-0.1 8,-0.0 -2,-0.0 0.836 96.3 72.5 -96.9 -44.7 3.1 -27.1 -11.2 A A 167 398 A C S S- 0 0 20 1,-0.2 2,-0.0 7,-0.1 -4,-0.0 -0.185 101.8 -74.4 -67.2 164.3 1.8 -28.8 -8.1 A A 168 399 A P > - 0 0 68 0, 0.0 3,-2.3 0, 0.0 6,-0.2 -0.355 37.5-126.9 -57.3 137.5 -1.8 -28.7 -6.9 A A 169 400 A A T 3 S+ 0 0 95 1,-0.3 -2,-0.1 -3,-0.1 5,-0.0 0.678 111.4 57.1 -61.3 -17.0 -2.7 -25.3 -5.4 A A 170 401 A D T 3 S+ 0 0 139 2,-0.0 -1,-0.3 0, 0.0 -3,-0.0 0.277 76.6 108.3 -98.6 9.2 -3.9 -27.2 -2.3 A A 171 402 A E X - 0 0 65 -3,-2.3 3,-1.3 1,-0.2 -29,-0.1 -0.799 57.7-159.0 -86.0 109.9 -0.6 -28.9 -1.7 A A 172 403 A P T 3 S+ 0 0 92 0, 0.0 -1,-0.2 0, 0.0 -3,-0.0 0.863 85.5 43.6 -60.9 -41.9 0.7 -27.2 1.4 A A 173 404 A L T 3 S+ 0 0 63 1,-0.1 2,-2.2 -10,-0.0 -32,-0.3 0.296 77.8 111.7 -92.0 9.3 4.4 -27.9 1.1 A A 174 405 A A < + 0 0 0 -3,-1.3 -10,-2.9 -6,-0.2 2,-0.3 -0.446 49.0 140.5 -81.1 66.8 4.6 -27.1 -2.7 A A 175 406 A I B -K 163 0D 4 -2,-2.2 -34,-2.1 -12,-0.3 2,-1.0 -0.846 57.8-116.4-116.1 149.0 6.7 -24.1 -2.0 A A 176 407 A M E -I 140 0C 3 -14,-1.9 -36,-0.2 -2,-0.3 -2,-0.1 -0.717 30.4-166.1 -90.1 100.1 9.7 -22.7 -4.0 A A 177 408 A K E -I 139 0C 8 -38,-2.4 -38,-2.2 -2,-1.0 -16,-0.0 -0.764 23.9-120.9 -88.9 121.2 12.8 -22.9 -1.8 A A 178 409 A P E -I 138 0C 1 0, 0.0 2,-2.0 0, 0.0 -40,-0.3 -0.284 35.0-106.1 -55.4 146.8 15.8 -20.9 -3.1 A A 179 410 A E E S+ 0 0C 65 -42,-3.0 -45,-1.6 -45,-0.3 2,-0.4 -0.218 74.1 133.2 -86.0 50.1 18.7 -23.2 -3.6 A A 180 411 A I E -I 133 0C 10 -2,-2.0 2,-0.5 -47,-0.3 -47,-0.3 -0.809 65.5-108.8 -85.3 138.2 20.6 -22.1 -0.6 A A 181 412 A V - 0 0 27 -49,-2.1 2,-0.2 -2,-0.4 6,-0.1 -0.592 37.4-165.5 -78.5 122.8 21.8 -25.0 1.4 A A 182 413 A F > - 0 0 4 -2,-0.5 3,-2.3 4,-0.1 -115,-0.3 -0.646 38.2 -80.0 -97.6 159.6 20.1 -25.5 4.7 A A 183 414 A F B 3 S+h 67 0B 73 -117,-3.0 -115,-2.5 -120,-0.3 -114,-0.3 -0.352 122.9 30.0 -54.1 134.3 21.1 -27.7 7.6 A A 184 415 A G T 3 S+ 0 0 77 1,-0.3 2,-0.3 -117,-0.1 -1,-0.3 0.379 101.8 106.3 92.0 -4.3 20.0 -31.3 6.7 A A 185 416 A E S < S- 0 0 61 -3,-2.3 -1,-0.3 1,-0.0 2,-0.2 -0.765 73.0-108.2-106.8 154.0 20.4 -30.7 2.9 A A 186 417 A N - 0 0 147 -2,-0.3 -4,-0.1 -3,-0.1 3,-0.1 -0.485 