==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 08-AUG-06 2HZ0 . COMPND 2 MOLECULE: PROTO-ONCOGENE TYROSINE-PROTEIN KINASE ABL1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.W.COWAN-JACOB,G.FENDRICH,J.LIEBETANZ,D.FABBRO,P.MANLEY . 504 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25715.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 318 63.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 1.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 65 12.9 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 . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 21 4.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 63 12.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 145 28.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.6 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 3 2 2 0 0 0 0 2 0 0 0 1 1 0 0 0 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 . 2 1 3 3 2 1 1 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 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 1 233 A D 0 0 116 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -37.4 2.1 35.7 61.7 2 234 A K + 0 0 144 2,-0.2 0, 0.0 0, 0.0 0, 0.0 -0.789 360.0 53.8 121.3 -55.8 2.8 34.8 58.0 3 235 A W S S+ 0 0 52 -2,-0.2 69,-1.9 68,-0.1 67,-0.0 0.651 79.2 110.0 -74.0 -25.8 6.4 36.0 58.8 4 236 A E B +a 72 0A 45 67,-0.2 2,-0.2 69,-0.1 69,-0.2 -0.305 36.9 152.5 -58.0 140.9 7.3 33.9 61.8 5 237 A M - 0 0 36 67,-1.2 2,-0.3 66,-0.0 69,-0.1 -0.761 32.9-115.7-148.2-167.4 9.9 31.1 61.3 6 238 A E - 0 0 70 -2,-0.2 3,-0.3 67,-0.1 4,-0.2 -0.998 22.5-103.8-146.1 144.7 12.5 29.3 63.4 7 239 A R S S+ 0 0 65 -2,-0.3 4,-0.1 1,-0.2 22,-0.0 -0.249 100.1 52.1 -66.6 155.8 16.3 29.0 63.7 8 240 A T S S+ 0 0 112 2,-0.8 -1,-0.2 0, 0.0 3,-0.1 0.732 94.7 74.4 82.7 25.8 17.9 25.8 62.5 9 241 A D S S+ 0 0 56 -3,-0.3 2,-0.4 19,-0.1 22,-0.3 0.024 102.7 59.6-127.5 -13.1 16.1 26.3 59.3 10 242 A I S S- 0 0 5 19,-0.3 -2,-0.8 -4,-0.2 2,-0.5 -0.947 70.7-158.8-129.9 121.0 18.9 28.8 59.3 11 243 A T E -B 28 0A 63 17,-2.4 17,-1.9 -2,-0.4 2,-0.6 -0.773 22.4-139.1 -91.7 128.4 22.7 28.4 59.5 12 244 A M E +B 27 0A 61 -2,-0.5 15,-0.2 15,-0.2 2,-0.1 -0.813 27.6 173.6 -92.8 125.7 24.4 31.5 60.7 13 245 A K E - 0 0 91 13,-2.6 14,-0.1 -2,-0.6 -1,-0.0 -0.118 39.7 -35.7-108.8-153.2 27.6 32.4 58.9 14 246 A H E - 0 0 117 1,-0.1 12,-3.4 