==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/TRANSFERASE INHIBITOR 22-SEP-10 3OY3 . COMPND 2 MOLECULE: TYROSINE-PROTEIN KINASE ABL1; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR T.ZHOU,L.COMMODORE,W.S.HUANG,Y.WANG,M.THOMAS,J.KEATS,Q.XU,V. . 568 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 29487.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 373 65.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 1.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 70 12.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 30 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 78 13.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 176 31.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.4 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 3 2 0 1 2 2 0 0 0 0 2 0 0 0 2 0 0 1 1 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 2 5 3 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 ANTIPARALLEL BRIDGES PER LADDER . 2 0 2 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 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 1 228 A G 0 0 104 0, 0.0 3,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 10.7 6.9 35.1 11.1 2 229 A S > - 0 0 94 3,-0.0 3,-1.7 0, 0.0 0, 0.0 -0.930 360.0 -88.5 178.8 152.2 5.4 36.0 7.8 3 230 A P T 3 S+ 0 0 142 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.700 119.6 43.5 -59.4 -29.2 2.5 34.5 5.7 4 231 A N T 3 S+ 0 0 134 2,-0.0 2,-0.2 -3,-0.0 0, 0.0 0.168 80.5 137.0-108.3 14.9 4.5 32.0 3.7 5 232 A Y < + 0 0 157 -3,-1.7 2,-0.4 2,-0.0 3,-0.0 -0.433 24.6 176.6 -72.1 134.3 6.7 30.6 6.5 6 233 A D > - 0 0 60 -2,-0.2 3,-1.3 3,-0.2 -2,-0.0 -0.953 25.4-146.0-137.8 116.5 7.2 26.8 6.6 7 234 A K T 3 S+ 0 0 159 -2,-0.4 -1,-0.1 1,-0.3 -2,-0.0 0.604 98.6 46.9 -58.7 -15.2 9.5 25.5 9.3 8 235 A W T 3 S+ 0 0 64 68,-0.1 69,-2.4 2,-0.1 -1,-0.3 0.671 88.4 98.1 -98.5 -17.6 10.8 22.7 7.1 9 236 A E B < -a 77 0A 27 -3,-1.3 2,-0.2 67,-0.2 69,-0.2 -0.504 52.0-173.6 -79.8 132.9 11.5 24.7 3.9 10 237 A M - 0 0 27 67,-2.8 2,-0.7 -2,-0.2 69,-0.1 -0.745 32.6-100.2-115.6 170.0 15.1 25.7 3.2 11 238 A E > - 0 0 109 -2,-0.2 3,-3.3 1,-0.1 4,-0.4 -0.833 25.8-140.7 -92.4 117.6 16.6 27.9 0.6 12 239 A R G > S+ 0 0 52 -2,-0.7 3,-1.7 1,-0.3 -1,-0.1 0.802 100.0 62.5 -40.8 -40.5 18.2 25.8 -2.2 13 240 A T G 3 S+ 0 0 104 1,-0.3 -1,-0.3 -3,-0.1 -2,-0.0 0.572 84.7 74.9 -74.8 -4.2 21.1 28.2 -2.4 14 241 A D G < S+ 0 0 58 -3,-3.3 21,-2.0 21,-0.1 2,-0.5 0.728 91.6 70.7 -67.9 -20.3 22.1 27.5 1.2 15 242 A I E < S-B 34 0A 10 -3,-1.7 2,-0.5 -4,-0.4 19,-0.2 -0.842 71.9-148.4-107.4 129.8 23.4 24.1 -0.1 16 243 A T E -B 33 0A 50 17,-2.6 17,-1.8 -2,-0.5 2,-0.4 -0.838 24.0-145.5 -84.6 125.1 26.5 23.5 -2.3 17 244 A M E +B 32 0A 63 -2,-0.5 15,-0.2 15,-0.2 2,-0.1 -0.807 26.2 167.6 -97.2 138.1 25.7 20.5 -4.4 18 245 A K E - 0 0 106 13,-2.7 2,-0.1 -2,-0.4 -1,-0.1 -0.028 40.5 -18.0-120.9-136.4 28.6 18.2 -5.2 19 246 A H E - 0 0 101 1,-0.1 12,-2.8 11,-0.1 -1,-0.3 -0.331 65.3-100.8 -79.1 151.0 28.9 14.6 -6.7 20 247 A K E -B 30 0A 77 10,-0.2 