32.7-119.2 -70.6 145.5 23.0 -31.9 0.5 A A 187 418 A L - 0 0 18 -2,-0.2 -55,-0.1 1,-0.2 -56,-0.1 -0.459 51.2 -73.3 -73.5 160.1 25.5 -29.4 -0.9 A A 188 419 A P >> - 0 0 36 0, 0.0 3,-1.4 0, 0.0 4,-1.0 -0.230 39.4-120.0 -55.6 144.1 25.5 -29.0 -4.7 A A 189 420 A E H 3> S+ 0 0 115 1,-0.3 4,-2.4 2,-0.2 5,-0.3 0.844 111.0 69.0 -55.2 -35.0 26.9 -31.8 -6.7 A A 190 421 A Q H 3> S+ 0 0 127 1,-0.2 4,-2.6 2,-0.2 -1,-0.3 0.862 95.3 55.6 -51.3 -39.5 29.5 -29.3 -8.1 A A 191 422 A F H <> S+ 0 0 6 -3,-1.4 4,-2.4 1,-0.2 -1,-0.2 0.940 109.5 44.1 -60.1 -49.9 31.1 -29.1 -4.7 A A 192 423 A H H X S+ 0 0 82 -4,-1.0 4,-1.8 2,-0.2 -2,-0.2 0.886 115.5 46.9 -67.3 -39.5 31.7 -32.9 -4.4 A A 193 424 A R H X S+ 0 0 140 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.930 113.1 49.4 -67.6 -44.6 33.0 -33.3 -7.9 A A 194 425 A A H X S+ 0 0 6 -4,-2.6 4,-2.8 -5,-0.3 -2,-0.2 0.908 110.0 51.1 -59.4 -43.9 35.3 -30.3 -7.6 A A 195 426 A M H X S+ 0 0 20 -4,-2.4 4,-2.2 -5,-0.2 -1,-0.2 0.901 108.4 51.9 -63.2 -38.9 36.7 -31.6 -4.3 A A 196 427 A K H < S+ 0 0 156 -4,-1.8 4,-0.4 1,-0.2 -1,-0.2 0.917 115.1 42.1 -63.8 -40.9 37.4 -35.0 -5.8 A A 197 428 A Y H < S+ 0 0 176 -4,-2.2 3,-0.3 1,-0.2 -2,-0.2 0.896 120.3 43.3 -66.0 -41.0 39.3 -33.4 -8.6 A A 198 429 A D H >X S+ 0 0 3 -4,-2.8 4,-2.4 -5,-0.2 3,-1.7 0.762 90.1 79.8 -83.6 -26.3 41.1 -30.8 -6.4 A A 199 430 A K T 3< S+ 0 0 74 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.1 0.848 101.5 37.3 -62.2 -35.3 42.2 -32.8 -3.4 A A 200 431 A D T 34 S+ 0 0 106 -4,-0.4 -1,-0.3 -3,-0.3 -2,-0.1 0.436 118.7 51.6 -94.8 4.1 45.3 -34.3 -5.0 A A 201 432 A E T <4 S+ 0 0 93 -3,-1.7 -2,-0.2 -4,-0.1 -1,-0.2 0.734 80.2 105.6-103.0 -31.6 46.1 -31.2 -7.0 A A 202 433 A V < + 0 0 8 -4,-2.4 -177,-0.2 1,-0.1 3,-0.1 -0.223 37.7 178.2 -56.7 136.2 46.1 -28.5 -4.3 A A 203 434 A D + 0 0 44 -179,-2.3 2,-0.3 1,-0.3 -178,-0.2 0.396 70.0 24.1-117.0 0.5 49.6 -27.2 -3.3 A A 204 435 A L E -b 25 0A 0 -180,-0.8 -178,-3.0 24,-0.2 2,-0.5 -0.911 61.8-157.2-163.1 133.9 48.4 -24.5 -0.7 A A 205 436 A L E -bd 26 230A 0 24,-2.3 26,-2.6 -2,-0.3 2,-0.5 -0.979 9.9-177.1-115.3 127.4 45.3 -24.0 1.4 A A 206 437 A I E -bd 27 231A 4 -180,-2.5 -178,-2.8 -2,-0.5 2,-0.5 -0.992 8.7-161.3-122.4 121.8 44.4 -20.6 2.7 A A 207 438 A V E -bd 28 232A 0 24,-2.8 26,-2.9 -2,-0.5 2,-0.4 -0.924 13.8-176.3-104.5 127.2 41.3 -20.3 4.9 A A 208 439 A I E -bd 29 233A 0 -180,-2.7 -178,-1.8 -2,-0.5 -175,-0.3 -0.984 56.4 -13.3-130.6 123.3 39.9 -16.7 5.1 A A 209 440 A G S S+ 0 0 6 24,-1.9 -177,-2.4 -2,-0.4 -176,-0.4 0.877 94.8 115.0 61.3 43.9 37.1 -15.4 7.2 A A 210 441 A S - 0 0 10 -180,-0.2 -1,-0.2 -179,-0.2 26,-0.1 -0.997 56.2-152.3-142.1 146.3 35.4 -18.7 8.4 A A 211 442 A S - 0 0 22 -2,-0.3 -1,-0.1 23,-0.0 -2,-0.0 0.508 36.3-139.3 -85.6 -9.4 34.9 -20.3 11.8 A A 212 443 A L + 0 0 1 1,-0.1 -2,-0.0 2,-0.0 3,-0.0 0.899 57.6 137.0 44.8 52.7 34.8 -23.7 10.0 A A 213 444 A K + 0 0 139 2,-0.0 2,-0.5 1,-0.0 -1,-0.1 0.446 49.0 73.0-101.0 -7.1 32.0 -24.9 12.3 A A 214 445 A V S > S- 0 0 21 2,-0.0 4,-2.4 0, 0.0 5,-0.2 -0.942 79.7-104.7-120.7 132.0 29.9 -26.5 9.6 A A 215 446 A R T 4 S+ 0 0 202 -2,-0.5 -2,-0.0 1,-0.2 -3,-0.0 -0.603 88.2 22.0 -88.0 156.8 30.6 -29.8 7.7 A A 216 447 A P T >4 S+ 0 0 38 0, 0.0 3,-1.9 0, 0.0 4,-0.4 -0.999 124.5 50.6 -85.7 -4.1 31.5 -30.9 5.1 A A 217 448 A V G >4 S+ 0 0 0 1,-0.3 3,-2.1 2,-0.2 -2,-0.2 0.914 106.4 59.2 -58.1 -38.3 33.3 -27.6 4.3 A A 218 449 A A G 3< S+ 0 0 13 -4,-2.4 -1,-0.3 1,-0.3 4,-0.2 0.644 98.1 61.7 -65.1 -12.8 35.0 -27.7 7.7 A A 219 450 A L G X> S+ 0 0 73 -3,-1.9 4,-1.1 -5,-0.2 3,-0.8 0.531 77.1 90.7 -88.2 -7.1 36.4 -31.1 6.7 A A 220 451 A I H X> S+ 0 0 3 -3,-2.1 3,-1.1 -4,-0.4 4,-1.0 0.935 82.4 53.8 -57.7 -46.7 38.4 -29.7 3.7 A A 221 452 A P H 34 S+ 0 0 2 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.796 115.1 41.0 -60.5 -25.6 41.6 -29.0 5.8 A A 222 453 A S H <4 S+ 0 0 48 -3,-0.8 -2,-0.2 -4,-0.2 4,-0.1 0.532 108.7 61.3 -97.1 -6.3 41.6 -32.7 7.0 A A 223 454 A S H << S+ 0 0 64 -3,-1.1 -1,-0.1 -4,-1.1 -3,-0.1 0.605 91.0 75.5 -95.4 -15.0 40.7 -34.2 3.6 A A 224 455 A I S < S- 0 0 4 -4,-1.0 -24,-0.1 -5,-0.2 -25,-0.1 -0.556 104.8 -70.8 -93.7 163.1 43.7 -32.9 1.6 A A 225 456 A P > - 0 0 33 0, 0.0 3,-1.9 0, 0.0 -1,-0.1 -0.295 44.7-127.7 -56.4 135.2 47.1 -34.4 1.8 A A 226 457 A H T 3 S+ 0 0 78 1,-0.3 -220,-0.1 -4,-0.1 -2,-0.1 0.712 103.3 