==== 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 04-JAN-07 2OFU . COMPND 2 MOLECULE: PROTO-ONCOGENE TYROSINE-PROTEIN KINASE LCK; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR X.HUANG . 273 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13971.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 179 65.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 2.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 43 15.8 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 . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 15 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 10.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 81 29.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.1 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 2 0 1 0 0 1 1 0 0 1 1 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 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 . 1 2 1 1 1 0 1 1 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 1 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 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 1 229 A P 0 0 182 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-173.5 -0.6 33.7 92.8 2 230 A Q - 0 0 75 1,-0.1 3,-0.1 6,-0.0 6,-0.0 -0.432 360.0 -91.9 -90.9 164.0 2.0 31.2 91.7 3 231 A K - 0 0 104 -2,-0.1 -1,-0.1 1,-0.1 5,-0.1 -0.444 57.5 -90.8 -70.7 154.3 1.6 27.4 91.8 4 232 A P >> - 0 0 42 0, 0.0 4,-3.1 0, 0.0 3,-2.5 -0.336 38.8-107.8 -64.2 156.5 2.9 26.0 95.1 5 233 A W T 34 S+ 0 0 122 1,-0.3 6,-0.2 2,-0.2 -2,-0.1 0.813 121.4 59.3 -55.2 -32.5 6.6 25.0 94.9 6 234 A W T 34 S+ 0 0 173 1,-0.2 -1,-0.3 3,-0.0 -3,-0.0 0.613 119.6 29.9 -73.6 -9.0 5.6 21.3 95.0 7 235 A E T <4 S+ 0 0 122 -3,-2.5 -2,-0.2 0, 0.0 2,-0.2 0.628 90.7 108.0-117.7 -25.9 3.6 22.0 91.8 8 236 A D >< - 0 0 10 -4,-3.1 3,-1.3 1,-0.2 -6,-0.0 -0.388 61.1-147.3 -59.0 120.5 5.6 24.8 90.1 9 237 A E T 3 S+ 0 0 120 1,-0.3 -1,-0.2 -2,-0.2 -4,-0.1 0.643 96.5 60.8 -61.8 -16.8 7.4 23.3 87.1 10 238 A W T 3 S+ 0 0 35 67,-0.1 68,-2.0 2,-0.0 -1,-0.3 0.677 79.3 101.0 -86.1 -19.9 10.1 25.8 87.7 11 239 A E B < +a 78 0A 28 -3,-1.3 68,-0.2 66,-0.2 66,-0.0 -0.485 48.3 179.2 -69.3 132.7 11.1 24.6 91.2 12 240 A V - 0 0 15 66,-1.5 68,-0.1 -2,-0.2 2,-0.1 -0.978 35.9 -99.4-134.1 145.4 14.2 22.4 91.4 13 241 A P > - 0 0 80 0, 0.0 3,-1.9 0, 0.0 4,-0.2 -0.405 29.8-126.6 -62.8 140.7 15.9 20.8 94.4 14 242 A R G > S+ 0 0 69 1,-0.3 3,-1.5 2,-0.2 65,-0.0 0.723 106.6 73.2 -60.8 -21.6 18.9 22.8 95.6 15 243 A E G 3 S+ 0 0 151 1,-0.3 -1,-0.3 3,-0.0 22,-0.0 0.758 83.2 67.7 -63.5 -26.2 