11,-0.1 -1,-0.3 -0.061 65.8 -85.2 -72.5 169.7 29.9 35.4 59.2 15 247 A K E -B 25 0A 79 10,-0.3 10,-0.3 1,-0.1 -1,-0.1 -0.251 26.3-176.0 -67.1 155.0 29.2 39.1 59.7 16 248 A L E - 0 0 70 8,-2.7 2,-0.3 1,-0.5 9,-0.2 0.511 61.4 -79.1-120.3 -30.6 28.4 41.4 56.9 17 249 A G E -B 24 0A 20 7,-1.5 7,-3.7 133,-0.1 -1,-0.5 -0.986 43.6-159.2 161.0-159.8 28.3 44.5 59.1 18 250 A G E -B 23 0A 35 5,-0.3 133,-0.3 -2,-0.3 5,-0.2 -0.959 14.6-120.8 174.8-166.3 26.1 46.4 61.5 19 251 A G - 0 0 39 3,-1.5 3,-0.1 2,-0.4 134,-0.1 -0.478 62.8 -43.9-137.7-153.3 25.6 49.9 63.1 20 252 A Q S S+ 0 0 98 -2,-0.2 2,-0.3 1,-0.1 131,-0.0 0.937 134.7 3.6 -47.5 -46.3 25.6 51.7 66.5 21 253 A Y S S+ 0 0 78 131,-0.2 131,-2.7 20,-0.0 -2,-0.4 -0.901 113.5 52.9-130.3 161.5 23.5 48.7 67.6 22 254 A G - 0 0 10 -2,-0.3 -3,-1.5 129,-0.2 2,-0.4 0.341 57.3-143.2 88.6 137.6 22.6 45.6 65.6 23 255 A E E -BC 18 40A 53 17,-2.7 17,-2.9 -5,-0.2 2,-0.5 -0.992 7.7-146.6-134.6 141.7 24.8 43.3 63.7 24 256 A V E -BC 17 39A 14 -7,-3.7 -8,-2.7 -2,-0.4 -7,-1.5 -0.948 15.5-171.8-112.8 133.2 23.9 41.6 60.4 25 257 A Y E -BC 15 38A 58 13,-3.1 13,-2.5 -2,-0.5 2,-0.3 -0.865 24.5-120.7-119.1 153.7 25.2 38.1 59.5 26 258 A E E + C 0 37A 38 -12,-3.4 -13,-2.6 -2,-0.3 2,-0.3 -0.677 46.5 158.2 -84.7 147.6 25.1 36.1 56.2 27 259 A G E -BC 12 36A 0 9,-2.3 9,-3.5 -2,-0.3 2,-0.4 -0.947 37.2-112.6-157.9 177.8 23.2 32.8 56.6 28 260 A V E -BC 11 35A 22 -17,-1.9 -17,-2.4 -2,-0.3 2,-1.5 -0.987 6.9-149.8-126.9 129.9 21.3 30.0 54.8 29 261 A W E > > - C 0 34A 45 5,-2.5 3,-1.2 -2,-0.4 5,-0.7 -0.610 28.3-160.5 -90.1 62.6 17.6 29.2 55.2 30 262 A K G > 5S+ 0 0 78 -2,-1.5 3,-1.9 -21,-0.3 -1,-0.2 0.620 75.7 61.5 -11.1 -62.0 18.5 25.5 54.5 31 263 A K G 3 5S+ 0 0 62 -22,-0.3 -1,-0.2 1,-0.3 -21,-0.1 0.883 117.0 27.5 -40.4 -63.9 15.0 24.3 53.4 32 264 A Y G < 5S- 0 0 161 -3,-1.2 -1,-0.3 2,-0.1 -2,-0.2 0.209 108.4-127.7 -89.3 15.2 14.6 26.6 50.4 33 265 A S T < 5 + 0 0 97 -3,-1.9 2,-0.3 -4,-0.4 -3,-0.2 0.425 56.0 151.9 53.9 3.5 18.4 26.5 50.1 34 266 A L E < -C 29 0A 86 -5,-0.7 -5,-2.5 -6,-0.1 -1,-0.2 -0.439 47.0-133.3 -75.1 130.9 18.5 30.3 50.0 35 267 A T E +C 28 0A 45 -2,-0.3 50,-0.7 -7,-0.2 -7,-0.3 -0.484 40.6 174.5 -71.6 142.8 21.5 32.5 51.3 36 268 A V E -CD 27 84A 0 -9,-3.5 -9,-2.3 48,-0.2 2,-0.4 -0.860 33.2-117.5-144.9 174.3 19.9 35.3 53.4 37 269 A A E -CD 26 83A 13 46,-2.1 46,-2.5 -2,-0.3 2,-0.4 -0.978 28.1-168.0-122.3 135.3 21.0 38.2 55.7 38 270 A V E -CD 25 82A 0 -13,-2.5 -13,-3.1 -2,-0.4 2,-0.4 -0.989 8.0-151.9-132.8 123.1 19.9 38.1 59.4 39 271 A K E +CD 24 81A 12 42,-2.4 42,-1.0 -2,-0.4 2,-0.3 -0.808 19.3 178.8 -97.3 136.7 20.1 41.0 61.8 40 272 A T E -C 23 0A 16 -17,-2.9 -17,-2.7 -2,-0.4 2,-0.3 -0.899 20.2-141.1-133.0 161.6 20.6 40.3 65.5 41 273 A L - 0 0 25 38,-0.4 2,-0.1 -2,-0.3 38,-0.0 -0.697 37.4 -92.5-110.2 170.8 21.0 42.4 68.7 42 274 A K > - 0 0 86 -2,-0.3 3,-1.5 1,-0.1 -1,-0.1 -0.295 32.4-100.8 -86.8 168.2 23.3 41.4 71.5 43 275 A E T 3 S+ 0 0 126 1,-0.3 2,-0.1 3,-0.1 -1,-0.1 0.962 123.9 23.4 -45.5 -62.2 22.8 39.4 74.7 44 276 A D T 3 S+ 0 0 158 2,-0.1 2,-0.8 3,-0.0 -1,-0.3 -0.279 84.7 119.9-108.9 51.3 22.5 42.6 76.7 45 277 A T < - 0 0 15 -3,-1.5 2,-2.1 -2,-0.1 3,-0.1 -0.944 51.3-158.9-105.5 96.9 21.4 45.1 74.1 46 278 A M + 0 0 173 -2,-0.8 3,-0.1 1,-0.2 -2,-0.1 -0.470 54.4 116.4 -78.3 64.7 18.1 46.0 75.9 47 279 A E >> + 0 0 30 -2,-2.1 4,-2.3 1,-0.1 3,-0.7 -0.073 23.7 135.8-126.1 38.6 16.5 47.4 72.7 48 280 A V H 3> S+ 0 0 62 1,-0.3 4,-2.7 2,-0.2 5,-0.3 0.906 71.4 48.8 -50.4 -57.7 13.7 45.0 72.2 49 281 A E H 3> S+ 0 0 112 1,-0.2 4,-1.3 2,-0.2 -1,-0.3 0.779 112.5 51.9 -55.9 -32.1 10.9 47.4 71.4 50 282 A E H <> S+ 0 0 7 -3,-0.7 4,-1.8 2,-0.2 -1,-0.2 0.917 110.9 46.2 -70.4 -42.4 13.2 49.1 68.8 51 283 A F H X S+ 0 0 2 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.938 114.4 48.8 -65.2 -44.9 14.0 45.8 67.2 52 284 A L H X S+ 0 0 63 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.767 107.6 53.7 -63.1 -36.6 10.3 44.9 67.1 53 285 A K H X S+ 0 0 21 -4,-1.3 4,-2.1 -5,-0.3 5,-0.3 0.894 108.8 50.1 -67.5 -41.0 9.4 48.2 65.7 54 286 A E H X S+ 0 0 9 -4,-1.8 4,-2.6 2,-0.2 3,-0.3 0.989 113.4 46.2 -61.7 -51.1 12.0 47.6 62.8 55 287 A A H X S+ 0 0 2 -4,-2.6 4,-0.9 1,-0.2 -1,-0.2 0.912 112.1 50.9 -57.6 -42.2 10.5 44.1 62.1 56 288 A A H < S+ 0 0 48 -4,-2.2 4,-0.3 1,-0.2 3,-0.3 0.851 111.9 45.8 -63.9 -43.0 6.9 45.4 62.2 57 289 A V H >< S+ 0 0 14 -4,-2.1 3,-1.9 -3,-0.3 4,-0.3 0.902 105.0 60.9 -68.0 -41.7 7.5 48.2 59.8 58 290 A M H >< S+ 0 0 30 -4,-2.6 3,-0.9 1,-0.3 11,-0.3 0.770 97.5 60.4 -57.2 -23.8 9.4 46.0 57.4 59 291 A K T 3< S+ 0 0 55 -4,-0.9 -1,-0.3 -3,-0.3 -2,-0.2 0.667 100.7 55.6 -77.9 -18.7 6.2 43.8 57.0 60 292 A E T < S+ 0 0 106 -3,-1.9 2,-0.5 -4,-0.3 -1,-0.2 0.436 91.1 92.1 -91.2 -2.0 4.4 46.8 55.7 61 293 A I < + 0 0 43 -3,-0.9 2,-0.4 -4,-0.3 8,-0.3 -0.840 38.3 164.2-104.0 128.8 6.9 47.5 52.8 62 294 A K + 0 0 190 -2,-0.5 5,-0.1 6,-0.1 6,-0.1 -0.858 25.3 127.8-139.3 101.0 6.6 46.1 49.3 63 295 A H > - 0 0 34 -2,-0.4 3,-1.3 3,-0.3 55,-0.1 -0.988 60.2-122.8-154.2 143.6 8.8 47.9 46.7 64 296 A P T 3 S+ 0 0 89 0, 0.0 4,-0.1 0, 0.0 -1,-0.1 0.775 111.6 41.4 -61.6 -26.0 11.3 46.7 44.1 65 297 A N T 3 S+ 0 0 15 49,-0.1 82,-2.5 81,-0.1 2,-0.4 0.003 94.7 85.7-115.8 35.1 14.1 48.8 45.5 66 298 A L B < S-f 147 0B 13 -3,-1.3 -3,-0.3 80,-0.3 82,-0.2 -0.996 95.0 -97.9-128.1 123.4 13.6 48.4 49.3 67 299 A V - 0 0 29 80,-2.4 2,-0.6 -2,-0.4 -2,-0.1 -0.134 45.8-106.5 -47.1 143.0 15.3 45.3 50.6 68 300 A Q - 0 0 107 -4,-0.1 16,-1.8 -6,-0.1 2,-0.3 -0.644 19.3-141.8 -87.2 121.1 13.0 42.3 50.9 69 301 A L E + E 0 83A 15 -2,-0.6 14,-0.3 -11,-0.3 3,-0.1 -0.572 22.0 173.1 -75.0 130.8 11.8 40.9 54.1 70 302 A L E - 0 0 31 12,-2.9 2,-0.3 1,-0.4 13,-0.2 0.754 58.2 -43.6-105.6 -38.1 11.6 37.2 54.1 71 303 A G E - E 0 82A 0 11,-1.8 11,-2.7 -66,-0.0 -1,-0.4 -0.967 45.4-130.9-173.0-173.5 10.8 36.5 57.8 72 304 A V E -aE 4 81A 0 -69,-1.9 -67,-1.2 -2,-0.3 2,-0.6 -0.979 10.2-144.5-157.3 147.5 11.3 37.2 61.5 73 305 A C E + E 0 80A 14 7,-2.2 7,-1.2 -2,-0.3 -69,-0.1 -0.850 47.9 138.3-115.5 85.6 12.0 35.2 64.7 74 306 A T + 0 0 30 -2,-0.6 -1,-0.1 5,-0.2 5,-0.1 0.244 43.2 83.2-118.6 12.8 10.1 37.4 67.2 75 307 A R S S- 0 0 142 1,-0.3 -1,-0.1 -3,-0.1 4,-0.1 0.775 109.3 -2.9 -85.9 -21.9 8.3 35.0 69.5 76 308 A E S S- 0 0 83 2,-0.2 -1,-0.3 0, 0.0 0, 0.0 -0.983 95.2 -42.4-163.5 156.8 11.4 34.5 71.7 77 309 A P S S+ 0 0 95 0, 0.0 2,-0.2 0, 0.0 -3,-0.1 -0.315 103.6 48.7 -72.2 154.1 15.1 35.5 71.8 78 310 A P S S- 0 0 86 0, 0.0 2,-0.3 0, 0.0 -2,-0.2 0.586 84.3-152.3 -73.7 146.1 17.4 35.9 70.1 79 311 A F - 0 0 39 -2,-0.2 -38,-0.4 -5,-0.1 2,-0.3 -0.629 13.3-166.2 -85.4 143.8 15.1 37.8 67.8 80 312 A Y E - E 0 73A 26 -7,-1.2 -7,-2.2 -2,-0.3 2,-0.4 -0.966 17.9-159.7-127.9 152.7 16.0 37.8 64.1 81 313 A I E -DE 39 72A 2 -42,-1.0 -42,-2.4 -2,-0.3 2,-0.5 -0.996 20.8-159.8-128.8 124.5 14.9 39.8 61.1 82 314 A I E +DE 38 71A 0 -11,-2.7 -12,-2.9 -2,-0.4 -11,-1.8 -0.954 16.6 165.8-115.8 129.2 15.6 38.0 57.9 83 315 A T E -DE 37 69A 23 -46,-2.5 -46,-2.1 -2,-0.5 -14,-0.2 -0.776 44.9 -76.0-129.4 174.7 15.9 39.6 54.5 84 316 A E E -D 36 0A 30 -16,-1.8 