61.3 -61.6 -25.2 48.7 -33.6 5.2 A A 227 458 A E T 3 S+ 0 0 124 2,-0.1 -1,-0.3 -222,-0.0 3,-0.0 0.646 75.9 107.0 -79.6 -13.8 51.9 -32.1 3.8 A A 228 459 A V S < S- 0 0 10 -3,-1.9 -24,-0.2 1,-0.1 -222,-0.1 -0.476 80.6-112.8 -65.6 128.5 50.1 -29.4 1.9 A A 229 460 A P - 0 0 10 0, 0.0 -24,-2.3 0, 0.0 2,-0.4 -0.376 30.6-154.6 -67.5 147.6 50.8 -26.1 3.7 A A 230 461 A Q E -d 205 0A 2 -26,-0.2 14,-2.4 -221,-0.1 15,-1.4 -0.989 9.9-172.1-129.6 129.2 47.9 -24.4 5.4 A A 231 462 A I E -de 206 245A 3 -26,-2.6 -24,-2.8 -2,-0.4 2,-0.5 -0.965 8.8-154.2-121.6 132.7 47.5 -20.7 6.2 A A 232 463 A L E -de 207 246A 0 13,-2.5 15,-2.9 -2,-0.4 2,-0.4 -0.917 11.5-180.0-106.3 131.9 44.7 -19.1 8.3 A A 233 464 A I E +de 208 247A 2 -26,-2.9 -24,-1.9 -2,-0.5 2,-0.3 -0.932 37.2 121.4-128.0 103.7 43.7 -15.5 7.9 A A 234 465 A N E S- e 0 248A 13 13,-2.0 15,-1.4 -2,-0.4 16,-0.1 -0.994 70.8-116.1-164.8 151.8 40.9 -14.8 10.3 A A 235 466 A R S S+ 0 0 95 -2,-0.3 67,-2.4 13,-0.3 68,-0.5 0.799 103.7 40.4 -66.5 -28.9 39.9 -12.6 13.3 A A 236 467 A E S S- 0 0 79 65,-0.2 -26,-0.1 66,-0.1 13,-0.1 -0.921 86.4-115.6-121.0 146.3 39.8 -15.7 15.5 A A 237 468 A P - 0 0 46 0, 0.0 3,-0.1 0, 0.0 -2,-0.0 -0.363 23.5-133.6 -68.6 159.7 42.0 -18.7 15.9 A A 238 469 A L > - 0 0 6 3,-0.1 3,-2.0 1,-0.1 5,-0.2 -0.851 21.2-173.5-116.9 88.7 40.4 -22.1 15.0 A A 239 470 A P T 3 S+ 0 0 118 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 0.692 77.3 64.8 -63.8 -18.5 41.5 -24.3 17.9 A A 240 471 A H T 3 S+ 0 0 91 -3,-0.1 2,-0.3 2,-0.0 -2,-0.0 0.432 102.1 54.9 -83.6 3.9 40.0 -27.5 16.4 A A 241 472 A L S < S- 0 0 21 -3,-2.0 2,-0.6 -239,-0.0 -3,-0.1 -0.905 76.2-129.2-134.9 160.2 42.5 -27.4 13.4 A A 242 473 A H - 0 0 62 -239,-0.3 -236,-0.2 -2,-0.3 2,-0.1 -0.791 29.3-179.3-116.8 88.9 46.3 -27.2 13.0 A A 243 474 A F - 0 0 3 -2,-0.6 -12,-0.2 -5,-0.2 3,-0.1 -0.463 27.2-140.0 -80.0 155.3 47.3 -24.4 10.6 A A 244 475 A D S S+ 0 0 0 -14,-2.4 2,-0.4 1,-0.3 -13,-0.2 0.893 90.6 24.1 -81.1 -42.2 51.0 -23.8 9.8 A A 245 476 A V E S-e 231 0A 0 -15,-1.4 -13,-2.5 2,-0.0 2,-0.6 -0.991 70.1-158.3-128.2 131.1 50.8 -20.0 9.9 A A 246 477 A E E -ef 232 295A 26 48,-2.8 50,-2.7 -2,-0.4 2,-0.7 -0.938 