20.9 19.6 95.3 16 244 A T G < S+ 0 0 24 -3,-1.9 21,-2.8 21,-0.1 22,-0.4 0.606 94.8 73.4 -70.0 -11.4 20.7 19.9 91.5 17 245 A L E < -B 36 0A 21 -3,-1.5 2,-0.4 19,-0.2 19,-0.2 -0.851 52.3-177.3-113.9 146.6 23.0 23.0 91.6 18 246 A K E -B 35 0A 128 17,-1.4 17,-1.8 -2,-0.4 2,-0.4 -0.977 21.5-141.3-139.9 112.6 26.6 23.5 92.3 19 247 A L E +B 34 0A 51 -2,-0.4 15,-0.2 15,-0.2 3,-0.1 -0.704 28.4 165.5 -78.4 126.3 28.0 27.1 92.4 20 248 A V E + 0 0 67 13,-2.4 2,-0.4 -2,-0.4 14,-0.2 0.824 56.6 18.0-108.9 -52.5 31.4 27.3 90.8 21 249 A E E -B 33 0A 109 12,-2.0 12,-3.5 0, 0.0 2,-0.4 -0.989 68.3-128.8-132.6 130.5 32.6 30.9 90.1 22 250 A R E +B 32 0A 134 -2,-0.4 10,-0.3 10,-0.2 3,-0.1 -0.622 22.8 178.8 -79.0 127.6 31.2 34.2 91.5 23 251 A L E + 0 0 86 8,-2.8 2,-0.3 -2,-0.4 9,-0.2 0.816 66.8 1.9 -94.7 -39.7 30.3 36.7 88.9 24 252 A G E -B 31 0A 33 7,-1.8 7,-2.6 2,-0.0 2,-0.4 -0.996 53.9-159.4-150.9 151.7 29.0 39.5 91.1 25 253 A A E +B 30 0A 70 -2,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.991 25.1 160.7-134.8 123.5 28.5 40.4 94.7 26 254 A G - 0 0 49 3,-3.7 3,-0.4 -2,-0.4 -2,-0.0 -0.661 53.6 -88.1-130.8-171.9 26.1 43.0 95.9 27 255 A Q S S+ 0 0 142 1,-0.2 3,-0.1 -2,-0.2 24,-0.0 0.779 125.2 40.1 -70.3 -29.3 24.2 44.4 98.9 28 256 A F S S- 0 0 103 1,-0.2 20,-2.8 23,-0.1 2,-0.3 0.417 126.8 -64.9-102.0 -0.8 21.2 42.1 98.2 29 257 A G E - C 0 47A 16 -3,-0.4 -3,-3.7 18,-0.3 2,-0.3 -0.973 52.5 -70.3 152.8-167.7 23.2 39.0 97.2 30 258 A E E -BC 25 46A 58 16,-1.2 16,-3.0 -2,-0.3 2,-0.4 -0.871 22.6-147.0-127.7 159.4 25.5 37.2 94.9 31 259 A V E -BC 24 45A 51 -7,-2.6 -8,-2.8 -2,-0.3 -7,-1.8 -0.998 23.0-173.3-128.8 131.9 25.4 35.9 91.3 32 260 A W E -BC 22 44A 56 12,-3.3 12,-3.2 -2,-0.4 2,-0.5 -0.876 29.1-126.5-127.0 156.8 27.3 32.8 90.3 33 261 A M E +BC 21 43A 12 -12,-3.5 -13,-2.4 -2,-0.3 -12,-2.0 -0.865 52.6 151.5 -95.3 129.6 28.3 30.7 87.3 34 262 A G E -BC 19 42A 0 8,-3.4 8,-2.8 -2,-0.5 2,-0.4 -0.788 41.4-102.2-145.8-169.8 27.3 27.2 88.1 35 263 A Y E -BC 18 41A 68 -17,-1.8 -17,-1.4 6,-0.2 2,-0.5 -0.985 15.5-149.5-129.3 135.8 26.1 23.8 86.9 36 264 A Y E > S-BC 17 40A 47 4,-3.2 4,-1.9 -2,-0.4 3,-0.3 -0.912 88.4 -12.5-102.1 127.0 22.7 22.2 86.8 37 265 A N T 4 S- 0 0 94 -21,-2.8 2,-1.7 -2,-0.5 -1,-0.2 0.847 118.6 -76.5 49.0 38.4 22.8 18.4 87.1 38 266 A G T 4 S+ 0 0 53 -22,-0.4 -1,-0.2 -3,-0.3 -2,-0.0 -0.268 128.2 55.4 78.2 -51.8 26.5 18.6 86.4 39 267 A H T 4 S+ 0 0 182 -2,-1.7 2,-0.7 -3,-0.3 -1,-0.2 0.707 85.1 82.3 -90.5 -25.4 26.5 19.2 82.7 40 268 A T E < -C 36 0A 57 -4,-1.9 -4,-3.2 1,-0.0 2,-0.3 -0.762 69.0-140.5 -95.0 117.0 