2,-0.4 -2,-0.2 -48,-0.2 -0.372 48.1-115.2 -69.5 156.2 17.2 38.6 51.0 85 317 A F - 0 0 58 -50,-0.7 2,-0.8 -49,-0.1 -1,-0.1 -0.764 23.1-140.1 -92.3 131.6 21.0 38.5 50.6 86 318 A M > - 0 0 18 -2,-0.4 3,-2.2 1,-0.1 53,-0.3 -0.889 9.9-144.1-102.7 104.3 22.2 41.2 48.0 87 319 A T T 3 S+ 0 0 78 -2,-0.8 53,-0.2 1,-0.3 -1,-0.1 0.691 92.2 45.4 -42.7 -36.0 24.9 39.6 46.0 88 320 A Y T 3 S- 0 0 123 51,-2.5 -1,-0.3 1,-0.2 52,-0.2 0.496 97.7-140.4 -94.3 1.8 27.1 42.6 45.5 89 321 A G E < -G 139 0B 30 -3,-2.2 50,-2.7 50,-0.5 -1,-0.2 -0.384 54.4 -0.9 80.3-158.1 27.1 44.0 49.1 90 322 A N E > -G 138 0B 30 48,-0.2 4,-2.2 1,-0.1 48,-0.3 -0.403 60.1-129.4 -75.6 144.2 26.9 47.6 50.0 91 323 A L H > S+ 0 0 0 46,-2.4 4,-2.6 43,-0.6 5,-0.2 0.799 103.0 60.4 -58.7 -36.6 26.7 50.4 47.5 92 324 A L H > S+ 0 0 21 42,-1.0 4,-1.6 45,-0.4 -1,-0.2 0.941 111.3 36.9 -64.3 -46.4 29.5 52.4 49.0 93 325 A D H > S+ 0 0 64 -3,-0.3 4,-1.3 2,-0.2 -1,-0.2 0.873 114.2 59.3 -71.3 -34.4 32.2 49.7 48.6 94 326 A Y H >X S+ 0 0 34 -4,-2.2 4,-1.0 1,-0.2 3,-0.6 0.952 109.6 43.0 -56.4 -47.1 30.6 48.7 45.3 95 327 A L H 3< S+ 0 0 0 -4,-2.6 3,-0.3 1,-0.2 -1,-0.2 0.862 112.6 52.7 -64.9 -42.3 31.2 52.2 44.0 96 328 A R H 3< S+ 0 0 117 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.629 121.2 31.2 -70.1 -17.4 34.8 52.4 45.5 97 329 A E H << S+ 0 0 151 -4,-1.3 -1,-0.2 -3,-0.6 -2,-0.2 0.389 95.6 116.4-120.2 -0.8 35.9 49.2 43.9 98 330 A C S < S- 0 0 25 -4,-1.0 2,-1.0 -3,-0.3 -3,-0.1 -0.228 72.9-106.2 -74.8 163.8 33.9 49.1 40.6 99 331 A N >> - 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0 0 26 -2,-0.3 4,-1.9 1,-0.1 3,-0.7 -0.936 64.0 -84.5-157.0 177.8 4.0 110.9 63.0 430 418 B I H 3> S+ 0 0 22 -2,-0.3 4,-2.3 1,-0.2 5,-0.1 0.869 126.7 58.9 -62.5 -32.7 3.8 112.1 59.4 431 419 B K H 3> S+ 0 0 47 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.798 104.0 49.6 -67.7 -27.1 5.3 115.4 60.7 432 420 B S H <> S+ 0 0 5 -3,-0.7 4,-2.2 2,-0.2 -1,-0.2 0.825 107.1 54.1 -81.4 -28.8 8.3 113.5 62.0 433 421 B D H X S+ 0 0 3 -4,-1.9 4,-2.6 1,-0.2 -2,-0.2 0.925 106.9 55.1 -66.5 -35.4 8.6 111.8 58.4 434 422 B V H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.927 106.2 47.6 -58.3 -49.4 8.5 115.5 57.2 435 423 B W H X S+ 0 0 0 -4,-1.6 4,-1.3 2,-0.2 -1,-0.2 0.939 112.6 50.1 -56.8 -50.5 11.6 116.5 59.5 436 424 B A H X S+ 0 0 7 -4,-2.2 4,-2.8 1,-0.2 3,-0.3 0.912 106.2 