9.6-179.3-116.2 108.2 48.1 -18.1 11.8 A A 247 478 A L E -ef 233 296A 0 -15,-2.9 -13,-2.0 -2,-0.6 2,-0.5 -0.918 15.2-168.6-107.3 104.5 47.5 -14.5 10.7 A A 248 479 A L E +ef 234 297A 8 48,-3.2 50,-3.5 -2,-0.7 53,-0.3 -0.861 39.4 55.4-110.1 125.0 44.9 -13.2 13.0 A A 249 480 A G S S- 0 0 0 -15,-1.4 51,-0.3 -2,-0.5 2,-0.2 -0.958 95.2 -16.5 151.4-172.6 43.1 -9.9 12.4 A A 250 481 A D > - 0 0 33 49,-3.0 4,-2.3 -2,-0.3 5,-0.2 -0.478 57.6-138.2 -63.7 130.3 41.0 -8.2 9.7 A A 251 482 A C H > S+ 0 0 14 -2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.848 101.1 52.9 -67.6 -32.7 41.5 -10.1 6.5 A A 252 483 A D H > S+ 0 0 36 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.908 109.6 50.1 -66.8 -38.6 41.7 -6.9 4.3 A A 253 484 A V H > S+ 0 0 23 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.929 115.3 42.8 -61.6 -44.7 44.5 -5.6 6.6 A A 254 485 A I H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.917 114.5 48.4 -70.3 -43.0 46.4 -8.8 6.4 A A 255 486 A I H X S+ 0 0 1 -4,-2.8 4,-3.1 -5,-0.2 -1,-0.2 0.887 107.9 57.0 -67.0 -35.5 45.9 -9.3 2.7 A A 256 487 A N H X S+ 0 0 52 -4,-2.4 4,-1.9 -5,-0.2 -1,-0.2 0.944 108.6 46.8 -56.5 -46.8 47.0 -5.7 2.2 A A 257 488 A E H X S+ 0 0 35 -4,-1.8 4,-1.9 1,-0.2 -2,-0.2 0.933 113.4 47.5 -62.4 -46.5 50.3 -6.5 4.0 A A 258 489 A L H X S+ 0 0 3 -4,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.906 108.7 55.9 -61.4 -39.9 50.8 -9.6 2.0 A A 259 490 A C H X S+ 0 0 0 -4,-3.1 4,-1.7 1,-0.2 8,-0.3 0.880 107.4 48.5 -61.7 -39.5 50.0 -7.8 -1.3 A A 260 491 A H H < S+ 0 0 76 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.887 111.0 50.0 -69.8 -35.4 52.7 -5.2 -0.6 A A 261 492 A R H < S+ 0 0 83 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.810 111.2 49.9 -69.9 -29.1 55.2 -7.9 0.2 A A 262 493 A L H < S- 0 0 30 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.839 89.0-178.3 -76.9 -34.2 54.3 -9.7 -3.1 A A 263 494 A G >X + 0 0 20 -4,-1.7 4,-1.4 -5,-0.2 3,-1.4 -0.360 41.5 80.9 68.0-147.6 54.7 -6.6 -5.2 A A 264 495 A G H 3> S- 0 0 62 1,-0.3 4,-0.9 2,-0.2 3,-0.2 -0.159 118.5 -20.0 49.0-136.8 54.0 -6.9 -8.9 A A 265 496 A E H 3> S+ 0 0 97 1,-0.2 4,-0.7 2,-0.2 -1,-0.3 