24.4 22.3 82.1 41 269 A K E +C 35 0A 71 -2,-0.7 49,-0.6 -6,-0.2 2,-0.3 -0.542 34.2 162.1 -74.1 127.3 26.1 25.7 82.7 42 270 A V E -CD 34 89A 0 -8,-2.8 -8,-3.4 -2,-0.3 2,-0.4 -0.876 38.1-116.6-140.2 172.1 23.8 28.2 84.4 43 271 A A E -CD 33 88A 14 45,-2.2 45,-2.5 -2,-0.3 2,-0.5 -0.929 28.1-161.3-112.5 136.1 23.8 31.5 86.3 44 272 A V E -CD 32 87A 1 -12,-3.2 -12,-3.3 -2,-0.4 2,-0.5 -0.974 7.4-163.4-126.3 126.0 22.6 31.5 89.9 45 273 A K E -CD 31 86A 71 41,-2.8 41,-2.1 -2,-0.5 2,-0.4 -0.925 12.7-162.9-106.2 126.1 21.4 34.5 91.9 46 274 A S E -CD 30 85A 18 -16,-3.0 -16,-1.2 -2,-0.5 2,-0.4 -0.888 16.7-124.8-112.2 141.1 21.3 34.1 95.6 47 275 A L E -C 29 0A 21 37,-1.7 2,-0.9 -2,-0.4 -18,-0.3 -0.671 14.0-136.2 -85.9 129.7 19.4 36.3 98.1 48 276 A K >> - 0 0 127 -20,-2.8 3,-1.6 -2,-0.4 4,-0.6 -0.768 35.7-122.3 -82.0 111.0 21.4 37.8 100.9 49 277 A Q B 34 S+f 52 0B 151 -2,-0.9 4,-0.1 1,-0.2 -1,-0.0 -0.257 92.1 20.1 -58.0 139.0 18.9 37.1 103.8 50 278 A G T 34 S+ 0 0 78 2,-0.5 -1,-0.2 -22,-0.0 3,-0.1 -0.057 102.2 92.0 93.4 -32.1 17.8 40.2 105.6 51 279 A S T <4 S- 0 0 34 -3,-1.6 2,-0.3 1,-0.2 -2,-0.2 0.873 101.6 -13.3 -63.1 -40.3 18.8 42.4 102.7 52 280 A M B < S-f 49 0B 58 -4,-0.6 -2,-0.5 -24,-0.1 -1,-0.2 -0.985 82.4 -76.1-158.4 165.9 15.4 42.3 101.2 53 281 A S > - 0 0 57 -2,-0.3 4,-2.5 1,-0.1 5,-0.1 -0.407 30.3-136.4 -68.5 138.6 12.0 40.5 101.2 54 282 A P H > S+ 0 0 65 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.855 110.1 54.8 -61.9 -34.2 11.9 37.0 99.5 55 283 A D H > S+ 0 0 133 1,-0.2 4,-1.3 2,-0.2 -2,-0.0 0.949 109.2 46.6 -62.3 -47.8 8.6 38.2 97.9 56 284 A A H 4 S+ 0 0 51 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.876 113.6 50.5 -61.0 -39.0 10.5 41.2 96.5 57 285 A F H >< S+ 0 0 6 -4,-2.5 3,-0.6 1,-0.2 4,-0.4 0.912 111.8 43.7 -66.8 -47.7 13.3 38.9 95.4 58 286 A L H >X S+ 0 0 28 -4,-2.7 4,-2.3 1,-0.2 3,-0.5 0.633 89.3 88.8 -75.9 -15.9 11.2 36.3 93.5 59 287 A A H 3X S+ 0 0 52 -4,-1.3 4,-1.8 1,-0.3 -1,-0.2 0.869 89.2 47.9 -52.2 -40.6 8.9 38.8 91.8 60 288 A E H <> S+ 0 0 26 -3,-0.6 4,-2.3 -4,-0.4 -1,-0.3 0.839 108.1 55.6 -72.3 -29.6 11.3 39.1 88.8 61 289 A A H <> S+ 0 0 0 -3,-0.5 4,-1.1 -4,-0.4 -2,-0.2 0.931 107.3 50.2 -64.9 -43.9 11.5 35.3 88.6 62 290 A N H X S+ 0 0 49 -4,-2.3 4,-0.8 1,-0.2 3,-0.3 0.883 109.6 50.2 -61.8 -39.8 7.7 35.2 88.3 63 291 A L H >X S+ 0 0 22 -4,-1.8 4,-2.0 1,-0.2 3,-1.3 0.936 107.1 54.4 -65.4 -42.9 7.7 37.8 85.6 64 292 A M H 3< S+ 0 0 11 -4,-2.3 11,-0.4 1,-0.3 -1,-0.2 0.744 98.4 63.1 -62.8 -22.5 10.3 35.8 83.6 65 293 A K H 3< S+ 0 0 14 -4,-1.1 -1,-0.3 -3,-0.3 -2,-0.2 