==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 05-JAN-07 2OG8 . COMPND 2 MOLECULE: PROTO-ONCOGENE TYROSINE-PROTEIN KINASE LCK; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR X.HUANG . 495 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24104.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 320 64.6 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 . 75 15.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.8 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 . 1 0.2 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 . 23 4.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 61 12.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 141 28.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.2 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 3 2 1 1 1 3 2 0 0 1 0 0 2 0 0 0 2 0 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 0 2 2 2 0 1 3 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 1 237 A E 0 0 191 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -1.4 -10.6 20.3 49.5 2 238 A W + 0 0 29 67,-0.1 68,-2.1 2,-0.0 2,-0.1 0.635 360.0 104.6 -94.7 -16.8 -7.9 21.2 52.1 3 239 A E B +a 70 0A 95 66,-0.2 68,-0.2 68,-0.1 0, 0.0 -0.396 45.3 178.7 -69.8 139.2 -10.0 20.5 55.2 4 240 A V - 0 0 6 66,-1.5 68,-0.1 -2,-0.1 5,-0.0 -0.989 36.9 -95.8-140.8 146.4 -9.2 17.4 57.2 5 241 A P > - 0 0 76 0, 0.0 3,-2.0 0, 0.0 4,-0.1 -0.367 30.6-127.9 -60.9 138.8 -10.7 15.9 60.4 6 242 A R G > S+ 0 0 43 1,-0.3 3,-2.0 2,-0.2 65,-0.0 0.809 105.5 72.6 -58.7 -28.0 -8.6 16.9 63.4 7 243 A E G 3 S+ 0 0 154 1,-0.3 -1,-0.3 21,-0.0 22,-0.1 0.656 81.4 70.8 -61.8 -17.5 -8.6 13.2 64.3 8 244 A T G < S+ 0 0 22 -3,-2.0 21,-3.1 20,-0.1 22,-0.3 0.520 92.8 77.5 -77.6 -3.5 -6.2 12.5 61.4 9 245 A L E < -B 28 0A 27 -3,-2.0 2,-0.4 19,-0.2 19,-0.2 -0.835 50.5-176.8-118.2 149.9 -3.5 14.3 63.4 10 246 A K E -B 27 0A 148 17,-1.3 17,-1.5 -2,-0.3 2,-0.5 -0.965 20.6-144.7-138.9 115.9 -1.2 13.6 66.3 11 247 A L E +B 26 0A 53 -2,-0.4 15,-0.3 15,-0.2 3,-0.1 -0.732 23.7 171.7 -84.3 125.7 1.2 16.3 67.5 12 248 A V E + 0 0 72 13,-2.6 2,-0.4 -2,-0.5 14,-0.2 0.843 59.4 12.3-102.0 -46.0 4.5 14.7 68.6 13 249 A E E -B 25 0A 101 12,-1.8 12,-3.4 0, 0.0 2,-0.8 -0.996 65.0-130.0-140.9 132.8 6.9 17.5 69.4 14 250 A R E -B 24 0A 123 -2,-0.4 10,-0.3 10,-0.2 3,-0.1 -0.737 20.1-174.0 -85.3 115.4 6.5 21.3 69.8 15 251 A L E - 0 0 81 8,-1.7 2,-0.3 -2,-0.8 9,-0.2 0.833 64.1 -16.1 -74.9 -36.7 9.1 23.0 67.6 16 252 A G E -B 23 0A 30 7,-1.6 7,-2.2 2,-0.0 2,-0.3 -0.972 54.5-152.7-161.2 171.6 8.3 26.5 68.8 17 253 A A E +B 22 0A 67 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.986 23.3 143.4-154.4 145.6 5.9 28.8 70.7 18 254 A G E > -B 21 0A 52 3,-2.1 3,-1.3 -2,-0.3 -2,-0.0 -0.893 57.8 -53.0-162.6-170.1 5.0 32.5 70.6 19 255 A Q T 3 S+ 0 0 154 -2,-0.3 3,-0.1 1,-0.2 -1,-0.0 0.850 125.9 34.9 -45.9 -52.0 2.4 35.3 70.9 20 256 A F T 3 S- 0 0 98 1,-0.1 20,-1.6 19,-0.1 2,-0.3 0.285 123.6 -64.9 -95.7 12.7 -0.0 34.0 68.2 21 257 A G E < -BC 18 39A 13 -3,-1.3 -3,-2.1 18,-0.3 2,-0.3 -0.965 57.8 -65.3 144.3-161.7 0.2 30.2 68.7 22 258 A E E -BC 17 38A 64 16,-2.1 16,-3.1 -2,-0.3 2,-0.5 -0.901 20.9-139.8-134.5 162.3 2.4 27.2 68.4 23 259 A V E -BC 16 37A 52 -7,-2.2 -8,-1.7 -2,-0.3 -7,-1.6 -0.976 26.6-179.4-121.3 126.7 4.4 25.1 65.9 24 260 A W E -BC 14 36A 55 12,-2.9 12,-3.0 -2,-0.5 2,-0.4 -0.924 28.1-133.7-129.5 154.5 4.5 21.3 66.2 25 261 A M E +BC 13 35A 14 -12,-3.4 -13,-2.6 -2,-0.3 -12,-1.8 -0.844 49.2 141.3 -96.8 137.9 6.0 18.3 64.4 26 262 A G E -BC 11 34A 0 8,-3.4 8,-2.2 -2,-0.4 2,-0.3 -0.768 44.1 -99.0-153.7-159.2 3.4 15.6 63.9 27 263 A Y E -BC 10 33A 82 -17,-1.5 -17,-1.3 6,-0.3 2,-0.6 -0.999 15.5-144.3-141.8 140.0 1.9 12.9 61.7 28 264 A Y E >> S-BC 9 32A 19 4,-2.6 4,-1.4 -2,-0.3 3,-1.2 -0.925 88.7 -17.0-108.0 114.5 -1.1 12.8 59.4 29 265 A N T 34 S- 0 0 70 -21,-3.1 -1,-0.2 -2,-0.6 -20,-0.1 0.837 112.8 -78.6 60.4 34.4 -2.9 9.4 59.5 30 266 A G T 34 S+ 0 0 42 -22,-0.3 -1,-0.3 1,-0.2 431,-0.2 0.445 126.8 72.7 58.2 2.5 0.2 7.8 61.0 31 267 A H T <4 S+ 0 0 44 -3,-1.2 2,-0.5 1,-0.2 -2,-0.2 0.669 84.1 60.2-118.6 -22.7 2.1 7.7 57.7 32 268 A T E < -C 28 0A 16 -4,-1.4 -4,-2.6 315,-0.1 2,-0.2 -0.929 69.2-139.5-116.4 125.7 3.1 11.3 56.9 33 269 A K E +C 27 0A 59 -2,-0.5 49,-0.8 -6,-0.2 2,-0.3 -0.540 33.9 172.9 -75.0 139.7 5.3 13.5 59.0 34 270 A V E -CD 26 81A 0 -8,-2.2 -8,-3.4 47,-0.2 2,-0.4 -0.979 33.8-127.9-148.5 160.4 4.1 17.1 59.1 35 271 A A E -CD 25 80A 17 45,-1.8 45,-2.4 -2,-0.3 2,-0.4 -0.842 29.0-158.3-104.7 143.9 4.7 20.5 60.7 36 272 A V E -CD 24 79A 1 -12,-3.0 -12,-2.9 -2,-0.4 2,-0.6 -0.988 13.3-160.5-132.5 131.4 1.6 22.2 62.2 37 273 A K E -CD 23 78A 44 41,-2.8 41,-1.8 -2,-0.4 2,-0.4 -0.946 18.8-169.1-107.6 115.3 1.0 25.8 62.9 38 274 A S E -CD 22 77A 16 -16,-3.1 -16,-2.1 -2,-0.6 2,-0.3 -0.907 17.8-129.0-110.1 138.3 -1.8 26.1 65.5 39 275 A L E -C 21 0A 3 37,-2.5 2,-0.8 -2,-0.4 -18,-0.3 -0.636 18.7-127.7 -82.9 130.4 -3.5 29.4 66.4 40 276 A K - 0 0 84 -20,-1.6 3,-0.4 -2,-0.3 4,-0.3 -0.729 45.2-101.0 -82.0 118.6 -3.8 30.3 70.1 41 277 A Q S S+ 0 0 101 -2,-0.8 -1,-0.1 1,-0.2 4,-0.1 0.114 98.8 9.0 -43.6 141.8 -7.5 31.0 70.5 42 278 A G S S+ 0 0 76 2,-0.2 -1,-0.2 1,-0.1 3,-0.1 0.906 97.4 109.4 52.7 46.0 -8.7 34.6 70.6 43 279 A S S S- 0 0 28 1,-0.6 2,-0.3 -3,-0.4 -2,-0.1 0.570 92.9 -14.5-117.9 -30.8 -5.2 35.8 69.6 44 280 A M S S- 0 0 59 -4,-0.3 -1,-0.6 -24,-0.1 -2,-0.2 -0.913 91.4 -76.5-168.9 149.1 -6.1 36.9 66.1 45 281 A S > - 0 0 58 -2,-0.3 4,-2.0 1,-0.1 5,-0.2 -0.109 34.1-123.8 -53.8 151.4 -9.2 36.3 64.0 46 282 A P H > S+ 0 0 46 0, 0.0 4,-2.6 0, 0.0 5,-0.1 0.849 115.1 57.7 -61.8 -35.4 -9.5 32.8 62.2 47 283 A D H > S+ 0 0 128 2,-0.2 4,-1.2 1,-0.2 3,-0.1 0.982 106.9 43.3 -58.4 -60.1 -9.7 34.9 59.1 48 284 A A H 4 S+ 0 0 55 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.836 115.8 49.8 -57.6 -34.6 -6.4 36.7 59.5 49 285 A F H >< S+ 0 0 8 -4,-2.0 3,-1.1 1,-0.2 4,-0.5 0.900 110.1 49.5 -72.1 -40.3 -4.7 33.4 60.6 50 286 A L H 3X S+ 0 0 30 -4,-2.6 4,-2.4 1,-0.2 5,-0.2 0.637 88.4 82.3 -74.8 -14.5 -6.0 31.5 57.6 51 287 A A H 3X S+ 0 0 55 -4,-1.2 4,-1.4 1,-0.2 -1,-0.2 0.818 88.9 57.3 -57.2 -30.2 -4.9 34.2 55.2 52 288 A E H <> S+ 0 0 63 -3,-1.1 4,-1.5 -4,-0.4 -1,-0.2 0.926 106.9 47.2 -65.5 -45.0 -1.5 32.4 55.5 53 289 A A H > S+ 0 0 1 -4,-0.5 4,-1.8 1,-0.2 -2,-0.2 0.910 108.6 53.2 -63.4 -44.8 -3.1 29.2 54.3 54 290 A N H X S+ 0 0 70 -4,-2.4 4,-1.2 1,-0.2 -1,-0.2 0.824 108.1 52.5 -61.9 -29.6 -4.9 30.9 51.4 55 291 A L H X S+ 0 0 45 -4,-1.4 4,-2.5 -5,-0.2 -1,-0.2 0.858 108.1 50.0 -73.2 -36.5 -1.6 32.3 50.3 56 292 A M H < S+ 0 0 32 -4,-1.5 11,-0.4 2,-0.2 -2,-0.2 0.787 105.1 56.9 -73.0 -27.2 0.0 28.9 50.3 57 293 A K H < S+ 0 0 71 -4,-1.8 3,-0.2 1,-0.2 -1,-0.2 0.905 112.8 43.8 -66.7 -38.3 -2.9 27.5 48.2 58 294 A Q H < S+ 0 0 120 -4,-1.2 2,-1.3 1,-0.2 -2,-0.2 0.905 109.8 55.3 -69.7 -50.0 -2.0 30.1 45.7 59 295 A L < + 0 0 17 -4,-2.5 2,-0.6 -5,-0.1 -1,-0.2 -0.589 66.3 155.4 -92.4 74.5 1.8 29.8 45.7 60 296 A Q + 0 0 103 -2,-1.3 2,-0.3 -3,-0.2 6,-0.1 -0.902 15.9 140.3-100.9 125.2 2.4 26.1 45.0 61 297 A H > - 0 0 54 -2,-0.6 3,-2.0 3,-0.4 54,-0.0 -0.974 62.6-109.8-160.8 151.7 5.9 25.5 43.5 62 298 A Q T 3 S+ 0 0 64 -2,-0.3 4,-0.1 1,-0.3 53,-0.1 0.774 118.1 50.3 -54.7 -30.5 8.7 22.9 43.7 63 299 A R T 3 S+ 0 0 52 80,-0.1 81,-3.4 51,-0.1 2,-0.4 0.189 99.7 77.4 -95.8 14.3 10.9 25.5 45.6 64 300 A L B < S-f 144 0B 12 -3,-2.0 -3,-0.4 79,-0.3 81,-0.2 -0.982 90.1-105.6-127.4 136.9 8.3 26.5 48.2 65 301 A V - 0 0 20 79,-2.6 2,-0.3 -2,-0.4 -2,-0.1 -0.344 48.9-132.2 -55.3 131.9 7.3 24.7 51.3 66 302 A R - 0 0 57 -4,-0.1 15,-1.5 -6,-0.1 2,-0.2 -0.725 2.0-121.6-100.8 145.6 3.8 23.3 50.4 67 303 A L E - E 0 80A 2 -11,-0.4 13,-0.3 -2,-0.3 3,-0.1 -0.510 24.6-178.6 -74.0 143.9 0.6 23.4 52.3 68 304 A Y E - 0 0 11 11,-3.0 2,-0.3 1,-0.4 12,-0.2 0.721 56.3 -32.3-112.2 -44.2 -0.9 19.9 53.0 69 305 A A E - E 0 79A 4 10,-1.8 10,-1.9 2,-0.0 -1,-0.4 -0.942 47.7-134.4-163.4-176.2 -4.2 20.6 54.8 70 306 A V E -aE 3 78A 8 -68,-2.1 -66,-1.5 -2,-0.3 2,-0.5 -0.988 4.2-153.0-153.1 150.1 -6.1 22.8 57.1 71 307 A V E - E 0 77A 1 6,-1.8 6,-2.0 -2,-0.3 -68,-0.1 -0.956 13.4-172.4-127.8 107.9 -8.5 22.4 60.1 72 308 A T + 0 0 71 -2,-0.5 2,-0.5 4,-0.2 4,-0.2 0.198 56.6 87.0 -90.6 13.5 -10.8 25.4 60.3 73 309 A Q S S- 0 0 115 2,-0.3 4,-0.1 4,-0.0 -67,-0.0 -0.966 95.0 -64.1-113.5 127.8 -12.6 24.8 63.6 74 310 A E S S+ 0 0 107 -2,-0.5 -2,-0.1 1,-0.1 2,-0.1 -0.193 126.6 55.7 -50.8 134.5 -10.8 26.2 66.7 75 311 A P S S- 0 0 42 0, 0.0 2,-0.3 0, 0.0 -2,-0.3 0.356 97.7-151.7 -69.4 123.6 -8.1 25.3 67.6 76 312 A I - 0 0 2 -37,-0.2 -37,-2.5 -4,-0.2 2,-0.3 -0.534 13.7-165.0 -74.9 130.0 -7.3 26.3 64.0 77 313 A Y E -DE 38 71A 28 -6,-2.0 -6,-1.8 -2,-0.3 2,-0.4 -0.851 20.1-162.0-117.9 154.3 -4.4 24.5 62.3 78 314 A I E -DE 37 70A 2 -41,-1.8 -41,-2.8 -2,-0.3 2,-0.4 -0.980 20.9-161.8-131.3 113.4 -2.3 24.9 59.2 79 315 A I E +DE 36 69A 4 -10,-1.9 -11,-3.0 -2,-0.4 -10,-1.8 -0.860 14.6 167.4-105.5 134.0 -0.5 21.7 58.2 80 316 A T E -DE 35 67A 22 -45,-2.4 -45,-1.8 -2,-0.4 -13,-0.2 -0.794 42.2 -79.1-132.7 173.8 2.5 21.5 55.9 81 317 A E E -D 34 0A 17 -15,-1.5 2,-0.5 -2,-0.2 -47,-0.2 -0.333 47.2-125.0 -70.0 159.7 5.1 19.0 54.8 82 318 A Y - 0 0 51 -49,-0.8 2,-0.6 -48,-0.1 -49,-0.1 -0.927 11.3-144.5-112.9 131.4 8.0 18.5 57.2 83 319 A M > - 0 0 11 -2,-0.5 3,-1.6 1,-0.2 53,-0.1 -0.856 5.7-150.0 -98.8 121.2 11.6 18.9 56.2 84 320 A E T 3 S+ 0 0 88 -2,-0.6 -1,-0.2 1,-0.3 53,-0.1 0.878 93.3 47.3 -51.9 -48.5 13.9 16.4 58.0 85 321 A N T 3 S- 0 0 65 51,-1.0 -1,-0.3 1,-0.2 6,-0.2 0.287 96.2-149.2 -83.5 11.7 17.0 18.7 58.0 86 322 A G < - 0 0 26 -3,-1.6 50,-2.8 50,-0.1 -1,-0.2 -0.098 49.8 -1.8 58.1-152.6 15.3 21.8 59.3 87 323 A S B > -G 135 0B 12 48,-0.2 4,-2.4 1,-0.1 48,-0.3 -0.304 63.3-122.4 -73.7 155.6 16.4 25.3 58.3 88 324 A L H > S+ 0 0 0 46,-2.8 4,-2.4 43,-1.0 44,-0.2 0.867 109.1 55.6 -64.9 -40.5 19.3 26.1 56.1 89 325 A V H > S+ 0 0 19 42,-1.4 4,-0.5 45,-0.2 -1,-0.2 0.889 113.4 42.6 -62.8 -38.5 21.2 28.3 58.7 90 326 A D H >4 S+ 0 0 100 41,-0.2 3,-1.0 2,-0.2 4,-0.4 0.946 113.5 50.3 -72.5 -48.2 21.1 25.4 61.2 91 327 A F H >< S+ 0 0 17 -4,-2.4 3,-1.9 1,-0.2 6,-0.6 0.880 101.8 60.5 -58.6 -43.2 22.0 22.7 58.7 92 328 A L H 3< S+ 0 0 1 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.763 100.8 57.7 -57.4 -25.6 25.0 24.5 57.3 93 329 A K T << S+ 0 0 130 -3,-1.0 -1,-0.3 -4,-0.5 -2,-0.2 0.587 90.4 89.3 -81.9 -12.4 26.5 24.5 60.8 94 330 A T S <> S- 0 0 51 -3,-1.9 4,-2.5 -4,-0.4 3,-0.3 -0.380 93.3-110.0 -80.9 164.7 26.4 20.7 61.1 95 331 A P H > S+ 0 0 109 0, 0.0 4,-2.0 0, 0.0 5,-0.1 0.937 122.3 56.2 -58.9 -42.4 29.3 18.4 59.9 96 332 A S H 4 S+ 0 0 84 1,-0.2 -4,-0.1 2,-0.2 4,-0.1 0.853 112.3 41.3 -55.5 -37.8 27.0 17.4 57.1 97 333 A G H >4 S+ 0 0 0 -6,-0.6 3,-0.9 -3,-0.3 -1,-0.2 0.794 110.9 54.7 -82.7 -29.2 26.5 21.0 56.0 98 334 A I H 3< S+ 0 0 106 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.807 100.3 62.0 -73.1 -28.0 30.2 22.0 56.5 99 335 A K T 3< S+ 0 0 79 -4,-2.0 2,-0.3 -5,-0.2 -1,-0.2 0.474 79.9 115.8 -76.2 -3.3 31.4 19.2 54.2 100 336 A L < - 0 0 38 -3,-0.9 2,-0.1 -5,-0.1 -3,-0.0 -0.498 63.8-127.4 -74.4 134.0 29.4 20.7 51.3 101 337 A T > - 0 0 79 -2,-0.3 4,-2.4 1,-0.1 5,-0.2 -0.306 23.2-109.2 -77.1 160.4 31.4 22.0 48.3 102 338 A I H > S+ 0 0 52 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.805 120.8 58.3 -58.0 -29.4 31.1 25.4 46.8 103 339 A N H > S+ 0 0 89 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.952 107.7 43.7 -64.6 -51.4 29.4 23.6 43.8 104 340 A K H > S+ 0 0 53 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.878 111.4 55.7 -63.0 -38.2 26.7 22.2 46.0 105 341 A L H X S+ 0 0 4 -4,-2.4 4,-1.9 1,-0.2 -1,-0.2 0.870 108.1 47.1 -63.4 -38.4 26.3 25.5 47.8 106 342 A L H X S+ 0 0 2 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.825 108.4 55.6 -74.5 -28.7 25.6 27.4 44.5 107 343 A D H X S+ 0 0 