0.697 134.2 68.0 -73.7 -20.9 50.3 -6.7 -9.6 A A 266 497 A Y H X> S+ 0 0 20 -3,-1.4 3,-1.1 1,-0.2 4,-0.6 0.943 99.6 47.7 -67.4 -44.9 49.4 -7.6 -6.1 A A 267 498 A A H >< S+ 0 0 13 -4,-1.4 3,-1.1 -8,-0.3 -1,-0.2 0.861 105.9 61.1 -61.5 -32.4 50.7 -4.3 -4.6 A A 268 499 A K H 3< S+ 0 0 138 -4,-0.9 -1,-0.3 1,-0.3 -2,-0.2 0.720 88.8 70.7 -70.4 -19.1 48.8 -2.6 -7.4 A A 269 500 A L H << S+ 0 0 41 -3,-1.1 2,-1.4 -4,-0.7 -1,-0.3 0.839 86.5 70.4 -62.5 -33.3 45.5 -4.0 -6.0 A A 270 501 A C << + 0 0 7 -3,-1.1 -1,-0.2 -4,-0.6 5,-0.1 -0.681 59.1 160.6 -88.2 86.9 45.9 -1.7 -3.1 A A 271 502 A C + 0 0 97 -2,-1.4 -1,-0.2 1,-0.1 4,-0.1 0.417 38.1 107.5 -92.5 2.5 45.2 1.6 -4.8 A A 272 503 A N S S+ 0 0 139 2,-0.1 2,-0.2 -3,-0.1 -1,-0.1 -0.977 76.7 27.5-132.7 121.0 44.4 3.5 -1.6 A A 273 504 A P S S- 0 0 103 0, 0.0 2,-0.2 0, 0.0 -1,-0.0 0.566 107.8-107.6 -73.3 172.6 46.3 5.5 -0.6 A A 274 505 A V - 0 0 124 -2,-0.2 -2,-0.1 1,-0.1 2,-0.1 -0.483 32.9-136.8 -73.7 132.2 48.0 6.5 -3.9 A A 275 506 A K - 0 0 85 -2,-0.2 2,-0.3 1,-0.1 -1,-0.1 -0.370 34.2 -78.8 -84.3 165.5 51.5 5.2 -4.5 A A 276 507 A L S S+ 0 0 183 -2,-0.1 2,-0.3 2,-0.0 -1,-0.1 -0.467 70.2 143.8 -65.8 123.0 54.5 7.1 -5.8 A A 277 508 A S - 0 0 96 -2,-0.3 2,-0.3 -3,-0.1 -3,-0.0 -0.992 50.4-104.8-159.0 155.7 54.2 7.3 -9.6 A A 278 509 A E 0 0 192 -2,-0.3 -2,-0.0 1,-0.1 0, 0.0 -0.665 360.0 360.0 -83.5 135.7 54.8 9.5 -12.6 A A 279 510 A I 0 0 221 -2,-0.3 -1,-0.1 0, 0.0 0, 0.0 0.863 360.0 360.0 -63.5 360.0 51.8 11.2 -14.2 A A 280 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 281 -6 B G 0 0 120 0, 0.0 3,-0.1 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0-174.5 43.7 2.4 7.2 B B 282 -5 B P > - 0 0 48 0, 0.0 3,-1.9 0, 0.0 4,-0.2 -0.090 360.0 -65.2 -76.5 172.0 43.5 1.8 10.9 B B 283 -4 B H T 3 S- 0 0 158 1,-0.3 16,-0.1 2,-0.1 0, 0.0 -0.336 119.5 -10.4 -56.7 122.7 45.9 2.8 13.7 B B 284 -3 B M T > S+ 0 0 106 -3,-0.1 3,-1.8 1,-0.1 -1,-0.3 0.839 85.2 163.8 54.7 36.7 49.3 1.0 13.3 B B 285 -2 B G T < + 0 0 18 -3,-1.9 14,-0.3 1,-0.3 -2,-0.1 0.753 67.9 54.1 -55.1 -31.4 47.6 -1.2 10.6 B B 286 -1 B S T 3 S+ 0 0 85 -4,-0.2 2,-0.3 12,-0.1 -1,-0.3 0.460 95.9 84.9 -87.7 0.3 51.0 -2.4 