==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER GENE REGULATION 17-DEC-98 1DBH . COMPND 2 MOLECULE: PROTEIN (HUMAN SOS 1); . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.M.SOISSON,J.KURIYAN . 340 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19193.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 253 74.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 3 0.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 35 10.3 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 . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 0.3 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 . 17 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 10.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 153 45.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 2.1 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 1 1 0 2 2 2 2 0 1 1 0 1 0 0 0 1 1 0 0 0 1 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 0 1 0 3 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 0 ANTIPARALLEL BRIDGES PER LADDER . 0 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 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 1 198 A E 0 0 241 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -17.0 2.7 -3.2 15.0 2 199 A Q - 0 0 98 4,-0.0 2,-0.1 3,-0.0 0, 0.0 -0.778 360.0-137.7 -94.6 135.7 6.0 -4.8 15.7 3 200 A T > - 0 0 76 -2,-0.4 4,-2.1 1,-0.1 5,-0.2 -0.355 29.8-102.4 -83.4 169.2 6.1 -8.4 17.0 4 201 A Y H > S+ 0 0 4 162,-0.4 4,-2.0 1,-0.2 5,-0.1 0.902 125.3 52.5 -55.3 -42.7 8.5 -9.6 19.7 5 202 A Y H > S+ 0 0 94 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.856 104.3 53.4 -65.4 -38.1 10.5 -11.1 17.0 6 203 A D H > S+ 0 0 58 2,-0.2 4,-3.1 1,-0.2 5,-0.2 0.935 108.6 51.0 -63.1 -43.4 10.8 -7.9 15.0 7 204 A L H X S+ 0 0 14 -4,-2.1 4,-2.9 1,-0.2 -2,-0.2 0.910 110.7 48.6 -60.4 -41.4 12.1 -6.1 18.0 8 205 A V H X S+ 0 0 5 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.896 112.3 47.8 -65.3 -40.6 14.7 -8.8 18.6 9 206 A K H X S+ 0 0 97 -4,-2.4 4,-1.8 2,-0.2 -2,-0.2 0.940 113.9 47.6 -64.8 -46.0 15.8 -8.7 14.9 10 207 A A H X S+ 0 0 39 -4,-3.1 4,-2.2 1,-0.2 -2,-0.2 0.929 111.7 50.9 -60.3 -45.9 16.0 -4.9 15.1 11 208 A F H X S+ 0 0 4 -4,-2.9 4,-2.9 -5,-0.2 5,-0.2 0.876 106.2 53.9 -60.7 -39.6 18.0 -5.1 18.3 12 209 A X H X S+ 0 0 21 -4,-2.2 4,-1.3 1,-0.2 -1,-0.2 