73 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.931 109.7 46.6 -66.4 -43.0 23.2 24.7 43.4 108 344 A M H X S+ 0 0 0 -4,-2.2 4,-1.8 1,-0.2 -2,-0.2 0.882 112.3 50.0 -65.0 -37.7 21.3 25.3 46.7 109 345 A A H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.850 108.3 54.1 -68.7 -33.7 21.5 29.1 46.2 110 346 A A H X S+ 0 0 1 -4,-2.2 4,-2.8 2,-0.2 -2,-0.2 0.960 106.5 51.2 -63.9 -49.3 20.2 28.6 42.6 111 347 A Q H X S+ 0 0 13 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.872 109.4 50.7 -54.7 -41.9 17.2 26.7 43.9 112 348 A I H X S+ 0 0 1 -4,-1.8 4,-2.2 2,-0.2 -1,-0.2 0.951 111.1 48.1 -62.2 -47.3 16.4 29.5 46.3 113 349 A A H X S+ 0 0 0 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.894 108.1 56.1 -58.7 -42.1 16.6 32.0 43.5 114 350 A E H X S+ 0 0 29 -4,-2.8 4,-1.8 1,-0.2 -1,-0.2 0.929 108.9 46.0 -57.0 -46.8 14.4 29.8 41.4 115 351 A G H X S+ 0 0 0 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.881 111.9 50.6 -64.3 -38.9 11.7 29.9 44.1 116 352 A M H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.831 105.8 56.8 -66.7 -32.1 12.1 33.7 44.6 117 353 A A H X S+ 0 0 9 -4,-2.3 4,-2.7 118,-0.2 -1,-0.2 0.917 106.8 49.7 -63.4 -42.8 11.7 34.0 40.8 118 354 A F H X S+ 0 0 8 -4,-1.8 4,-1.4 1,-0.2 -2,-0.2 0.955 110.2 49.5 -58.1 -50.7 8.4 32.2 41.2 119 355 A I H <>S+ 0 0 3 -4,-2.3 5,-2.5 1,-0.2 -1,-0.2 0.844 110.8 50.0 -56.1 -37.6 7.5 34.6 44.0 120 356 A E H ><5S+ 0 0 44 -4,-2.3 3,-1.9 1,-0.2 -1,-0.2 0.914 106.3 56.2 -66.1 -45.6 8.4 37.5 41.7 121 357 A E H 3<5S+ 0 0 141 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.758 109.2 48.1 -56.0 -31.9 6.3 36.0 38.9 122 358 A R T 3<5S- 0 0 122 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.179 112.3-114.8-100.6 16.4 3.3 36.1 41.3 123 359 A N T < 5 + 0 0 151 -3,-1.9 2,-0.2 1,-0.2 -3,-0.2 0.773 69.4 143.5 57.8 25.4 3.7 39.7 42.6 124 360 A Y < - 0 0 63 -5,-2.5 2,-0.4 -6,-0.2 -1,-0.2 -0.641 39.5-153.3 -95.3 157.9 4.5 38.3 46.0 125 361 A I - 0 0 49 -2,-0.2 42,-0.1 1,-0.1 40,-0.0 -0.996 4.7-161.4-131.0 125.6 7.0 39.8 48.4 126 362 A H - 0 0 6 -2,-0.4 -1,-0.1 1,-0.1 41,-0.1 0.939 10.3-169.0 -72.7 -47.7 8.7 37.7 51.0 127 363 A R S S+ 0 0 137 39,-0.2 -1,-0.1 1,-0.1 39,-0.0 0.159 75.6 51.8 77.3 -17.0 9.9 40.4 53.4 128 364 A D + 0 0 45 5,-0.1 2,-0.4 2,-0.0 5,-0.2 -0.096 64.2 163.4-143.8 45.3 12.1 38.1 55.4 129 365 A L + 0 0 0 25,-0.1 2,-0.3 3,-0.1 48,-0.1 -0.522 24.4 127.7 -68.7 121.2 14.4 36.2 53.1 130 366 A R S > S- 0 0 54 -2,-0.4 3,-1.9 46,-0.1 -42,-0.1 -0.934 73.4 -97.3-167.8 155.8 17.3 34.7 55.2 131 367 A A G > S+ 0 0 0 1,-0.3 -42,-1.4 -2,-0.3 3,-1.2 0.708 119.1 66.1 -57.1 -21.3 18.8 31.2 55.6 132 368 A A G 3 S+ 0 0 28 1,-0.3 -1,-0.3 -44,-0.2 -42,-0.1 0.806 101.1 49.4 -70.3 -28.6 16.6 30.7 58.8 133 369 A N G < S+ 0 0 4 -3,-1.9 12,-2.1 -5,-0.2 2,-0.5 0.135 93.7 94.1 -96.2 18.9 13.5 30.8 56.6 134 370 A I E < - H 0 144B 0 -3,-1.2 -46,-2.8 10,-0.2 2,-0.3 -0.954 64.2-150.5-113.1 124.7 15.0 28.2 54.1 135 371 A L E -GH 