55.8 -57.9 -37.8 13.4 113.3 58.1 437 425 B F H X S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.3 -1,-0.2 0.897 103.1 56.4 -57.9 -43.5 12.5 114.5 54.5 438 426 B G H X S+ 0 0 0 -4,-2.1 4,-1.0 2,-0.2 -1,-0.3 0.893 109.4 44.3 -59.6 -34.2 14.3 117.7 55.3 439 427 B V H X S+ 0 0 0 -4,-1.3 4,-2.4 -3,-0.3 3,-0.3 0.901 110.7 54.4 -78.6 -38.5 17.4 115.7 56.2 440 428 B L H X S+ 0 0 0 -4,-2.8 4,-1.8 1,-0.2 -2,-0.2 0.930 104.9 55.6 -58.8 -36.5 17.0 113.6 53.1 441 429 B L H X S+ 0 0 5 -4,-2.8 4,-2.0 1,-0.2 -1,-0.2 0.846 106.5 49.8 -62.5 -38.2 16.9 116.8 51.1 442 430 B W H X S+ 0 0 16 -4,-1.0 4,-1.4 -3,-0.3 7,-0.3 0.875 107.5 53.7 -70.2 -36.7 20.2 117.7 52.6 443 431 B E H <>S+ 0 0 1 -4,-2.4 5,-4.1 1,-0.2 6,-0.4 0.851 109.7 47.5 -64.0 -40.1 21.7 114.4 51.7 444 432 B I H ><5S+ 0 0 5 -4,-1.8 3,-1.7 3,-0.2 -2,-0.2 0.929 110.2 53.5 -67.7 -44.6 20.6 114.8 48.1 445 433 B A H 3<5S+ 0 0 18 -4,-2.0 -2,-0.2 1,-0.3 -1,-0.2 0.717 113.3 41.4 -64.0 -25.2 22.0 118.3 48.0 446 434 B T T 3<5S- 0 0 21 -4,-1.4 -1,-0.3 3,-0.1 -2,-0.2 0.226 115.2-111.8-103.2 11.0 25.4 117.2 49.2 447 435 B Y T < 5S- 0 0 47 -3,-1.7 -3,-0.2 1,-0.2 -2,-0.1 0.899 83.3 -38.0 53.5 49.8 25.5 114.1 47.0 448 436 B G S S- 0 0 3 1,-0.1 3,-1.8 2,-0.1 8,-0.0 0.935 87.4-151.9 49.1 50.8 25.8 117.0 61.2 453 441 B P T 3 S+ 0 0 84 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.294 73.4 8.2 -56.7 134.2 29.4 116.3 60.2 454 442 B G T 3 S+ 0 0 91 1,-0.2 2,-0.4 0, 0.0 -2,-0.1 0.224 99.9 121.0 79.4 -16.7 31.7 116.5 63.3 455 443 B I < - 0 0 39 -3,-1.8 2,-0.3 -4,-0.1 -1,-0.2 -0.638 65.1-125.1 -83.7 131.7 28.8 116.7 65.7 456 444 B D > - 0 0 70 -2,-0.4 3,-2.4 1,-0.1 4,-0.4 -0.582 15.3-127.3 -79.0 134.1 28.6 114.0 68.3 457 445 B L G > S+ 0 0 89 -2,-0.3 3,-0.9 1,-0.3 4,-0.4 0.738 105.5 64.1 -45.5 -35.9 25.3 112.2 68.4 458 446 B S G 3 S+ 0 0 95 1,-0.2 4,-0.3 2,-0.1 -1,-0.3 0.762 104.7 46.5 -66.0 -21.9 24.9 112.7 72.1 459 447 B Q G <> S+ 0 0 96 -3,-2.4 4,-1.9 1,-0.1 -1,-0.2 0.463 83.6 93.0-101.3 -2.7 24.7 116.5 71.6 460 448 B V H <> S+ 0 0 2 -3,-0.9 4,-2.8 -4,-0.4 5,-0.2 0.951 85.3 48.9 -58.2 -51.6 22.2 116.7 68.7 461 449 B Y H > S+ 0 0 73 -4,-0.4 4,-3.2 1,-0.2 5,-0.3 0.952 110.1 51.7 -54.0 -48.3 19.0 117.1 70.7 462 450 B E H > S+ 0 0 96 -4,-0.3 4,-0.9 1,-0.2 -1,-0.2 0.887 112.6 45.5 -57.4 -43.2 20.5 119.9 72.9 463 451 B L H <>S+ 0 0 46 -4,-1.9 5,-2.4 2,-0.2 3,-0.5 