3,-0.4 -3,-0.1 2,-0.3 -0.436 39.2-133.8 -60.5 137.0 26.2 11.9 -7.0 21 248 A L S > S+ 0 0 34 8,-3.4 3,-0.8 1,-0.2 5,-0.4 -0.730 75.5 17.9 -94.5 144.3 26.6 9.3 -4.3 22 249 A G G > S- 0 0 48 -2,-0.3 3,-2.4 1,-0.2 4,-0.4 0.753 108.1 -87.7 73.6 25.0 26.4 5.5 -5.0 23 250 A G G 3 S- 0 0 78 -3,-0.4 -1,-0.2 1,-0.3 -2,-0.1 0.674 83.3 -59.4 58.7 20.1 27.1 5.4 -8.7 24 251 A G G X S+ 0 0 25 -3,-0.8 3,-1.7 3,-0.3 -1,-0.3 0.177 117.2 107.7 94.2 -18.6 23.4 5.8 -9.6 25 252 A Q T < S+ 0 0 60 -3,-2.4 -2,-0.2 1,-0.3 135,-0.1 0.665 83.8 46.4 -68.6 -14.7 22.4 2.6 -7.7 26 253 A Y T 3 S- 0 0 20 -5,-0.4 -1,-0.3 1,-0.4 -3,-0.1 0.157 110.7-126.6-113.2 15.9 20.8 4.9 -5.0 27 254 A G < - 0 0 7 -3,-1.7 2,-1.9 -5,-0.2 -1,-0.4 -0.367 66.4 -11.1 77.9-154.5 19.0 7.2 -7.4 28 255 A E S S+ 0 0 63 17,-0.2 17,-2.6 -3,-0.1 2,-0.5 -0.472 86.6 136.6 -87.2 67.8 19.4 11.0 -7.4 29 256 A V E - C 0 44A 13 -2,-1.9 -8,-3.4 -8,-0.4 2,-0.3 -0.974 29.6-172.5-119.0 126.2 21.2 11.5 -4.2 30 257 A Y E -BC 20 43A 41 13,-3.0 13,-2.6 -2,-0.5 2,-0.3 -0.814 27.4-116.2-115.4 150.4 24.1 13.9 -4.0 31 258 A E E + C 0 42A 42 -12,-2.8 -13,-2.7 -2,-0.3 2,-0.3 -0.614 47.8 166.9 -73.9 144.0 26.8 14.9 -1.4 32 259 A G E -BC 17 41A 0 9,-2.9 9,-3.3 -2,-0.3 2,-0.4 -0.942 32.3-129.5-148.0 178.6 26.3 18.5 -0.4 33 260 A V E -BC 16 40A 32 -17,-1.8 -17,-2.6 -2,-0.3 2,-1.2 -0.995 11.9-142.6-135.4 127.4 27.3 21.1 2.2 34 261 A W E > > -BC 15 39A 13 5,-3.0 5,-1.5 -2,-0.4 3,-1.0 -0.781 26.3-159.1 -87.6 95.0 24.9 23.3 4.2 35 262 A K G > 5S+ 0 0 118 -21,-2.0 3,-1.5 -2,-1.2 -1,-0.2 0.855 80.7 54.9 -52.0 -48.2 27.3 26.3 4.0 36 263 A K G 3 5S+ 0 0 158 -22,-0.4 -1,-0.3 1,-0.3 -21,-0.1 0.843 117.1 36.6 -57.2 -36.7 26.0 28.3 6.9 37 264 A Y G < 5S- 0 0 17 -3,-1.0 -1,-0.3 2,-0.1 -2,-0.2 0.235 100.5-125.8-106.2 11.6 26.4 25.4 9.3 38 265 A S T < 5 + 0 0 80 -3,-1.5 2,-0.5 -4,-0.4 -3,-0.2 0.853 62.4 146.1 50.7 37.3 29.6 23.9 8.0 39 266 A L E < -C 34 0A 11 -5,-1.5 -5,-3.0 521,-0.0 2,-0.3 -0.930 48.8-138.0-114.8 122.8 27.7 20.6 7.7 40 267 A T E +C 33 0A 59 -2,-0.5 50,-1.9 -7,-0.2 -7,-0.3 -0.611 35.4 179.3 -69.8 129.8 28.2 18.0 5.1 41 268 A V E -CD 32 89A 0 -9,-3.3 -9,-2.9 -2,-0.3 2,-0.4 -0.735 29.8-127.5-124.7 173.6 24.8 16.7 3.9 42 269 A A E -CD 31 88A 21 46,-3.3 46,-2.4 -11,-0.2 2,-0.4 -0.970 27.4-160.5-118.4 143.4 23.3 14.2 1.5 43 270 A V E -CD 30 87A 1 -13,-2.6 -13,-3.0 -2,-0.4 2,-0.5 -0.979 10.2-157.2-133.1 122.7 20.6 15.5 -0.8 44 271 A K E -CD 29 86A 48 42,-2.8 42,-1.8 -2,-0.4 2,-0.3 -0.835 20.1-173.2 -95.1 132.9 17.9 13.7 -2.7 45 272 A T E - D 0 85A 12 -17,-2.6 -17,-0.2 -2,-0.5 40,-0.2 -0.890 30.1-165.8-126.0 155.4 16.5 15.5 -5.7 46 273 A L - 0 0 20 38,-1.1 -1,-0.2 -2,-0.3 3,-0.1 0.809 36.5-145.8 -97.8 -51.7 13.7 14.9 -8.1 47 274 A K - 0 0 112 1,-0.3 2,-0.1 37,-0.3 -2,-0.0 0.885 40.5 -71.6 85.8 96.7 15.0 17.5 -10.5 48 275 A E S S+ 0 0 80 1,-0.1 36,-0.4 33,-0.0 -1,-0.3 -0.465 88.8 117.2 41.2-119.0 12.1 19.1 -12.1 49 276 A D - 0 0 110 -2,-0.1 -1,-0.1 -3,-0.1 0, 0.0 -0.465 63.3-103.6-146.3 57.7 10.7 17.1 -14.1 50 277 A T S S+ 0 0 114 1,-0.1 2,-0.5 