87 143B 21 8,-2.7 8,-2.7 -2,-0.5 2,-0.6 -0.766 3.7-145.7 -97.2 141.7 14.1 24.6 54.6 136 372 A V E - H 0 142B 0 -50,-2.8 -51,-1.0 -2,-0.3 6,-0.2 -0.924 16.7-142.9-107.6 118.7 16.5 21.7 53.6 137 373 A S > - 0 0 12 4,-2.5 3,-1.5 -2,-0.6 -54,-0.1 -0.033 32.3 -96.7 -70.5 178.7 14.8 18.5 52.3 138 374 A D T 3 S+ 0 0 110 1,-0.3 -1,-0.1 2,-0.1 -55,-0.0 0.677 128.7 51.0 -72.4 -17.5 16.0 15.0 53.0 139 375 A T T 3 S- 0 0 106 2,-0.1 -1,-0.3 0, 0.0 3,-0.1 0.193 123.0-106.7-102.3 13.0 17.8 15.1 49.6 140 376 A L S < S+ 0 0 21 -3,-1.5 -2,-0.1 1,-0.2 2,-0.1 0.666 73.1 143.6 71.4 17.5 19.4 18.4 50.5 141 377 A S - 0 0 29 -30,-0.0 -4,-2.5 1,-0.0 2,-0.4 -0.441 46.9-121.4 -80.3 164.2 17.2 20.4 48.2 142 378 A C E - H 0 136B 0 -6,-0.2 2,-0.4 -2,-0.1 -6,-0.2 -0.927 24.9-174.2-116.2 133.3 16.1 23.9 49.3 143 379 A K E - H 0 135B 30 -8,-2.7 -8,-2.7 -2,-0.4 2,-0.3 -0.967 24.5-122.2-125.5 140.0 12.6 25.2 49.8 144 380 A I E +fH 64 134B 6 -81,-3.4 -79,-2.6 -2,-0.4 2,-0.2 -0.613 42.3 154.1 -81.1 135.8 11.5 28.8 50.6 145 381 A A - 0 0 6 -12,-2.1 2,-0.2 -2,-0.3 -12,-0.1 -0.850 32.8-142.1-146.0-178.5 9.4 29.3 53.7 146 382 A D + 0 0 62 -2,-0.2 -13,-0.1 1,-0.1 -17,-0.1 -0.788 17.5 170.2-159.1 109.1 8.5 31.9 56.4 147 383 A F - 0 0 108 -2,-0.2 2,-0.2 1,-0.2 -1,-0.1 0.757 46.0-112.7 -91.7 -32.1 8.0 31.2 60.1 148 384 A G 0 0 41 -20,-0.1 -1,-0.2 0, 0.0 0, 0.0 -0.567 360.0 360.0 123.3 172.4 7.8 34.6 61.7 149 385 A L 0 0 204 -2,-0.2 0, 0.0 0, 0.0 0, 0.0 0.129 360.0 360.0 -47.0 360.0 9.6 37.0 64.1 150 ! 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 0.0 151 403 A P 0 0 113 0, 0.0 3,-0.1 0, 0.0 4,-0.0 0.000 360.0 360.0 360.0 90.9 16.8 42.1 63.3 152 404 A I > + 0 0 28 1,-0.1 3,-2.6 2,-0.1 8,-0.1 0.691 360.0 96.5-101.9 -28.4 18.0 44.5 60.6 153 405 A K T 3 S+ 0 0 23 1,-0.3 -1,-0.1 35,-0.1 36,-0.0 0.619 90.5 40.2 -42.2 -25.7 20.9 42.6 59.0 154 406 A W T 3 S+ 0 0 18 -3,-0.1 2,-0.4 2,-0.1 -1,-0.3 0.457 94.1 99.9-106.0 -3.0 18.8 41.2 56.1 155 407 A T S < S- 0 0 23 -3,-2.6 15,-0.1 18,-0.1 -27,-0.0 -0.716 71.1-122.8 -93.5 133.4 16.7 44.3 55.3 156 408 A A > - 0 0 0 -2,-0.4 4,-2.4 13,-0.3 3,-0.2 -0.262 28.6-113.0 -63.6 154.1 17.4 46.7 52.4 157 409 A P H > S+ 0 0 10 0, 0.0 4,-3.8 0, 0.0 5,-0.3 0.932 114.7 53.0 -56.4 -51.4 18.0 50.4 53.4 158 410 A E H > S+ 0 0 25 69,-0.2 4,-2.5 1,-0.2 6,-1.4 0.874 111.6 47.1 -54.6 -39.1 14.8 51.7 51.7 159 411 A A H > S+ 0 0 3 4,-0.3 4,-1.5 3,-0.2 -1,-0.2 0.930 115.8 45.5 -69.2 -43.8 12.7 49.1 53.5 160 412 A I H < S+ 0 0 62 -4,-2.4 -2,-0.2 2,-0.2 -1,-0.2 0.970 121.1 37.4 -61.7 -53.5 14.4 50.0 56.8 161 413 A N H < S+ 0 0 114 -4,-3.8 -2,-0.2 1,-0.2 -3,-0.2 0.898 138.4 10.8 -69.3 -44.7 14.2 53.8 56.3 162 414 A Y H < S- 0 0 196 -4,-2.5 -3,-0.2 -5,-0.3 -1,-0.2 0.250 97.8-113.3-119.7 10.7 10.8 54.2 54.7 163 415 A G < + 0 0 45 -4,-1.5 2,-1.2 -5,-0.3 -4,-0.3 0.816 58.9 157.6 63.3 29.3 9.3 50.7 55.1 164 416 A T - 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0 0 39 -3,-2.1 -1,-0.3 -4,-0.2 