0.903 110.5 46.8 -63.3 -39.7 20.5 -7.6 16.9 13 210 A A H X S+ 0 0 59 -4,-1.8 4,-1.6 2,-0.2 -1,-0.2 0.889 113.2 50.3 -67.7 -39.3 21.3 -5.3 14.0 14 211 A E H X S+ 0 0 87 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.942 110.4 46.9 -64.9 -48.4 21.5 -2.3 16.4 15 212 A I H X S+ 0 0 1 -4,-2.9 4,-2.4 1,-0.2 -1,-0.2 0.758 109.5 55.8 -68.7 -22.9 23.9 -4.0 18.8 16 213 A R H X S+ 0 0 117 -4,-1.3 4,-1.5 -5,-0.2 -1,-0.2 0.871 110.6 43.4 -74.4 -36.7 26.1 -5.2 15.9 17 214 A Q H X S+ 0 0 98 -4,-1.6 4,-2.1 -3,-0.2 -2,-0.2 0.928 115.8 50.5 -70.5 -45.1 26.5 -1.6 14.6 18 215 A Y H X S+ 0 0 7 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.901 107.4 51.7 -57.5 -48.0 27.1 -0.5 18.2 19 216 A I H X S+ 0 0 19 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.892 108.7 52.4 -58.6 -38.8 29.7 -3.1 18.8 20 217 A R H X S+ 0 0 131 -4,-1.5 4,-2.2 1,-0.2 -1,-0.2 0.907 109.2 49.7 -64.3 -39.9 31.4 -1.9 15.7 21 218 A E H X S+ 0 0 53 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.906 109.2 50.9 -65.9 -39.6 31.3 1.6 17.1 22 219 A L H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.918 110.0 51.2 -63.5 -41.0 32.8 0.4 20.4 23 220 A N H X>S+ 0 0 46 -4,-2.5 4,-3.4 2,-0.2 5,-0.6 0.909 108.6 50.5 -60.7 -43.0 35.6 -1.3 18.4 24 221 A L H X>S+ 0 0 24 -4,-2.2 4,-1.9 1,-0.2 5,-1.5 0.936 112.3 47.7 -59.0 -48.9 36.3 1.9 16.5 25 222 A I H <>S+ 0 0 0 -4,-2.4 5,-2.5 3,-0.2 -2,-0.2 0.901 119.7 38.6 -58.7 -45.9 36.5 3.8 19.8 26 223 A I H <>S+ 0 0 25 -4,-2.6 5,-1.5 3,-0.2 -2,-0.2 0.952 125.2 32.1 -74.2 -52.7 38.8 1.2 21.4 27 224 A K H <5S+ 0 0 151 -4,-3.4 -3,-0.2 -5,-0.2 -2,-0.2 0.859 131.1 29.4 -77.2 -36.5 41.1 0.2 18.6 28 225 A V T <> S+ 0 0 16 0, 0.0 4,-1.0 0, 0.0 -1,-0.3 0.804 108.3 47.9 -62.8 -28.4 47.1 5.6 20.7 33 230 A F H <4 S+ 0 0 0 -3,-1.4 7,-0.3 -4,-0.4 3,-0.3 0.901 112.6 48.4 -76.1 -41.0 46.6 7.2 24.1 34 231 A V H < S+ 0 0 62 -4,-2.1 3,-0.2 1,-0.2 -1,-0.2 0.890 109.3 55.2 -62.3 -39.9 47.2 3.8 25.8 35 232 A S H < S+ 0 0 77 -4,-2.7 2,-1.2 -5,-0.3 -1,-0.2 0.784 97.5 64.5 -64.9 -30.9 50.4 3.4 23.6 36 233 A N >X + 0 0 32 -4,-1.0 4,-2.4 -3,-0.3 3,-0.6 -0.609 59.3 165.6 -98.6 75.1 51.9 6.7 24.7 37 234 A S T 34 S+ 0 0 99 -2,-1.2 -1,-0.2 1,-0.2 -2,-0.1 0.801 72.7 58.7 -57.2 -34.1 52.5 6.0 28.4 38 235 A K T 34 S+ 0 0 211 -3,-0.2 -1,-0.2 1,-0.2 3,-0.1 0.874 113.0 36.6 -67.1 -38.4 54.8 9.1 28.7 39 