2,-0.0 -1,-0.0 0.557 82.0 43.5 58.9 145.3 7.1 15.7 -13.8 51 278 A M S S+ 0 0 174 1,-0.1 4,-0.2 4,-0.0 3,-0.2 -0.187 97.2 60.9 97.9 -35.6 5.8 12.3 -12.7 52 279 A E S > S+ 0 0 129 -2,-0.5 4,-1.8 1,-0.1 3,-0.2 0.349 76.2 104.9 -96.5 5.4 7.7 11.1 -9.6 53 280 A V H > + 0 0 43 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.872 70.0 54.6 -63.3 -44.0 6.5 14.1 -7.7 54 281 A E H > S+ 0 0 148 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.932 109.1 46.7 -56.9 -50.2 3.8 12.5 -5.5 55 282 A E H > S+ 0 0 126 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.881 110.7 54.2 -64.6 -32.3 6.1 9.9 -4.0 56 283 A F H X S+ 0 0 6 -4,-1.8 4,-2.3 2,-0.2 -1,-0.2 0.952 110.6 45.4 -62.7 -46.2 8.8 12.6 -3.3 57 284 A L H X S+ 0 0 72 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.897 112.4 51.8 -65.5 -37.7 6.2 14.7 -1.4 58 285 A K H X S+ 0 0 119 -4,-2.6 4,-3.0 -5,-0.2 -1,-0.2 0.923 108.3 51.3 -61.4 -45.3 5.0 11.6 0.5 59 286 A E H X S+ 0 0 50 -4,-2.7 4,-2.9 2,-0.2 -2,-0.2 0.938 111.6 47.3 -57.2 -46.4 8.6 10.7 1.5 60 287 A A H X S+ 0 0 4 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.953 111.1 51.4 -63.2 -44.6 9.1 14.3 2.8 61 288 A A H < S+ 0 0 52 -4,-2.7 4,-0.5 1,-0.2 3,-0.3 0.946 112.2 46.7 -58.8 -47.3 5.8 14.1 4.7 62 289 A V H >< S+ 0 0 68 -4,-3.0 3,-1.9 1,-0.2 4,-0.3 0.930 109.7 53.1 -57.2 -50.2 6.8 10.8 6.3 63 290 A M H >< S+ 0 0 20 -4,-2.9 3,-1.4 1,-0.3 11,-0.5 0.824 97.1 65.6 -59.8 -30.3 10.3 12.0 7.2 64 291 A K T 3< S+ 0 0 65 -4,-2.1 -1,-0.3 -3,-0.3 -2,-0.2 0.737 104.3 48.8 -61.6 -18.5 8.9 15.1 9.0 65 292 A E T < S+ 0 0 108 -3,-1.9 2,-0.6 -4,-0.5 -1,-0.2 0.446 94.5 87.0 -98.9 -4.3 7.3 12.6 11.5 66 293 A I < + 0 0 24 -3,-1.4 8,-0.5 -4,-0.3 2,-0.4 -0.869 41.2 154.9-111.1 114.3 10.4 10.5 12.2 67 294 A K + 0 0 126 -2,-0.6 6,-0.1 6,-0.1 5,-0.1 -0.894 20.4 124.4-141.4 107.8 12.9 11.5 14.9 68 295 A H > - 0 0 27 3,-0.4 3,-1.8 -2,-0.4 55,-0.1 -0.975 63.1-115.6-163.1 144.1 15.0 8.8 16.4 69 296 A P T 3 S+ 0 0 88 0, 0.0 4,-0.1 0, 0.0 54,-0.1 0.802 115.1 43.8 -60.8 -27.8 18.8 8.4 16.9 70 297 A N T 3 S+ 0 0 16 81,-0.1 82,-2.9 49,-0.1 2,-0.3 0.091 104.2 72.3-107.4 20.5 18.9 5.3 14.7 71 298 A L B < S-f 152 0B 7 -3,-1.8 -3,-0.4 80,-0.3 82,-0.2 -0.968 96.9 -92.4-124.8 149.3 16.7 6.6 11.9 72 299 A V - 0 0 22 80,-1.8 2,-0.6 -2,-0.3 -4,-0.1 -0.271 42.3-140.0 -60.8 146.0 17.7 9.2 9.3 73 300 A Q - 0 0 38 16,-0.1 16,-0.6 -6,-0.1 -6,-0.1 -0.927 9.0-126.8-120.1 118.4 16.6 12.7 10.5 74 301 A L E - E 0 88A 3 -2,-0.6 14,-0.2 -11,-0.5 3,-0.1 -0.340 24.0-179.6 -60.0 133.2 15.2 15.2 8.1 75 302 A L E - 0 0 18 12,-2.8 2,-0.3 1,-0.5 13,-0.2 0.659 62.3 -42.5-101.1 -28.9 17.1 18.6 8.2 76 303 A G E - E 0 87A 0 11,-1.1 11,-2.4 -66,-0.0 -1,-0.5 -0.947 49.7-140.8 175.1 166.0 15.1 20.4 5.6 77 304 A V E -aE 9 86A 0 -69,-2.4 -67,-2.8 -2,-0.3 2,-0.4 -0.922 9.5-145.8-136.3 165.7 13.3 20.2 2.3 78 305 A C E + E 0 85A 3 7,-2.4 7,-1.7 -2,-0.3 -69,-0.1 -0.908 41.7 140.9-128.5 106.0 12.8 22.4 -0.8 79 306 A T + 0 0 29 -2,-0.4 5,-0.1 5,-0.2 -1,-0.1 0.130 43.5 88.8-134.4 23.2 9.4 21.5 -2.2 80 307 A R S S- 