0.841 112.1 38.6 -68.2 -31.0 8.1 32.8 83.8 66 294 A Q H << S+ 0 0 131 -3,-1.3 2,-0.8 -4,-0.8 -2,-0.2 0.779 110.5 61.0 -86.7 -33.1 5.7 35.0 81.8 67 295 A L < + 0 0 10 -4,-2.0 2,-0.4 2,-0.0 -1,-0.2 -0.847 64.9 158.8-106.4 100.1 8.1 36.7 79.5 68 296 A Q + 0 0 90 -2,-0.8 2,-0.3 -3,-0.1 5,-0.1 -0.975 3.1 138.7-125.3 132.6 10.1 34.2 77.3 69 297 A H > - 0 0 65 3,-0.4 3,-2.1 -2,-0.4 54,-0.0 -0.976 58.1-110.1-164.3 150.6 11.9 34.8 74.0 70 298 A Q T 3 S+ 0 0 142 -2,-0.3 4,-0.1 1,-0.3 -1,-0.1 0.824 119.2 53.1 -53.6 -32.7 15.2 33.7 72.2 71 299 A R T 3 S+ 0 0 31 80,-0.1 81,-2.5 2,-0.1 2,-0.4 0.426 100.2 72.1 -86.1 1.4 16.4 37.3 72.6 72 300 A L B < S-g 152 0C 2 -3,-2.1 -3,-0.4 79,-0.3 81,-0.2 -0.968 96.0-101.9-119.5 132.5 15.8 37.5 76.4 73 301 A V - 0 0 8 79,-2.5 2,-0.3 -2,-0.4 -2,-0.1 -0.302 49.2-125.4 -53.5 119.7 17.9 35.7 79.0 74 302 A R - 0 0 109 -4,-0.1 15,-2.9 1,-0.1 2,-0.2 -0.516 7.5-120.3 -80.1 135.3 15.7 32.7 79.9 75 303 A L E - E 0 88A 2 -11,-0.4 13,-0.3 -2,-0.3 3,-0.1 -0.504 29.4-178.4 -67.1 133.2 14.6 31.7 83.4 76 304 A Y E - 0 0 60 11,-3.0 2,-0.3 1,-0.4 12,-0.2 0.829 53.2 -40.4-102.2 -44.9 15.9 28.2 84.1 77 305 A A E - E 0 87A 0 10,-1.8 10,-2.7 -65,-0.0 -1,-0.4 -0.965 45.7-133.6-170.1 177.0 14.6 27.4 87.6 78 306 A V E -aE 11 86A 0 -68,-2.0 -66,-1.5 -2,-0.3 2,-0.5 -0.992 3.0-153.9-148.3 145.1 13.9 28.7 91.0 79 307 A V E + E 0 85A 1 6,-2.3 6,-1.9 -2,-0.3 -68,-0.1 -0.983 18.3 175.9-121.0 111.0 14.5 27.4 94.5 80 308 A T + 0 0 44 -2,-0.5 2,-0.6 4,-0.2 4,-0.2 0.331 53.0 85.0-103.6 6.9 11.9 28.9 96.8 81 309 A Q S S- 0 0 72 2,-0.3 -67,-0.1 -76,-0.1 4,-0.1 -0.957 99.6 -56.0-106.5 120.2 12.6 27.3 100.1 82 310 A E S S+ 0 0 62 -2,-0.6 2,-0.1 2,-0.1 -2,-0.1 -0.030 126.6 50.0 -44.1 138.5 15.4 29.3 101.9 83 311 A P S S- 0 0 76 0, 0.0 2,-0.3 0, 0.0 -2,-0.3 0.519 94.4-149.1 -70.1 148.4 18.0 30.0 101.0 84 312 A I - 0 0 11 -37,-0.2 -37,-1.7 -4,-0.2 2,-0.3 -0.692 16.6-174.7 -93.1 140.9 16.3 31.2 97.8 85 313 A Y E -DE 46 79A 48 -6,-1.9 -6,-2.3 -2,-0.3 2,-0.5 -0.956 18.8-155.1-134.2 149.8 17.9 31.1 94.3 86 314 A I E -DE 45 78A 4 -41,-2.1 -41,-2.8 -2,-0.3 2,-0.4 -0.996 20.9-162.8-121.1 119.4 16.9 32.4 90.8 87 315 A I E +DE 44 77A 0 -10,-2.7 -11,-3.0 -2,-0.5 -10,-1.8 -0.892 12.8 176.2-109.6 136.3 18.6 30.3 88.1 88 316 A T E -DE 43 75A 24 -45,-2.5 -45,-2.2 -2,-0.4 -13,-0.2 -0.838 38.8 -74.2-134.2 170.9 18.9 31.5 84.5 89 317 A E E -D 42 0A 52 -15,-2.9 2,-0.4 -2,-0.3 -47,-0.1 -0.320 56.6-118.9 -58.6 142.5 20.3 30.8 81.1 90 318 A Y - 0 0 47 -49,-0.6 2,-0.6 -48,-0.0 -1,-0.1 -0.765 19.1-159.3 -97.1 134.6 24.1 31.4 81.0 