236 A L T <4 S+ 0 0 36 -3,-0.6 2,-0.5 1,-0.2 -2,-0.2 0.842 123.2 37.1 -83.8 -37.0 52.1 11.5 27.5 40 237 A F < - 0 0 5 -4,-2.4 -1,-0.2 -7,-0.3 2,-0.0 -0.968 69.6-150.2-126.2 126.3 49.0 10.0 29.1 41 238 A S > - 0 0 57 -2,-0.5 4,-1.8 -3,-0.1 5,-0.2 -0.201 40.6 -96.4 -77.4 175.3 48.8 8.3 32.5 42 239 A A H > S+ 0 0 84 1,-0.2 4,-2.9 2,-0.2 5,-0.1 0.927 127.6 50.9 -59.8 -43.6 46.3 5.5 33.2 43 240 A N H > S+ 0 0 112 2,-0.2 4,-3.8 1,-0.2 -1,-0.2 0.867 103.0 57.4 -61.9 -41.1 44.0 8.1 34.7 44 241 A D H > S+ 0 0 24 2,-0.2 4,-0.5 1,-0.2 -1,-0.2 0.947 112.8 41.3 -55.4 -48.2 44.2 10.4 31.7 45 242 A V H >X S+ 0 0 12 -4,-1.8 4,-3.1 1,-0.2 3,-1.7 0.959 114.8 52.2 -61.7 -50.5 42.9 7.6 29.5 46 243 A E H 3X S+ 0 0 57 -4,-2.9 4,-2.3 1,-0.3 -2,-0.2 0.891 105.2 55.9 -50.7 -46.6 40.4 6.7 32.2 47 244 A N H 3< S+ 0 0 59 -4,-3.8 -1,-0.3 1,-0.2 -2,-0.2 0.575 117.2 34.5 -66.7 -12.3 39.1 10.3 32.3 48 245 A I H << S+ 0 0 4 -3,-1.7 -2,-0.2 -4,-0.5 -1,-0.2 0.777 130.9 25.0-107.5 -46.8 38.4 10.2 28.6 49 246 A F H >< S+ 0 0 0 -4,-3.1 3,-1.9 1,-0.2 -3,-0.2 0.548 79.8 178.8-101.2 -8.3 37.3 6.7 27.8 50 247 A S T 3< - 0 0 3 -4,-2.3 3,-0.5 -5,-0.5 -1,-0.2 -0.006 68.2 -11.9 45.3-138.5 35.9 5.5 31.2 51 248 A R T 3> S+ 0 0 75 46,-0.2 4,-2.3 1,-0.2 3,-0.5 0.156 90.6 129.1 -78.4 19.9 34.5 1.9 31.2 52 249 A I H <> S+ 0 0 0 -3,-1.9 4,-1.7 1,-0.2 -1,-0.2 0.830 71.4 51.1 -46.8 -41.3 34.5 1.6 27.4 53 250 A V H > S+ 0 0 54 -3,-0.5 4,-2.1 2,-0.2 -1,-0.2 0.929 109.5 47.8 -65.3 -45.6 36.3 -1.7 27.5 54 251 A D H > S+ 0 0 62 -3,-0.5 4,-2.7 1,-0.2 5,-0.2 0.924 110.7 53.2 -61.4 -42.3 33.9 -3.3 30.0 55 252 A I H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.859 107.6 51.0 -60.7 -36.4 31.0 -2.1 28.0 56 253 A H H X S+ 0 0 39 -4,-1.7 4,-2.3 -5,-0.3 -1,-0.2 0.908 111.0 48.0 -67.5 -41.6 32.4 -3.7 24.9 57 254 A E H X S+ 0 0 129 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.914 111.9 49.2 -65.6 -42.2 32.9 -7.0 26.7 58 255 A L H X S+ 0 0 16 -4,-2.7 4,-2.8 1,-0.2 -2,-0.2 0.916 111.8 50.4 -61.9 -44.7 29.4 -7.0 28.1 59 256 A S H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 5,-0.2 0.890 109.3 48.0 -63.1 -43.7 28.0 -6.2 24.6 60 257 A V H X S+ 0 0 71 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.901 113.7 49.8 -65.4 -37.7 29.8 -9.0 22.8 61 258 A K H X S+ 0 0 126 -4,-2.0 4,-2.2 -5,-0.2 -2,-0.2 0.943 111.0 48.5 -64.2 -46.8 