9.2 B B 287 641 B Q < - 0 0 124 -3,-1.8 12,-0.4 2,-0.0 2,-0.3 -0.773 55.8-173.0-103.2 150.1 52.2 -3.6 12.6 B B 288 642 B Y - 0 0 86 -2,-0.3 2,-0.5 10,-0.1 10,-0.2 -0.900 24.6-124.7-130.8 161.5 51.5 -7.0 14.3 B B 289 643 B L E -G 297 0A 98 8,-2.2 8,-2.6 -2,-0.3 2,-0.5 -0.949 30.7-144.7-105.1 128.7 52.2 -8.6 17.6 B B 290 644 B F E -G 296 0A 84 -2,-0.5 6,-0.2 6,-0.2 -2,-0.0 -0.822 18.9-175.2-103.2 126.4 54.1 -11.9 17.3 B B 291 645 B L E >> -G 295 0A 86 4,-2.8 4,-1.7 -2,-0.5 3,-0.7 -0.951 51.3 -83.7-112.4 105.6 53.5 -15.0 19.5 B B 292 646 B P T 34 S+ 0 0 103 0, 0.0 -281,-0.0 0, 0.0 4,-0.0 -0.200 94.2 10.9 -66.3 152.6 56.2 -17.5 18.3 B B 293 647 B P T 34 S- 0 0 71 0, 0.0 -283,-0.0 0, 0.0 -3,-0.0 -0.996 132.8 -11.0 -96.4 -4.5 56.6 -19.5 16.3 B B 294 648 B N T <4 S+ 0 0 17 -3,-0.7 -48,-2.8 -283,-0.1 2,-0.5 0.191 92.5 103.9-149.6 15.1 53.8 -18.8 13.9 B B 295 649 B R E < -fG 246 291A 68 -4,-1.7 -4,-2.8 -50,-0.2 2,-0.4 -0.951 38.0-175.1-117.4 130.1 51.0 -16.5 15.2 B B 296 650 B Y E -fG 247 290A 4 -50,-2.7 -48,-3.2 -2,-0.5 2,-0.6 -0.974 11.5-152.8-124.4 128.5 50.6 -12.9 14.2 B B 297 651 B I E +fG 248 289A 13 -8,-2.6 -8,-2.2 -2,-0.4 2,-0.2 -0.900 21.2 174.5-111.3 118.4 48.1 -10.5 15.7 B B 298 652 B F > - 0 0 1 -50,-3.5 3,-2.0 -2,-0.6 -10,-0.1 -0.656 44.4 -61.6-114.0 168.7 46.9 -7.7 13.5 B B 299 653 B H T 3 S+ 0 0 76 -12,-0.4 -49,-3.0 -14,-0.3 -1,-0.2 -0.223 121.1 29.9 -47.7 132.2 44.3 -4.9 13.8 B B 300 654 B G T 3 S+ 0 0 22 1,-0.3 -1,-0.2 -51,-0.3 -51,-0.2 0.272 78.0 149.8 97.5 -8.1 40.9 -6.4 14.2 B B 301 655 B A X - 0 0 3 -3,-2.0 3,-1.8 -53,-0.3 -1,-0.3 -0.308 52.3-129.9 -57.3 137.3 41.8 -9.6 15.9 B B 302 656 B E G > S+ 0 0 59 -67,-2.4 3,-2.1 1,-0.3 -1,-0.1 0.756 100.9 76.4 -65.1 -23.0 39.1 -10.7 18.3 B B 303 657 B V G 3 S+ 0 0 107 -68,-0.5 -1,-0.3 1,-0.3 -2,-0.1 0.743 86.9 62.2 -59.8 -23.3 41.6 -11.1 21.1 B B 304 658 B Y G < S+ 0 0 124 -3,-1.8 -1,-0.3 2,-0.0 -2,-0.2 0.617 86.2 102.3 -76.3 -13.1 41.6 -7.3 21.4 B B 305 659 B S < 0 0 51 -3,-2.1 -3,-0.0 -4,-0.2 -4,-0.0 -0.257 360.0 360.0 -73.0 158.5 37.9 -7.3 22.3 B B 306 660 B D 0 0 204 -2,-0.0 -1,-0.1 0, 0.0 -2,-0.0 0.219 360.0 360.0-114.2 360.0 36.4 -6.9 25.8 B B