0.936 112.8 48.9 -67.8 -47.2 21.6 121.8 69.8 464 452 B L H ><5S+ 0 0 2 -4,-2.8 3,-4.0 1,-0.2 -2,-0.2 0.991 108.2 55.8 -54.6 -50.9 18.3 121.4 67.9 465 453 B E H 3<5S+ 0 0 105 -4,-3.2 -1,-0.2 1,-0.3 -2,-0.2 0.797 106.6 51.0 -52.9 -26.8 16.4 122.5 71.1 466 454 B K T 3<5S- 0 0 136 -4,-0.9 -1,-0.3 -3,-0.5 -2,-0.2 0.285 127.0-101.8 -96.4 14.2 18.5 125.7 71.0 467 455 B D T < 5 + 0 0 112 -3,-4.0 2,-0.3 1,-0.3 -3,-0.2 0.661 69.4 150.9 79.7 16.7 17.6 126.3 67.3 468 456 B Y < + 0 0 86 -5,-2.4 2,-0.3 -6,-0.1 -1,-0.3 -0.653 16.6 170.8 -79.2 139.3 20.8 125.0 65.8 469 457 B R - 0 0 22 -2,-0.3 16,-0.0 0, 0.0 -5,-0.0 -0.986 41.7 -85.7-144.8 151.3 20.2 123.6 62.2 470 458 B M - 0 0 2 -2,-0.3 2,-0.1 1,-0.1 15,-0.0 -0.182 51.1-115.0 -52.6 143.1 22.5 122.4 59.4 471 459 B E - 0 0 147 1,-0.1 -1,-0.1 0, 0.0 0, 0.0 -0.401 42.4 -76.4 -81.4 160.4 23.6 125.3 57.2 472 460 B R - 0 0 115 -2,-0.1 -1,-0.1 1,-0.1 3,-0.1 -0.365 53.2-122.8 -56.3 122.6 22.7 125.5 53.5 473 461 B P > - 0 0 12 0, 0.0 3,-1.9 0, 0.0 -1,-0.1 -0.345 38.5 -82.7 -67.8 156.4 24.9 123.1 51.5 474 462 B E T 3 S+ 0 0 164 1,-0.3 0, 0.0 -28,-0.0 0, 0.0 -0.270 115.7 9.7 -56.9 127.4 27.0 124.5 48.7 475 463 B G T 3 S+ 0 0 74 1,-0.3 -1,-0.3 -3,-0.1 -29,-0.1 0.222 90.9 134.8 86.4 -16.9 25.0 124.9 45.5 476 464 B C < - 0 0 4 -3,-1.9 -1,-0.3 1,-0.1 2,-0.1 -0.498 61.5-115.6 -67.3 131.9 21.7 124.2 47.2 477 465 B P >> - 0 0 76 0, 0.0 4,-2.1 0, 0.0 3,-0.8 -0.390 17.8-117.1 -71.4 149.3 19.2 126.8 46.0 478 466 B E H 3> S+ 0 0 133 1,-0.3 4,-2.5 2,-0.2 5,-0.2 0.864 112.9 50.3 -55.0 -43.3 17.8 129.3 48.5 479 467 B K H 3> S+ 0 0 144 1,-0.2 4,-1.5 2,-0.2 -1,-0.3 0.770 109.0 51.7 -68.5 -27.0 14.2 128.2 48.1 480 468 B V H <> S+ 0 0 31 -3,-0.8 4,-2.1 2,-0.2 -1,-0.2 0.886 111.2 47.3 -76.5 -34.6 15.2 124.6 48.6 481 469 B Y H X S+ 0 0 35 -4,-2.1 4,-3.0 2,-0.2 5,-0.2 0.942 109.5 54.3 -70.3 -44.9 17.1 125.5 51.9 482 470 B E H X S+ 0 0 134 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.917 110.2 46.2 -52.4 -45.7 14.1 127.5 53.0 483 471 B L H X S+ 0 0 22 -4,-1.5 4,-1.6 2,-0.2 -1,-0.2 0.878 109.7 54.4 -68.7 -36.9 11.9 124.5 52.5 484 472 B M H X S+ 0 0 0 -4,-2.1 4,-0.6 1,-0.2 -2,-0.2 0.944 109.8 47.9 -57.7 -47.1 14.5 122.3 54.3 485 473 B R H >< S+ 0 0 102 -4,-3.0 3,-0.7 1,-0.2 -2,-0.2 0.848 106.3 56.7 -64.5 -34.1 14.3 124.8 57.3 486 474 B A H >< S+ 0 0 31 -4,-1.9 3,-1.2 1,-0.3 -1,-0.2 