0 0 109 1,-0.4 4,-0.1 3,-0.1 -1,-0.0 0.802 105.0 -3.1 -88.4 -35.1 7.9 24.8 -3.3 81 308 A E S S- 0 0 93 2,-0.2 -1,-0.4 -33,-0.0 -33,-0.0 -0.968 98.5 -49.1-152.0 158.5 9.3 24.7 -6.8 82 309 A P S S+ 0 0 65 0, 0.0 2,-0.1 0, 0.0 -33,-0.1 -0.425 103.5 56.1 -76.6 154.6 11.6 22.3 -8.7 83 310 A P S S- 0 0 35 0, 0.0 -2,-0.2 0, 0.0 2,-0.2 0.505 81.9-152.9 -72.8 136.4 14.2 21.0 -8.3 84 311 A F - 0 0 22 -36,-0.4 -38,-1.1 -5,-0.1 2,-0.4 -0.497 10.7-162.0 -72.2 147.1 12.8 19.4 -5.1 85 312 A Y E -DE 45 78A 27 -7,-1.7 -7,-2.4 -40,-0.2 2,-0.4 -0.982 17.7-169.0-131.6 141.4 15.3 18.5 -2.3 86 313 A I E -DE 44 77A 6 -42,-1.8 -42,-2.8 -2,-0.4 2,-0.5 -0.997 23.9-161.7-122.7 126.7 15.2 16.3 0.7 87 314 A I E +DE 43 76A 0 -11,-2.4 -12,-2.8 -2,-0.4 -11,-1.1 -0.923 19.1 160.3-120.7 126.6 18.2 16.9 2.9 88 315 A I E -DE 42 74A 24 -46,-2.4 -46,-3.3 -2,-0.5 -14,-0.1 -0.925 48.2 -82.2-130.9 165.3 19.8 14.9 5.7 89 316 A E E -D 41 0A 101 -16,-0.6 -48,-0.3 -2,-0.3 2,-0.2 -0.358 51.9-107.0 -63.3 141.2 23.2 14.8 7.4 90 317 A F - 0 0 53 -50,-1.9 2,-0.6 -58,-0.1 -1,-0.1 -0.461 24.9-140.7 -70.9 135.2 25.9 12.8 5.5 91 318 A M > - 0 0 19 -2,-0.2 3,-1.7 1,-0.1 53,-0.2 -0.919 13.2-138.3-104.8 120.6 26.8 9.5 7.0 92 319 A T T 3 S+ 0 0 62 -2,-0.6 53,-0.2 1,-0.3 -1,-0.1 0.736 92.2 38.1 -49.9 -43.8 30.5 9.0 6.7 93 320 A Y T 3 S- 0 0 111 51,-2.6 -1,-0.3 1,-0.3 52,-0.2 0.339 95.0-140.9-101.0 6.4 30.7 5.4 5.8 94 321 A G E < +G 144 0B 28 -3,-1.7 50,-2.8 50,-0.5 -1,-0.3 -0.265 56.2 3.0 75.4-155.6 27.8 4.9 3.5 95 322 A N E > -G 143 0B 19 48,-0.2 4,-2.0 1,-0.1 48,-0.3 -0.362 64.1-126.8 -77.9 149.3 25.5 1.9 3.3 96 323 A L H > S+ 0 0 0 46,-2.3 4,-2.9 43,-0.9 5,-0.2 0.819 103.2 60.6 -65.8 -35.2 25.9 -0.9 5.7 97 324 A L H > S+ 0 0 23 42,-0.9 4,-2.0 45,-0.3 -1,-0.2 0.959 111.8 38.4 -59.9 -51.3 26.1 -3.7 3.1 98 325 A D H > S+ 0 0 64 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.844 113.7 58.3 -68.5 -31.6 29.2 -2.2 1.4 99 326 A Y H >X S+ 0 0 20 -4,-2.0 4,-1.0 2,-0.2 3,-0.6 0.950 108.3 44.3 -60.6 -49.1 30.6 -1.3 4.9 100 327 A L H >< S+ 0 0 1 -4,-2.9 3,-0.6 1,-0.2 -2,-0.2 0.918 112.7 53.3 -60.1 -40.5 30.4 -5.0 6.0 101 328 A R H 3< S+ 0 0 130 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.690 119.3 32.6 -71.9 -19.0 31.9 -6.1 2.7 102 329 A E H << S+ 0 0 155 -4,-1.2 -1,-0.2 -3,-0.6 -2,-0.2 0.394 93.4 119.6-115.7 5.8 34.9 -3.7 3.0 103 330 A C << - 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0 0 34 -2,-0.3 5,-0.1 -19,-0.2 -1,-0.1 0.320 46.2-120.3-107.8 7.1 44.0 33.7 45.1 441 383 B G > + 0 0 18 1,-0.1 3,-0.6 2,-0.1 4,-0.2 0.969 51.5 166.9 51.5 58.3 46.9 32.2 47.0 442 384 B L G >> + 0 0 0 1,-0.2 4,-3.1 2,-0.2 3,-1.2 0.613 44.9 91.4 -85.0 -16.4 44.4 30.0 48.8 443 385 B S G 34 S+ 0 0 32 1,-0.3 -1,-0.2 2,-0.2 -2,-0.1 0.744 99.8 38.5 -55.0 -19.4 46.7 27.4 50.5 444 386 B R G <4 S+ 0 0 152 -3,-0.6 -1,-0.3 14,-0.0 -2,-0.2 0.622 123.2 37.1-105.5 -22.9 46.6 29.7 53.5 445 387 B L T <4 S+ 0 0 62 -3,-1.2 2,-0.6 -4,-0.2 -2,-0.2 0.717 94.5 85.1-108.9 -30.1 43.0 30.9 53.4 446 388 B M < - 0 0 34 -4,-3.1 5,-0.3 -135,-0.1 