91 319 A M > - 0 0 12 -2,-0.4 3,-1.4 1,-0.1 53,-0.2 -0.926 5.4-158.4-112.6 109.7 25.8 33.9 78.7 92 320 A E T 3 S+ 0 0 86 -2,-0.6 53,-0.2 1,-0.2 -1,-0.1 0.827 85.2 50.1 -57.9 -39.2 29.5 33.2 78.3 93 321 A N T 3 S- 0 0 55 51,-2.1 -1,-0.2 1,-0.2 6,-0.2 0.227 96.3-142.7 -92.3 20.1 30.8 36.6 77.2 94 322 A G < - 0 0 32 -3,-1.4 50,-3.2 50,-0.3 -1,-0.2 -0.129 52.5 -4.9 62.1-153.9 29.2 38.6 80.1 95 323 A S B > -H 143 0C 17 48,-0.2 4,-2.8 1,-0.1 3,-0.5 -0.469 61.4-127.3 -76.3 148.0 27.7 42.1 79.8 96 324 A L H > S+ 0 0 0 46,-3.2 4,-2.4 43,-0.8 44,-0.2 0.899 109.4 60.0 -60.8 -40.8 28.0 43.9 76.5 97 325 A V H 4 S+ 0 0 22 42,-1.1 -1,-0.2 45,-0.3 43,-0.1 0.850 113.8 36.5 -57.4 -35.1 29.5 46.9 78.3 98 326 A D H >4 S+ 0 0 96 -3,-0.5 3,-2.0 41,-0.2 4,-0.5 0.914 113.3 55.5 -82.6 -47.9 32.4 44.8 79.5 99 327 A F H >< S+ 0 0 8 -4,-2.8 3,-1.5 1,-0.3 6,-0.7 0.847 98.9 62.5 -53.2 -40.5 32.8 42.6 76.4 100 328 A L T 3< S+ 0 0 1 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.1 0.631 101.9 53.0 -63.7 -13.4 33.2 45.6 74.1 101 329 A K T < S+ 0 0 119 -3,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.525 90.5 94.3 -98.2 -10.6 36.4 46.5 76.1 102 330 A T S <> S- 0 0 50 -3,-1.5 4,-3.0 -4,-0.5 5,-0.2 -0.300 94.4-101.6 -77.1 165.4 38.0 43.1 75.7 103 331 A P H > S+ 0 0 95 0, 0.0 4,-1.0 0, 0.0 -1,-0.1 0.882 125.9 48.4 -54.7 -38.7 40.5 42.4 72.8 104 332 A S H 4 S+ 0 0 79 2,-0.2 3,-0.5 1,-0.2 4,-0.3 0.931 113.0 46.0 -67.2 -46.9 37.7 40.6 71.0 105 333 A G H >4 S+ 0 0 0 -6,-0.7 3,-1.7 1,-0.2 -1,-0.2 0.880 105.3 60.1 -64.4 -40.0 35.2 43.4 71.5 106 334 A I H 3< S+ 0 0 104 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.811 103.0 53.5 -58.6 -31.8 37.6 46.1 70.5 107 335 A K T 3< S+ 0 0 163 -4,-1.0 -1,-0.3 -3,-0.5 -2,-0.2 0.478 78.3 124.2 -83.8 -3.5 38.0 44.4 67.1 108 336 A L < - 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0 0 26 -2,-0.3 3,-2.3 -25,-0.2 4,-1.3 -0.906 59.1 -88.2-148.5 170.0 6.0 53.7 79.1 191 419 A I H 3> S+ 0 0 35 -27,-0.4 4,-1.7 1,-0.3 5,-0.1 0.829 128.5 63.2 -54.8 -27.3 7.6 51.6 76.4 192 420 A K H 3> S+ 0 0 35 1,-0.2 4,-1.4 2,-0.2 -1,-0.3 0.761 94.3 58.9 -69.5 -22.9 8.6 55.0 74.9 193 421 A S H <> S+ 0 0 2 -3,-2.3 4,-1.8 2,-0.2 -1,-0.2 0.907 105.4 49.8 -70.0 -39.5 10.7 55.6 78.0 194 422 A D H X S+ 0 0 1 -4,-1.3 4,-2.4 1,-0.2 -2,-0.2 0.873 103.7 59.3 -65.0 -37.0 12.6 52.4 77.1 195 423 A V H X S+ 0 0 0 -4,-1.7 4,-1.4 1,-0.2 -1,-0.2 0.889 104.3 51.3 -59.1 -38.3 13.0 53.7 73.5 196 424 A W H X S+ 0 0 2 -4,-1.4 4,-1.6 1,-0.2 3,-0.5 0.947 108.9 49.7 -63.2 -48.0 14.9 56.7 74.9 197 425 A S H X S+ 0 0 7 -4,-1.8 4,-2.7 1,-0.3 -2,-0.2 0.856 104.8 59.0 -57.8 -38.2 17.2 54.4 76.9 198 426 A F H X S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 -1,-0.3 0.879 101.5 55.1 -59.8 -37.7 17.8 52.4 73.7 199 427 A G H X S+ 0 0 0 -4,-1.4 4,-1.2 -3,-0.5 -1,-0.2 0.940 109.8 45.5 -59.5 -47.2 19.1 55.6 72.2 200 428 A I H X S+ 0 0 0 -4,-1.6 4,-1.4 1,-0.2 3,-0.5 0.902 109.6 55.6 -61.5 -42.4 21.6 56.0 75.0 201 429 A L H X S+ 0 0 0 -4,-2.7 4,-2.0 1,-0.3 -1,-0.2 0.893 100.1 60.3 -58.9 -40.0 22.5 52.3 74.7 202 430 A L H X S+ 0 0 1 -4,-2.3 4,-2.2 1,-0.3 -1,-0.3 0.890 101.9 52.1 -55.7 -40.1 23.3 52.9 71.1 203 431 A T H X S+ 0 0 2 -4,-1.2 4,-1.3 -3,-0.5 7,-0.3 0.876 107.1 54.2 -66.1 -32.6 26.0 55.4 72.2 204 432 A E H <>S+ 0 0 5 -4,-1.4 5,-3.5 -3,-0.2 6,-0.3 0.887 108.3 49.6 -65.3 -39.5 27.4 52.7 74.5 205 433 A I H ><5S+ 0 0 4 -4,-2.0 3,-1.3 3,-0.2 -2,-0.2 0.955 113.2 42.9 -64.8 -53.6 27.7 50.2 71.5 206 434 A V H 3<5S+ 0 0 11 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.685 115.9 48.6 -70.7 -17.5 29.5 52.5 69.1 207 435 A T T 3<5S- 0 0 33 -4,-1.3 3,-0.3 -5,-0.2 -1,-0.3 0.196 112.8-116.2-104.3 12.0 31.8 53.9 71.8 208 436 A H T < 5S- 0 0 55 -3,-1.3 -3,-0.2 1,-0.2 -2,-0.1 0.891 81.6 -35.7 55.9 44.0 32.7 50.4 73.1 209 437 A G S S- 0 0 5 19,-0.1 3,-1.7 1,-0.1 8,-0.1 0.928 92.5-136.6 48.8 57.6 27.3 62.4 77.9 214 442 A P T 3 S+ 0 0 53 0, 0.0 -1,-0.1 0, 0.0 18,-0.1 -0.079 78.1 6.6 -45.5 131.6 31.1 62.6 78.2 215 443 A G T 3 S+ 0 0 82 1,-0.2 2,-0.4 -3,-0.1 -2,-0.1 0.618 103.6 119.1 68.4 15.4 32.5 65.2 80.6 216 444 A M < - 0 0 46 -3,-1.7 -1,-0.2 -4,-0.2 2,-0.1 -0.927 54.6-143.8-119.1 138.4 29.0 66.0 82.0 217 445 A T > - 0 0 74 -2,-0.4 4,-2.2 -3,-0.1 5,-0.1 -0.443 37.6-102.2 -84.8 166.8 27.6 65.7 85.5 218 446 A N H > S+ 0 0 76 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.915 122.9 54.5 -60.7 -43.0 23.9 64.7 85.8 219 447 A P H > S+ 0 0 92 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.919 111.1 48.0 -56.8 -40.4 22.8 68.3 86.6 220 448 A E H > S+ 0 0 84 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.899 108.8 52.4 -65.0 -42.9 24.5 69.3 83.3 221 449 A V H X S+ 0 0 0 -4,-2.2 4,-2.2 1,-0.2 5,-0.2 0.966 113.1 44.7 -58.5 -51.5 22.9 66.4 81.4 222 450 A I H X S+ 0 0 53 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.907 113.8 49.0 -58.6 -46.8 19.4 67.5 82.6 223 451 A Q H X S+ 0 0 47 -4,-2.5 4,-0.8 -5,-0.3 -1,-0.2 0.899 112.3 48.2 -62.3 -42.3 20.0 71.2 82.0 224 452 A N H ><>S+ 0 0 49 -4,-2.6 5,-1.8 1,-0.2 3,-0.5 0.880 108.5 53.6 -67.0 -38.9 21.3 70.6 78.5 225 453 A L H ><5S+ 0 0 19 -4,-2.2 3,-2.0 -5,-0.2 -1,-0.2 0.937 104.8 55.2 -61.8 -44.0 18.4 68.3 77.5 226 454 A E H 3<5S+ 0 0 142 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.734 101.9 58.2 -61.4 -23.2 15.9 71.0 78.6 227 455 A R T <<5S- 0 0 179 -4,-0.8 -1,-0.3 -3,-0.5 -2,-0.2 0.577 125.5-102.8 -81.5 -11.0 17.6 73.5 76.2 228 456 A G T < 5S+ 0 0 50 -3,-2.0 -3,-0.2 -4,-0.4 -2,-0.1 0.307 81.0 131.6 104.8 -7.7 16.9 71.1 73.4 229 457 A Y < - 0 0 116 -5,-1.8 -1,-0.4 -6,-0.2 2,-0.3 -0.344 36.3-165.9 -73.8 161.4 20.5 69.8 73.1 230 458 A R - 0 0 44 1,-0.1 3,-0.1 -3,-0.1 16,-0.0 -0.844 43.5 -53.9-136.7 171.2 21.1 66.0 73.0 231 459 A M - 0 0 7 -2,-0.3 -1,-0.1 1,-0.1 2,-0.0 -0.155 65.6-103.5 -51.0 140.4 24.3 64.0 73.5 232 460 A V - 0 0 111 1,-0.2 -19,-0.1 -18,-0.1 -1,-0.1 -0.341 48.7 -83.3 -64.5 145.2 27.1 65.1 71.2 233 461 A R - 0 0 134 -3,-0.1 -1,-0.2 1,-0.1 3,-0.1 -0.300 53.1-122.4 -51.0 119.8 27.9 62.9 68.2 234 462 A P > - 0 0 17 0, 0.0 3,-0.8 0, 0.0 -1,-0.1 -0.314 35.8 -89.4 -64.6 150.4 30.1 60.1 69.6 235 463 A D T 3 S+ 0 0 117 1,-0.2 -3,-0.0 -3,-0.1 0, 0.0 -0.335 110.0 8.5 -60.8 143.8 33.5 59.8 68.0 236 464 A N T 3 S+ 0 0 161 1,-0.2 -1,-0.2 -3,-0.1 -3,-0.0 0.883 90.3 145.5 50.1 51.3 33.5 57.4 65.0 237 465 A C < - 0 0 22 -3,-0.8 -1,-0.2 -30,-0.0 5,-0.1 -0.970 54.4-114.5-120.1 122.9 29.7 57.0 64.9 238 466 A P > - 0 0 46 0, 0.0 4,-2.5 0, 0.0 5,-0.2 -0.262 21.0-131.8 -54.0 137.5 27.9 56.6 61.6 239 467 A E H > S+ 0 0 82 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.857 106.1 58.6 -61.3 -36.8 25.7 59.7 60.9 240 468 A E H > S+ 0 0 135 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.931 110.0 44.4 -58.3 -45.0 22.8 57.4 59.9 241 469 A L H > S+ 0 0 5 2,-0.2 4,-2.4 1,-0.2 3,-0.2 0.919 109.0 55.4 -65.8 -45.1 23.0 55.8 63.4 242 470 A Y H X S+ 0 0 17 -4,-2.5 4,-1.9 1,-0.3 -1,-0.2 0.924 108.9 49.3 -55.5 -40.6 23.4 59.2 65.1 243 471 A Q H X S+ 0 0 70 -4,-2.5 4,-1.2 1,-0.2 -1,-0.3 0.828 107.2 53.7 -69.1 -30.1 20.2 60.3 63.5 244 472 A L H X S+ 0 0 5 -4,-1.4 4,-1.3 -3,-0.2 3,-0.3 0.882 106.3 54.0 -68.6 -37.9 18.4 57.1 64.6 245 473 A M H X S+ 0 0 0 -4,-2.4 4,-0.8 1,-0.2 3,-0.5 0.924 103.4 56.9 -59.2 -44.7 19.6 57.9 68.2 246 474 A R H >< S+ 0 0 113 -4,-1.9 3,-0.6 1,-0.3 -1,-0.2 0.822 99.9 57.5 -57.9 -34.8 17.9 61.3 67.8 247 475 A L H >< S+ 0 0 50 -4,-1.2 3,-1.3 -3,-0.3 -1,-0.3 0.897 103.7 54.1 -62.3 -39.8 14.6 59.7 67.0 248 476 A C H 3< S+ 0 0 0 -4,-1.3 -1,-0.2 -3,-0.5 -2,-0.2 0.686 108.0 52.2 -66.4 -18.8 14.8 57.9 70.3 249 477 A W T << S+ 0 0 1 -4,-0.8 -1,-0.3 -3,-0.6 -2,-0.2 0.102 74.2 140.9-107.6 23.0 15.3 61.2 72.1 250 478 A K < - 0 0 90 -3,-1.3 6,-0.2 3,-0.1 5,-0.1 -0.324 59.3-118.6 -64.5 150.2 12.4 63.3 70.8 251 479 A E S S+ 0 0 138 4,-0.1 -1,-0.1 3,-0.1 3,-0.1 0.927 98.4 59.0 -52.6 -57.6 10.7 65.6 73.3 252 480 A R S >> S- 0 0 133 1,-0.2 3,-1.8 2,-0.0 4,-0.7 -0.665 79.1-140.9 -79.9 127.0 7.2 64.0 73.2 253 481 A P G >4 S+ 0 0 34 0, 0.0 3,-1.5 0, 0.0 -1,-0.2 0.920 103.6 56.5 -51.1 -44.4 7.3 60.2 74.2 254 482 A E G 34 S+ 0 0 112 1,-0.3 -3,-0.1 -3,-0.1 -2,-0.0 0.683 98.2 61.6 -62.0 -21.0 4.7 59.6 71.5 255 483 A D G <4 S+ 0 0 62 -3,-1.8 -1,-0.3 -5,-0.1 -4,-0.1 0.687 84.2 92.8 -80.7 -18.4 7.0 61.1 68.9 256 484 A R S << S- 0 0 5 -3,-1.5 -8,-0.2 -4,-0.7 -9,-0.1 -0.443 83.7-109.4 -71.7 148.8 9.7 58.5 69.4 257 485 A P - 0 0 23 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.108 30.6 -96.6 -74.4 174.8 9.4 55.4 67.2 258 486 A T > - 0 0 60 1,-0.1 4,-2.1 -63,-0.0 5,-0.1 -0.496 29.1-116.9 -86.6 162.4 8.4 51.8 68.0 259 487 A F H > S+ 0 0 0 2,-0.2 4,-2.7 1,-0.2 -134,-0.3 0.824 116.0 58.2 -69.1 -30.1 11.0 49.2 68.8 260 488 A D H > S+ 0 0 82 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.932 107.0 48.3 -65.0 -40.4 9.9 47.2 65.7 261 489 A Y H > S+ 0 0 107 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.946 111.0 49.8 -61.0 -50.8 10.6 50.2 63.6 262 490 A L H X S+ 0 0 0 -4,-2.1 4,-2.7 1,-0.2 5,-0.2 0.910 109.9 52.5 -54.3 -44.2 14.1 50.6 65.2 263 491 A R H X S+ 0 0 54 -4,-2.7 4,-2.7 -142,-0.2 -2,-0.2 0.958 109.2 48.4 -57.4 -53.0 14.7 46.9 64.6 264 492 A S H X S+ 0 0 38 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.895 113.1 47.4 -55.3 -46.0 13.8 47.2 60.9 265 493 A V H X S+ 0 0 18 -4,-2.6 4,-2.7 2,-0.2 -1,-0.2 0.940 112.7 47.8 -63.3 -48.6 16.0 50.2 60.4 266 494 A L H X S+ 0 0 0 -4,-2.7 4,-2.8 1,-0.2 -2,-0.2 0.892 109.8 54.0 -59.6 -38.6 19.0 48.6 62.2 267 495 A E H X S+ 0 0 68 -4,-2.7 4,-2.8 -5,-0.2 -1,-0.2 0.887 109.7 47.4 -64.4 -36.9 18.5 45.4 60.1 268 496 A D H X S+ 0 0 108 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.931 111.9 50.2 -67.2 -45.3 18.7 47.5 56.9 269 497 A F H X S+ 0 0 36 -4,-2.7 4,-2.0 2,-0.2 -2,-0.2 0.901 112.8 47.9 -57.5 -42.9 21.8 49.3 58.2 270 498 A F H < S+ 0 0 65 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.952 110.0 49.8 -64.7 -50.8 23.3 45.9 59.0 271 499 A T H < S+ 0 0 102 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.788 110.1 54.1 -60.5 -27.1 22.5 44.3 55.7 272 500 A A H < 0 0 82 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.984 360.0 360.0 -69.3 -56.2 24.0 47.4 54.0 273 501 A T < 0 0 102 -4,-2.0 -3,-0.0 -5,-0.1 0, 0.0 0.314 360.0 360.0 -70.2 360.0 27.4 47.2 55.7