0.891 104.6 53.5 -66.4 -35.7 10.5 124.7 57.3 487 475 B C H 3< S+ 0 0 0 -4,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.694 105.4 55.3 -68.6 -22.0 10.7 120.9 57.7 488 476 B W T << S+ 0 0 2 -3,-0.7 -1,-0.3 -4,-0.6 2,-0.2 -0.022 74.4 141.6-102.4 28.1 13.0 121.4 60.7 489 477 B Q < - 0 0 86 -3,-1.2 6,-0.1 1,-0.1 5,-0.1 -0.477 58.0-126.9 -66.2 138.9 10.5 123.6 62.6 490 478 B W S S+ 0 0 74 -2,-0.2 -69,-0.2 4,-0.1 -1,-0.1 0.951 94.3 60.3 -54.0 -56.9 10.6 122.7 66.2 491 479 B N S > S- 0 0 79 1,-0.1 3,-1.7 -71,-0.1 4,-0.3 -0.677 81.9-138.0 -79.3 130.4 6.8 122.1 66.7 492 480 B P G > S+ 0 0 39 0, 0.0 3,-1.0 0, 0.0 -1,-0.1 0.761 101.3 57.0 -53.0 -33.4 5.5 119.3 64.4 493 481 B S G 3 S+ 0 0 97 1,-0.2 -3,-0.1 -3,-0.0 -2,-0.0 0.695 98.9 60.3 -77.0 -17.9 2.4 121.3 63.4 494 482 B D G < S+ 0 0 88 -3,-1.7 -1,-0.2 -5,-0.1 -4,-0.1 0.462 86.8 94.4 -84.4 -4.8 4.5 124.2 62.2 495 483 B R S < S- 0 0 5 -3,-1.0 -8,-0.2 -4,-0.3 -9,-0.1 -0.668 86.2-103.2 -83.8 147.4 6.1 122.0 59.6 496 484 B P - 0 0 21 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.182 33.8-114.4 -62.8 158.0 4.6 121.9 56.0 497 485 B S > - 0 0 24 1,-0.1 4,-1.5 -4,-0.0 5,-0.1 -0.528 26.7-112.3 -81.8 168.6 2.5 118.9 55.0 498 486 B F H > S+ 0 0 0 2,-0.2 4,-3.3 1,-0.2 5,-0.3 0.812 118.6 63.7 -69.9 -28.3 4.0 116.7 52.2 499 487 B A H > S+ 0 0 37 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.960 108.4 41.2 -59.1 -49.7 1.0 117.9 50.0 500 488 B E H > S+ 0 0 119 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.802 114.1 51.2 -67.6 -37.6 2.6 121.4 50.3 501 489 B I H X S+ 0 0 1 -4,-1.5 4,-2.2 2,-0.2 -2,-0.2 0.941 111.8 47.2 -66.3 -49.3 6.1 120.2 49.9 502 490 B H H X S+ 0 0 17 -4,-3.3 4,-2.9 -125,-0.3 5,-0.4 0.940 111.3 51.5 -56.8 -47.2 5.3 118.3 46.7 503 491 B Q H X S+ 0 0 61 -4,-2.3 4,-2.1 -5,-0.3 -1,-0.2 0.913 107.7 52.4 -55.3 -45.9 3.4 121.3 45.4 504 492 B A H < S+ 0 0 45 -4,-1.9 -1,-0.2 2,-0.2 -2,-0.2 0.890 116.0 41.0 -59.7 -39.6 6.5 123.5 46.0 505 493 B F H >< S+ 0 0 12 -4,-2.2 3,-3.1 2,-0.2 -2,-0.2 0.988 115.4 47.5 -70.8 -58.1 8.7 121.1 44.1 506 494 B E H 3< S+ 0 0 123 -4,-2.9 -2,-0.2 1,-0.3 -3,-0.2 0.815 115.3 47.0 -48.6 -42.1 6.3 120.3 41.2 507 495 B T T 3< 0 0 107 -4,-2.1 -1,-0.3 -5,-0.4 -2,-0.2 0.393 360.0 360.0 -78.8 -4.7 5.7 124.0 40.8 508 496 B M < 0 0 172 -3,-3.1 -3,-0.2 -5,-0.1 -2,-0.1 0.599 360.0 360.0 38.3 360.0 9.4 124.5 41.0