2,-0.2 -0.682 63.5-156.7 -86.9 119.4 41.0 27.9 52.4 447 389 B T + 0 0 105 -2,-0.6 2,-0.3 3,-0.1 3,-0.2 -0.502 48.8 51.6 -94.2 163.8 40.0 25.6 55.2 448 390 B G S S- 0 0 46 -2,-0.2 3,-0.2 1,-0.1 -2,-0.0 -0.811 105.3 -49.4 108.7-157.4 39.1 21.9 55.0 449 391 B D S S+ 0 0 112 -2,-0.3 -1,-0.1 1,-0.2 -2,-0.1 0.499 108.1 91.1-100.3 -5.5 41.0 19.1 53.4 450 392 B T S S+ 0 0 24 -3,-0.2 2,-0.4 1,-0.2 12,-0.3 0.900 98.1 33.9 -60.4 -40.4 41.7 20.6 50.0 451 393 B Y S S+ 0 0 3 -5,-0.3 2,-0.3 -3,-0.2 -1,-0.2 -0.966 78.5 171.0-113.0 136.1 45.0 22.0 51.3 452 394 B T E -R 459 0F 38 7,-2.3 7,-2.7 -2,-0.4 5,-0.1 -0.951 41.5 -75.4-140.7 160.0 47.0 20.1 53.9 453 395 B A E +R 458 0F 84 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.231 62.7 145.3 -56.7 132.7 50.4 20.2 55.6 454 396 B H E > -R 457 0F 57 3,-3.2 3,-2.7 7,-0.0 -2,-0.0 -0.880 58.7 -3.2-171.5 136.3 53.3 19.1 53.4 455 397 B A T 3 S- 0 0 71 1,-0.3 3,-0.1 -2,-0.3 -2,-0.0 0.770 128.4 -53.4 52.7 28.5 56.9 19.9 52.7 456 398 B G T 3 S+ 0 0 89 1,-0.3 -1,-0.3 0, 0.0 2,-0.2 0.577 130.1 58.4 86.4 9.2 56.8 22.7 55.2 457 399 B A E < S-R 454 0F 48 -3,-2.7 -3,-3.2 -5,-0.1 2,-0.5 -0.722 94.5 -81.0-144.3-169.6 53.8 24.4 53.5 458 400 B K E -R 453 0F 85 -5,-0.2 -5,-0.2 -2,-0.2 -15,-0.1 -0.959 45.2-174.3-106.4 125.8 50.2 23.7 52.6 459 401 B F E -R 452 0F 15 -7,-2.7 -7,-2.3 -2,-0.5 2,-1.5 -0.899 34.3-127.9-114.9 142.9 49.7 21.7 49.3 460 402 B P >> - 0 0 14 0, 0.0 3,-1.8 0, 0.0 4,-0.6 -0.749 35.6-168.4 -80.6 91.0 46.5 20.8 47.5 461 403 B I G >4 S+ 0 0 14 -2,-1.5 3,-1.6 1,-0.3 8,-0.1 0.864 75.7 56.2 -52.9 -45.4 47.7 17.2 47.4 462 404 B K G 34 S+ 0 0 24 -12,-0.3 -1,-0.3 1,-0.3 36,-0.1 0.570 113.0 41.2 -73.7 -7.6 45.1 15.9 45.0 463 405 B W G <4 S+ 0 0 17 -3,-1.8 2,-0.4 2,-0.1 -1,-0.3 0.410 93.1 105.9-106.4 -5.8 46.1 18.4 42.3 464 406 B T S << S- 0 0 11 -3,-1.6 5,-0.1 -4,-0.6 15,-0.1 -0.665 70.3-121.4 -95.8 129.1 49.9 18.2 42.8 465 407 B A >> - 0 0 1 -2,-0.4 4,-2.1 13,-0.2 3,-0.9 -0.239 26.8-113.1 -59.5 149.3 52.1 16.4 40.3 466 408 B P H 3> S+ 0 0 0 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.862 117.0 50.5 -54.8 -43.4 54.3 13.4 41.7 467 409 B E H 3> S+ 0 0 21 69,-0.3 4,-1.7 1,-0.2 6,-1.5 0.751 110.4 51.1 -69.3 -24.0 57.6 15.2 41.2 468 410 B S H <> S+ 0 0 0 -3,-0.9 4,-1.1 4,-0.2 -1,-0.2 0.882 111.6 45.9 -77.7 -41.4 56.2 18.3 43.0 469 411 B L H < S+ 0 0 17 -4,-2.1 -2,-0.2 1,-0.1 -1,-0.1 0.914 124.1 32.9 -62.5 -46.7 55.0 16.2 46.0 470 412 B A H < S+ 0 0 47 -4,-2.4 -2,-0.2 -5,-0.2 -3,-0.2 0.775 136.2 17.9 -86.8 -30.2 58.3 14.2 46.3 471 413 B Y H < S- 0 0 160 -4,-1.7 -3,-0.2 -5,-0.2 -2,-0.1 0.363 93.6-118.6-125.9 1.8 61.0 16.7 45.2 472 414 B N < + 0 0 86 -4,-1.1 2,-0.6 1,-0.2 -4,-0.2 0.835 61.2 153.8 60.0 32.5 59.3 20.1 45.5 473 415 B K + 0 0 142 -6,-1.5 2,-0.4 -8,-0.1 -1,-0.2 -0.862 18.6 179.4 -98.2 117.2 59.8 20.5 41.7 474 416 B F + 0 0 39 -2,-0.6 2,-0.3 -3,-0.1 -56,-0.0 -0.955 13.2 140.1-120.8 138.3 57.3 22.9 40.1 475 417 B S >> - 0 0 41 -2,-0.4 4,-1.6 1,-0.0 3,-0.8 -0.917 69.4 -78.5-158.2 178.6 57.2 23.8 36.4 476 418 B I