2,-0.1 -0.712 54.8-133.7 -92.9 138.6 18.5 0.7 57.9 443 445 B T > - 0 0 81 -2,-0.4 4,-2.9 1,-0.1 5,-0.3 -0.384 32.3-104.1 -79.3 163.2 21.5 1.4 55.7 444 446 B N H > S+ 0 0 69 1,-0.2 4,-1.0 2,-0.2 -1,-0.1 0.740 128.1 50.2 -61.9 -18.8 21.9 -0.6 52.5 445 447 B P H > S+ 0 0 60 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.924 110.4 47.9 -80.9 -47.8 24.6 -2.4 54.5 446 448 B E H > S+ 0 0 20 1,-0.2 4,-3.3 2,-0.2 -2,-0.2 0.867 108.7 52.6 -61.0 -41.8 22.3 -3.0 57.4 447 449 B V H X S+ 0 0 0 -4,-2.9 4,-3.0 2,-0.2 5,-0.3 0.973 104.9 55.8 -60.7 -50.3 19.4 -4.3 55.4 448 450 B I H X S+ 0 0 64 -4,-1.0 4,-1.1 -5,-0.3 -1,-0.2 0.895 113.1 44.4 -46.1 -43.4 21.7 -6.9 53.7 449 451 B Q H >X S+ 0 0 113 -4,-1.6 4,-0.8 2,-0.2 3,-0.8 0.963 111.1 49.7 -66.7 -55.3 22.5 -8.1 57.2 450 452 B N H ><>S+ 0 0 32 -4,-3.3 3,-2.4 1,-0.3 5,-1.5 0.944 108.2 55.2 -50.1 -50.8 19.0 -8.1 58.6 451 453 B L H ><5S+ 0 0 15 -4,-3.0 3,-2.0 1,-0.3 -1,-0.3 0.836 99.1 61.9 -51.9 -35.9 17.8 -10.1 55.6 452 454 B E H <<5S+ 0 0 90 -4,-1.1 -1,-0.3 -3,-0.8 -2,-0.2 0.727 100.1 55.3 -63.7 -21.1 20.5 -12.7 56.3 453 455 B R T <<5S- 0 0 185 -3,-2.4 -1,-0.3 -4,-0.8 -2,-0.2 0.204 126.4-101.4 -96.5 13.6 18.8 -13.3 59.7 454 456 B G T < 5 + 0 0 45 -3,-2.0 2,-0.2 1,-0.2 -3,-0.2 0.804 68.3 165.0 71.3 28.4 15.5 -14.0 57.9 455 457 B Y < - 0 0 75 -5,-1.5 2,-0.3 -6,-0.2 -1,-0.2 -0.553 15.2-179.0 -81.5 145.4 14.3 -10.6 58.8 456 458 B R - 0 0 23 -2,-0.2 16,-0.0 -6,-0.0 19,-0.0 -0.994 36.5 -91.8-142.4 140.3 11.3 -9.1 57.1 457 459 B M - 0 0 4 -2,-0.3 2,-0.2 1,-0.1 -1,-0.0 -0.022 45.6-110.7 -48.5 156.9 9.7 -5.6 57.6 458 460 B V - 0 0 97 1,-0.1 -19,-0.1 3,-0.0 -1,-0.1 -0.516 43.1 -81.3 -88.9 158.9 7.0 -5.3 60.1 459 461 B R - 0 0 129 -2,-0.2 3,-0.1 1,-0.1 -1,-0.1 -0.462 56.0-120.6 -61.6 114.6 3.3 -4.7 59.2 460 462 B P > - 0 0 3 0, 0.0 3,-2.1 0, 0.0 -1,-0.1 -0.146 43.0 -75.6 -56.3 152.2 3.2 -0.9 58.7 461 463 B D T 3 S+ 0 0 134 1,-0.3 -3,-0.0 -431,-0.2 0, 0.0 -0.210 118.5 2.6 -50.9 135.8 0.9 1.1 60.9 462 464 B N T 3 S+ 0 0 153 1,-0.2 -1,-0.3 -3,-0.1 3,-0.0 0.251 89.0 146.2 68.9 -11.7 -2.7 0.6 59.8 463 465 B C < - 0 0 6 -3,-2.1 -1,-0.2 1,-0.1 5,-0.1 -0.398 60.2-111.6 -59.9 115.1 -1.7 -1.9 57.0 464 466 B P >> - 0 0 39 0, 0.0 4,-1.7 0, 0.0 3,-1.6 -0.270 22.7-127.7 -50.4 121.5 -4.6 -4.4 56.8 465 467 B E H 3> S+ 0 0 84 1,-0.3 4,-2.5 2,-0.2 5,-0.2 0.819 108.3 57.5 -40.9 -44.0 -3.2 -7.7 58.1 466 468 B E H 3> S+ 0 0 58 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.892 105.8 49.4 -58.4 -39.2 -4.4 -9.5 54.9 467 469 B L H <> S+ 0 0 0 -3,-1.6 4,-1.7 1,-0.2 -1,-0.2 0.907 110.8 51.4 -64.9 -40.2 -2.4 -7.1 52.8 468 470 B Y H X S+ 0 0 23 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.853 105.6 53.3 -65.5 -38.4 0.6 -7.8 55.0 469 471 B Q H X S+ 0 0 91 -4,-2.5 4,-1.5 -5,-0.2 -1,-0.2 0.933 107.5 53.0 -63.7 -38.6 0.2 -11.5 54.7 470 472 B L H X S+ 0 0 10 -4,-1.9 4,-1.4 1,-0.2 3,-0.3 0.898 107.3 51.8 -61.2 -38.9 0.3 -10.9 50.9 471 473 B M H X S+ 0 0 0 -4,-1.7 