H 3> S+ 0 0 38 -2,-0.3 4,-1.0 1,-0.2 5,-0.1 0.827 128.5 60.8 -59.0 -27.5 54.9 24.3 33.5 477 419 B K H 3> S+ 0 0 42 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.771 100.8 50.3 -71.6 -29.2 54.7 20.5 33.3 478 420 B S H <> S+ 0 0 7 -3,-0.8 4,-2.0 2,-0.2 -1,-0.2 0.780 106.7 56.9 -75.4 -23.7 53.3 20.3 36.9 479 421 B D H X S+ 0 0 2 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.799 104.1 53.6 -68.0 -26.9 50.8 22.9 35.7 480 422 B V H X S+ 0 0 0 -4,-1.0 4,-1.8 2,-0.2 -2,-0.2 0.915 106.7 50.5 -74.8 -41.5 49.8 20.4 32.9 481 423 B W H X S+ 0 0 1 -4,-1.4 4,-1.5 2,-0.2 -2,-0.2 0.933 112.1 47.4 -52.7 -53.0 49.3 17.7 35.5 482 424 B A H X S+ 0 0 7 -4,-2.0 4,-2.7 1,-0.2 -2,-0.2 0.907 107.2 55.6 -59.6 -42.8 47.0 20.1 37.5 483 425 B F H X S+ 0 0 0 -4,-2.3 4,-3.0 1,-0.3 -1,-0.2 0.893 103.9 57.6 -57.3 -37.1 45.1 21.1 34.4 484 426 B G H X S+ 0 0 0 -4,-1.8 4,-1.5 2,-0.2 -1,-0.3 0.907 107.5 44.5 -59.3 -43.6 44.4 17.4 34.0 485 427 B V H X S+ 0 0 0 -4,-1.5 4,-1.8 2,-0.2 -2,-0.2 0.881 111.1 54.7 -68.9 -35.4 42.8 17.3 37.4 486 428 B L H X S+ 0 0 0 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.887 103.4 56.1 -64.1 -38.9 40.9 20.5 36.5 487 429 B L H X S+ 0 0 6 -4,-3.0 4,-2.7 1,-0.2 -1,-0.2 0.935 106.6 50.5 -54.0 -43.5 39.6 18.7 33.4 488 430 B W H X S+ 0 0 10 -4,-1.5 4,-0.8 1,-0.2 7,-0.2 0.866 107.9 53.0 -66.9 -34.9 38.3 16.1 35.7 489 431 B E H <>S+ 0 0 1 -4,-1.8 5,-3.9 2,-0.2 6,-0.4 0.878 111.3 45.9 -61.2 -42.6 36.6 18.8 37.9 490 432 B I H ><5S+ 0 0 6 -4,-2.3 3,-2.0 3,-0.2 -2,-0.2 0.954 109.9 53.1 -67.7 -48.9 34.9 20.2 34.9 491 433 B A H 3<5S+ 0 0 21 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.655 114.9 41.9 -62.6 -18.9 33.7 16.8 33.5 492 434 B T T 3<5S- 0 0 19 -4,-0.8 -1,-0.3 -3,-0.2 -2,-0.2 0.303 114.6-114.1-107.5 8.2 32.2 16.0 36.9 493 435 B Y T < 5S- 0 0 33 -3,-2.0 -3,-0.2 1,-0.2 -2,-0.1 0.910 83.7 -35.7 53.2 45.1 30.7 19.5 37.4 494 436 B G S S- 0 0 2 1,-0.2 3,-2.2 2,-0.1 -2,-0.0 0.952 89.5-138.4 48.2 62.7 40.0 10.9 43.9 499 441 B P T 3 S+ 0 0 77 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 -0.229 78.0 5.3 -60.1 121.7 36.6 10.2 45.4 500 442 B G T 3 S+ 0 0 87 1,-0.2 2,-0.5 -3,-0.2 -2,-0.1 0.465 99.5 120.8 92.9 2.0 36.9 8.1 48.6 501 443 B I < - 0 0 30 -3,-2.2 -1,-0.2 -4,-0.2 5,-0.1 -0.880 63.0-120.9-112.0 126.4 40.7 8.0 48.7 502 444 B D >> - 0 0 99 -2,-0.5 3,-2.0 1,-0.1 4,-0.6 -0.367 19.0-128.7 -59.8 135.8 42.8 9.3 51.7 503 445 B L H >> S+ 0 0 47 1,-0.3 3,-1.4 2,-0.2 4,-0.5 0.871 107.9 64.7 -45.6 -41.2 45.3 12.0 50.7 504 446 B S H 34 S+ 0 0 105 1,-0.3 -1,-0.3 2,-0.1 4,-0.3 0.644 103.7 45.5 -68.3 -12.1 48.0 9.9 52.4 505 447 B Q H <> S+ 0 0 89 -3,-2.0 4,-1.9 2,-0.1 -1,-0.3 0.515 88.0 91.8-104.3 -7.7 47.6 7.2 49.9 506 448 B V H S+ 0 0 121 -4,-0.3 4,-1.2 1,-0.2 -1,-0.2 0.847 111.5 49.0 -55.6 -36.8 51.6 5.6 46.3 509 451 B L H <>S+ 0 0 43 -4,-1.9 5,-2.8 -3,-0.2 3,-0.4 0.928 111.1 48.5 -68.8 -45.5 48.6 5.0 44.1 510 452 B L H ><5S+ 0 0 2 -4,-2.7 3,-1.7 1,-0.2 -2,-0.2 0.907 108.5 56.8 -59.0 -39.5 50.0 7.4 41.4 511 453 B E H 3<5S+ 0 0 113 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.815 104.5 50.1 -64.5 -31.7 53.3 5.5 41.7 512 454 B K T 3<5S- 0 0 153 -4,-1.2 -1,-0.3 -3,-0.4 -2,-0.2 0.430 127.7-101.7 -84.5 2.3 51.6 2.2 40.9 513 455 B D T < 5 + 0 0 99 -3,-1.7 2,-0.3 1,-0.3 -3,-0.2 0.662 69.2 154.3 81.4 20.9 50.1 3.8 37.9 514 456 B Y < + 0 0 90 -5,-2.8 2,-0.3 -6,-0.1 -1,-0.3 -0.633 13.8 170.9 -70.9 135.5 46.6 4.4 39.4 515 457 B R - 0 0 13 -2,-0.3 16,-0.0 0, 0.0 -5,-0.0 -0.962 42.4 -82.7-138.5 156.9 44.8 7.4 37.8 516 458 B M - 0 0 2 -2,-0.3 2,-0.1 1,-0.1 15,-0.0 -0.259 51.0-111.9 -57.4 145.9 41.2 8.6 38.1 517 459 B E - 0 0 141 1,-0.1 -1,-0.1 -3,-0.0 -3,-0.0 -0.355 41.6 -84.2 -74.1 158.5 38.7 6.7 35.9 518 460 B R - 0 0 92 1,-0.1 -1,-0.1 -2,-0.1 3,-0.1 -0.500 54.2-120.4 -62.6 122.1 37.0 8.5 33.0 519 461 B P > - 0 0 7 0, 0.0 3,-2.4 0, 0.0 -1,-0.1 -0.326 40.1 -77.7 -67.9 151.9 34.0 10.2 34.5 520 462 B E T 3 S+ 0 0 182 1,-0.3 0, 0.0 -28,-0.0 0, 0.0 -0.177 118.5 8.6 -42.2 124.4 30.4 9.3 33.3 521 463 B G T 3 S+ 0 0 65 1,-0.3 -1,-0.3 -3,-0.1 -29,-0.0 0.392 88.6 141.0 83.6 -5.8 29.8 11.1 30.0 522 464 B C < - 0 0 5 -3,-2.4 -1,-0.3 1,-0.1 5,-0.1 -0.593 59.3-113.8 -76.4 124.5 33.4 12.3 29.5 523 465 B P >> - 0 0 75 0, 0.0 4,-2.0 0, 0.0 3,-1.5 -0.355 19.9-125.4 -62.2 132.4 34.3 11.9 25.8 524 466 B E H 3> S+ 0 0 109 1,-0.3 4,-2.5 2,-0.2 5,-0.2 0.815 110.8 56.8 -48.2 -37.6 37.0 9.4 25.3 525 467 B K H 3> S+ 0 0 53 2,-0.2 4,-1.5 1,-0.2 -1,-0.3 0.878 107.2 49.5 -66.5 -32.9 39.2 11.8 23.5 526 468 B V H <> S+ 0 0 13 -3,-1.5 4,-2.1 2,-0.2 -2,-0.2 0.904 110.4 49.7 -70.5 -40.3 39.0 14.2 26.5 527 469 B Y H X S+ 0 0 33 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.883 106.2 56.2 -62.3 -39.1 39.9 11.3 28.8 528 470 B E H X S+ 0 0 132 -4,-2.5 4,-1.3 -5,-0.2 -1,-0.2 0.906 108.5 48.3 -60.7 -36.7 42.9 10.5 26.6 529 471 B L H X S+ 0 0 27 -4,-1.5 4,-1.8 2,-0.2 -2,-0.2 0.879 110.3 51.3 -70.6 -38.3 44.1 14.1 27.0 530 472 B M H X S+ 0 0 0 -4,-2.1 4,-1.1 1,-0.2 -2,-0.2 0.953 108.8 50.9 -56.2 -53.8 43.6 13.8 30.8 531 473 B R H < S+ 0 0 88 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.768 109.2 50.7 -60.4 -30.1 45.6 10.6 31.0 532 474 B A H >< S+ 0 0 29 -4,-1.3 3,-1.5 1,-0.2 -1,-0.3 0.844 104.5 57.1 -76.3 -34.8 48.5 12.2 29.0 533 475 B C H 3< S+ 0 0 0 -4,-1.8 -2,-0.2 1,-0.3 -1,-0.2 0.796 106.3 53.5 -61.7 -24.8 48.4 15.2 31.4 534 476 B W T 3< S+ 0 0 1 -4,-1.1 -1,-0.3 -5,-0.1 2,-0.2 -0.018 72.6 141.9-104.8 29.2 49.0 12.6 34.1 535 477 B Q < - 0 0 80 -3,-1.5 6,-0.1 1,-0.1 -3,-0.1 -0.524 56.4-129.9 -62.2 136.5 52.1 10.9 32.6 536 478 B W S S+ 0 0 90 -2,-0.2 -69,-0.3 4,-0.1 -1,-0.1 0.922 95.2 60.4 -59.9 -45.8 54.4 10.1 35.5 537 479 B N S > S- 0 0 77 1,-0.1 3,-1.6 -71,-0.1 4,-0.4 -0.761 81.3-142.4 -87.6 124.4 57.4 11.7 33.8 538 480 B P G > S+ 0 0 33 0, 0.0 3,-1.0 0, 0.0 -1,-0.1 0.758 99.1 63.3 -56.5 -28.7 56.8 15.5 33.1 539 481 B S G 3 S+ 0 0 100 1,-0.3 -3,-0.0 -3,-0.0 -2,-0.0 0.807 99.6 54.4 -65.7 -31.9 58.7 15.2 29.8 540 482 B D G < S+ 0 0 98 -3,-1.6 -1,-0.3 2,-0.0 -4,-0.1 0.576 89.6 95.9 -78.0 -10.9 56.1 12.8 28.6 541 483 