4,-1.2 1,-0.2 -1,-0.2 0.891 104.6 57.1 -64.4 -37.8 3.5 -9.0 51.5 472 474 B R H < S+ 0 0 97 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.829 103.8 52.4 -63.8 -30.8 4.9 -12.0 53.4 473 475 B L H >< S+ 0 0 63 -4,-1.5 3,-1.2 -3,-0.3 -1,-0.2 0.846 106.0 53.1 -73.1 -33.9 4.3 -14.3 50.3 474 476 B C H 3< S+ 0 0 0 -4,-1.4 -1,-0.2 1,-0.3 -2,-0.2 0.767 110.3 50.9 -70.5 -23.3 6.2 -11.9 48.1 475 477 B W T 3< S+ 0 0 4 -4,-1.2 -1,-0.3 -5,-0.1 -2,-0.2 0.032 74.2 139.7-102.6 26.0 9.0 -12.1 50.6 476 478 B K < - 0 0 77 -3,-1.2 6,-0.2 1,-0.1 -3,-0.1 -0.504 60.0-124.2 -68.1 140.7 9.3 -15.9 50.8 477 479 B E S S+ 0 0 105 -2,-0.1 -69,-0.2 4,-0.1 -1,-0.1 0.950 94.5 63.4 -48.1 -59.4 13.0 -16.9 51.0 478 480 B R S >> S- 0 0 141 1,-0.1 3,-1.0 2,-0.0 4,-0.9 -0.514 79.1-139.0 -76.4 132.0 12.7 -19.2 48.0 479 481 B P G >4 S+ 0 0 35 0, 0.0 3,-0.8 0, 0.0 -1,-0.1 0.879 102.7 56.8 -52.7 -42.4 11.8 -17.7 44.6 480 482 B E G 34 S+ 0 0 117 1,-0.2 -3,-0.0 -3,-0.0 -2,-0.0 0.752 100.3 57.0 -63.9 -29.0 9.5 -20.7 43.8 481 483 B D G <4 S+ 0 0 59 -3,-1.0 -1,-0.2 -5,-0.1 -4,-0.1 0.737 87.1 96.8 -77.9 -19.8 7.4 -20.2 47.0 482 484 B R S << S- 0 0 3 -4,-0.9 -8,-0.2 -3,-0.8 -9,-0.1 -0.362 80.0-109.6 -68.3 146.9 6.6 -16.7 46.0 483 485 B P - 0 0 19 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.120 27.0-105.8 -72.5 172.7 3.2 -16.1 44.2 484 486 B T > - 0 0 61 1,-0.1 4,-2.4 -63,-0.0 3,-0.2 -0.622 22.5-121.1 -95.2 155.6 2.5 -15.2 40.6 485 487 B F H > S+ 0 0 0 1,-0.2 4,-2.9 -2,-0.2 -119,-0.3 0.777 115.4 63.4 -67.1 -23.9 1.4 -11.8 39.5 486 488 B D H > S+ 0 0 115 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.926 107.4 42.1 -63.6 -43.1 -1.7 -13.5 38.1 487 489 B Y H > S+ 0 0 104 -3,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.925 113.8 51.8 -67.2 -48.8 -2.5 -14.5 41.6 488 490 B L H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 5,-0.2 0.919 107.1 51.6 -57.2 -47.6 -1.7 -11.1 43.1 489 491 B R H X S+ 0 0 78 -4,-2.9 4,-2.1 -127,-0.3 -1,-0.2 0.873 111.0 49.2 -60.4 -35.4 -3.8 -9.2 40.7 490 492 B S H X S+ 0 0 59 -4,-1.3 4,-1.3 -5,-0.2 -1,-0.2 0.948 112.2 46.5 -69.9 -45.9 -6.8 -11.4 41.5 491 493 B V H < S+ 0 0 38 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.866 115.1 47.8 -63.6 -35.5 -6.4 -11.0 45.2 492 494 B L H >< S+ 0 0 5 -4,-2.5 3,-1.2 -5,-0.2 4,-0.4 0.896 108.6 50.4 -74.5 -42.3 -5.9 -7.2 45.0 493 495 B E H 3< S+ 0 0 93 -4,-2.1 3,-0.2 1,-0.3 -1,-0.2 0.803 118.4 42.5 -65.6 -26.1 -8.9 -6.5 42.7 494 496 B D T >< S+ 0 0 100 -4,-1.3 3,-1.6 -5,-0.2 -1,-0.3 0.271 80.5 104.5-104.6 11.8 -11.0 -8.5 45.1 495 497 B F T < S+ 0 0 50 -3,-1.2 -1,-0.2 1,-0.3 -2,-0.1 0.894 93.2 33.7 -59.7 -40.5 -9.6 -7.2 48.4 496 498 B F T 3 S+ 0 0 102 -4,-0.4 -1,-0.3 -3,-0.2 -2,-0.1 -0.115 96.9 103.9-107.4 36.7 -12.7 -5.0 49.0 497 499 B T < 0 0 65 -3,-1.6 -2,-0.1 1,-0.1 -3,-0.1 0.605 360.0 360.0 -80.2-120.4 -15.1 -7.4 47.4 498 500 B A 0 0 173 -4,-0.1 -1,-0.1 0, 0.0 -4,-0.0 -0.150 360.0 360.0-179.0 360.0 -17.3 -9.4 49.9