B R S < S- 0 0 4 -3,-1.0 -8,-0.2 -4,-0.4 -60,-0.0 -0.588 81.3-111.5 -79.9 141.6 53.2 15.2 29.3 542 484 B P - 0 0 21 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.050 29.2-106.9 -62.4 170.2 52.0 17.4 26.5 543 485 B S > - 0 0 21 1,-0.1 4,-2.4 -63,-0.0 5,-0.1 -0.637 24.4-116.5 -92.4 159.2 52.5 21.2 26.2 544 486 B F H > S+ 0 0 0 -2,-0.2 4,-2.7 2,-0.2 -134,-0.3 0.761 117.8 60.5 -67.9 -20.8 49.7 23.6 26.7 545 487 B A H > S+ 0 0 38 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.944 108.8 42.7 -68.5 -44.9 50.2 24.6 23.1 546 488 B E H > S+ 0 0 113 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.908 115.0 50.5 -63.6 -41.8 49.4 21.1 22.1 547 489 B I H X S+ 0 0 2 -4,-2.4 4,-2.5 1,-0.2 5,-0.2 0.916 108.8 50.0 -67.0 -43.5 46.5 20.9 24.6 548 490 B H H X S+ 0 0 35 -4,-2.7 4,-2.8 -142,-0.3 -1,-0.2 0.914 109.5 52.5 -62.6 -42.1 44.9 24.1 23.4 549 491 B Q H X S+ 0 0 139 -4,-1.9 4,-2.0 -5,-0.2 -1,-0.2 0.956 109.4 49.6 -57.7 -49.9 45.1 22.9 19.8 550 492 B A H X S+ 0 0 34 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.941 114.9 42.6 -54.8 -50.6 43.4 19.7 20.7 551 493 B F H X S+ 0 0 2 -4,-2.5 4,-2.8 1,-0.2 -1,-0.2 0.866 108.9 58.4 -67.8 -35.7 40.5 21.4 22.6 552 494 B E H X S+ 0 0 58 -4,-2.8 4,-2.0 -5,-0.2 -1,-0.2 0.896 109.9 44.8 -58.2 -42.2 40.1 24.1 20.0 553 495 B T H X S+ 0 0 68 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.865 113.9 48.7 -69.5 -40.3 39.4 21.3 17.4 554 496 B M H X S+ 0 0 30 -4,-2.0 4,-2.2 -5,-0.2 -2,-0.2 0.856 111.9 50.5 -68.2 -34.4 37.1 19.5 19.8 555 497 B F H X S+ 0 0 37 -4,-2.8 4,-2.8 2,-0.2 -2,-0.2 0.879 109.4 49.3 -73.4 -40.7 35.2 22.7 20.5 556 498 B Q H X S+ 0 0 102 -4,-2.0 4,-2.3 2,-0.2 5,-0.2 0.934 113.5 46.9 -61.3 -46.8 34.7 23.6 16.8 557 499 B E H X S+ 0 0 124 -4,-2.0 4,-1.6 1,-0.2 -2,-0.2 0.933 116.1 45.0 -62.7 -42.6 33.4 20.2 16.1 558 500 B S H X S+ 0 0 29 -4,-2.2 4,-1.5 2,-0.2 -1,-0.2 0.874 111.0 53.5 -70.2 -37.4 31.1 20.3 19.1 559 501 B S H X S+ 0 0 27 -4,-2.8 4,-3.1 2,-0.2 5,-0.3 0.942 106.5 51.9 -59.4 -51.4 29.9 23.8 18.4 560 502 B I H X S+ 0 0 56 -4,-2.3 4,-1.8 1,-0.3 5,-0.2 0.912 110.2 48.5 -53.5 -46.0 28.9 23.0 14.8 561 503 B S H X S+ 0 0 70 -4,-1.6 4,-1.7 -5,-0.2 -1,-0.3 0.864 113.9 48.7 -63.2 -32.2 26.8 20.1 15.9 562 504 B D H X S+ 0 0 51 -4,-1.5 4,-2.9 2,-0.2 5,-0.3 0.900 107.0 52.5 -76.9 -41.1 25.3 22.3 18.5 563 505 B E H X S+ 0 0 84 -4,-3.1 4,-1.8 2,-0.2 -1,-0.2 0.862 110.3 50.1 -62.3 -36.2 24.4 25.2 16.2 564 506 B V H X S+ 0 0 10 -4,-1.8 4,-1.2 -5,-0.3 -1,-0.2 0.922 111.2 49.3 -66.9 -44.2 22.6 22.8 13.9 565 507 B E H < S+ 0 0 105 -4,-1.7 3,-0.4 1,-0.2 -2,-0.2 0.896 112.4 45.8 -61.5 -43.1 20.8 21.4 16.9 566 508 B K H >< S+ 0 0 126 -4,-2.9 3,-1.4 1,-0.2 -1,-0.2 0.856 109.4 58.6 -65.1 -33.1 19.7 24.9 18.1 567 509 B E H 3< S+ 0 0 92 -4,-1.8 -2,-0.2 1,-0.3 -1,-0.2 0.768 89.5 70.6 -71.0 -23.9 18.8 25.6 14.5 568 510 B L T 3< 0 0 58 -4,-1.2 -1,-0.3 -3,-0.4 -2,-0.1 0.382 360.0 360.0 -76.2 6.7 16.3 22.8 14.4 569 511 B G < 0 0 117 -3,-1.4 -2,-0.2 -4,-0.0 -3,-0.1 0.497 360.0 360.0-130.6 360.0 14.1 24.8 16.7