28.6 -11.4 25.6 62 259 A L H X S+ 0 0 0 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.942 113.7 45.7 -58.9 -50.4 25.0 -10.2 25.3 63 260 A L H X S+ 0 0 16 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.898 110.5 55.4 -61.4 -41.4 24.9 -10.5 21.4 64 261 A G H X S+ 0 0 20 -4,-2.2 4,-2.1 -5,-0.2 -1,-0.2 0.923 109.4 44.5 -58.2 -47.8 26.6 -13.9 21.6 65 262 A H H X S+ 0 0 76 -4,-2.2 4,-2.7 1,-0.2 -1,-0.2 0.944 113.3 50.9 -62.8 -47.2 24.0 -15.4 24.0 66 263 A I H X S+ 0 0 2 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.864 109.3 52.7 -59.6 -35.6 21.2 -13.9 21.9 67 264 A E H X S+ 0 0 66 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.927 110.2 45.5 -67.5 -44.6 22.7 -15.4 18.8 68 265 A D H X S+ 0 0 97 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.948 111.2 54.0 -62.9 -47.8 22.9 -18.9 20.2 69 266 A T H < S+ 0 0 36 -4,-2.7 4,-0.4 1,-0.2 -2,-0.2 0.939 109.6 47.7 -50.0 -53.5 19.3 -18.7 21.5 70 267 A V H >< S+ 0 0 34 -4,-2.2 3,-1.4 1,-0.2 -1,-0.2 0.927 113.4 46.3 -54.7 -51.2 18.0 -17.7 18.1 71 268 A E H 3< S+ 0 0 174 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.828 113.4 50.1 -62.8 -32.2 19.8 -20.5 16.3 72 269 A X T 3< S+ 0 0 150 -4,-2.5 2,-0.8 -5,-0.2 -1,-0.3 0.391 84.2 112.7 -87.7 2.3 18.7 -23.0 18.9 73 270 A T < - 0 0 41 -3,-1.4 2,-0.1 -4,-0.4 -3,-0.0 -0.682 54.5-159.3 -81.9 111.3 15.1 -21.9 18.7 74 271 A D > - 0 0 135 -2,-0.8 3,-2.0 1,-0.1 5,-0.1 -0.338 36.4 -95.7 -84.3 169.6 13.0 -24.7 17.2 75 272 A E T 3 S+ 0 0 197 1,-0.3 -1,-0.1 -2,-0.1 -2,-0.1 0.603 114.2 80.9 -60.4 -10.9 9.6 -24.4 15.4 76 273 A G T 3 S+ 0 0 77 2,-0.0 -1,-0.3 0, 0.0 -3,-0.0 0.687 82.0 71.4 -70.8 -18.9 8.1 -25.2 18.8 77 274 A S S < S- 0 0 50 -3,-2.0 92,-0.1 1,-0.1 -4,-0.0 -0.794 77.6-136.4-103.0 143.7 8.5 -21.7 20.1 78 275 A P S S- 0 0 86 0, 0.0 -73,-0.1 0, 0.0 -1,-0.1 0.702 90.4 -16.7 -65.3 -22.6 6.4 -18.7 18.9 79 276 A H S S- 0 0 10 -5,-0.1 -5,-0.1 -75,-0.1 89,-0.0 -0.920 93.4 -71.0-173.8 156.4 9.6 -16.6 18.9 80 277 A P - 0 0 7 0, 0.0 2,-1.0 0, 0.0 -10,-0.1 -0.382 49.5-128.9 -59.7 140.7 13.1 -17.0 20.3 81 278 A L + 0 0 43 1,-0.2 3,-0.3 -12,-0.1 4,-0.2 -0.799 40.2 161.3 -97.1 99.1 12.9 -16.5 24.0 82 279 A V > + 0 0 1 -2,-1.0 4,-1.6 1,-0.2 3,-0.4 0.426 46.8 99.3 -97.1 -0.8 15.6 -13.9 24.9 83 280 A G H > S+ 0 0 0 1,-0.2 4,-2.7 2,-0.2 3,-0.2 0.906 84.3 50.4 -50.9 -45.6 14.2 -12.9 28.3 84 281 A S H > S+ 0 0 47 -3,-0.3 4,-3.0 1,-0.2 5,-0.3 0.838 100.8 62.5 -63.1 -36.8 16.7 -15.1 30.1 85 282 A C H > S+ 0 0 4 -3,-0.4 4,-1.1 -4,-0.2 -1,-0.2 0.934 113.4 36.5 -54.9 -46.1 19.6 -13.7 28.1 86 283 A F H X S+ 0 0 2 -4,-1.6 4,-2.9 -3,-0.2 5,-0.3 0.918 115.4 53.4 -73.0 -44.7 18.8 -10.3 29.7 87 284 A E H X S+ 0 0 26 -4,-2.7 4,-2.4 1,-0.2 5,-0.2 0.906 105.1 54.3 -59.0 -44.7 17.8 -11.7 33.1 88 285 A D H X S+ 0 0 87 -4,-3.0 4,-0.8 1,-0.2 -1,-0.2 0.913 114.8 41.4 -56.5 -43.4 21.0 -13.7 33.6 89 286 A L H ><>S+ 0 0 18 -4,-1.1 5,-2.3 -5,-0.3 3,-0.7 0.924 113.9 49.9 -71.4 -45.3 23.1 -10.5 33.0 90 287 A A H ><5S+ 0 0 2 -4,-2.9 3,-1.6 1,-0.2 -2,-0.2 0.851 106.1 58.1 -62.2 -34.0 20.9 -8.1 35.0 91 288 A E H 3<5S+ 0 0 112 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.800 105.4 49.5 -67.6 -27.2 21.0 -10.5 37.9 92 289 A E T <<5S- 0 0 141 -4,-0.8 -1,-0.3 -3,-0.7 -2,-0.2 0.199 114.8-118.6 -95.0 16.1 24.8 -10.3 38.0 93 290 A L T X 5 + 0 0 100 -3,-1.6 3,-1.3 1,-0.1 -3,-0.2 0.833 61.2 154.4 50.6 35.4 24.6 -6.5 37.9 94 291 A A T 3 < + 0 0 27 -5,-2.3 -4,-0.2 1,-0.2 -1,-0.1 0.664 62.4 59.9 -67.8 -17.9 26.4 -6.7 34.6 95 292 A F T >> S+ 0 0 2 -6,-0.2 3,-1.5 1,-0.2 4,-0.6 0.458 73.9 97.5 -90.9 -0.1 25.0 -3.4 33.4 96 293 A D H X> + 0 0 65 -3,-1.3 4,-1.6 1,-0.3 3,-1.4 0.867 69.8 69.5 -53.9 -40.7 26.4 -1.3 36.3 97 294 A P H 3> S+ 0 0 29 0, 0.0 4,-2.8 0, 0.0 -1,-0.3 0.817 92.0 61.9 -50.3 -30.5 29.4 -0.2 34.2 98 295 A Y H <> S+ 0 0 2 -3,-1.5 4,-2.9 2,-0.2 5,-0.2 0.853 101.2 49.9 -65.3 -35.8 27.0 1.9 32.1 99 296 A E H < S+ 0 0 46 -4,-2.4 3,-0.6 1,-0.2 -2,-0.2 0.945 120.8 40.7 -70.6 -46.5 32.1 10.0 33.8 105 302 A I H 3< S+ 0 0 0 -4,-3.1 -2,-0.2 1,-0.2 -3,-0.2 0.811 118.2 44.4 -74.4 -31.6 31.1 11.1 30.3 106 303 A L T 3< S+ 0 0 7 -4,-2.5 -1,-0.2 -5,-0.3 93,-0.2 0.334 79.3 127.2 -97.2 8.5 28.2 13.3 31.2 107 304 A R S X S- 0 0 94 -3,-0.6 3,-1.9 -4,-0.4 4,-0.3 -0.376 72.8-115.0 -60.6 143.2 29.9 15.1 34.1 108 305 A P T 3 S+ 0 0 77 0, 0.0 3,-0.3 0, 0.0 4,-0.3 0.831 112.1 46.8 -52.5 -38.3 29.6 18.9 33.5 109 306 A G T 3> S+ 0 0 33 1,-0.2 4,-2.1 2,-0.1 5,-0.2 0.304 79.8 109.6 -91.8 15.1 33.3 19.4 33.1 110 307 A F H <> S+ 0 0 3 -3,-1.9 4,-2.0 1,-0.2 -1,-0.2 0.917 77.6 43.0 -53.4 -57.9 34.0 16.5 30.7 111 308 A H H > S+ 0 0 52 -3,-0.3 4,-2.9 -4,-0.3 5,-0.2 0.915 112.4 52.9 -59.7 -46.8 34.7 18.4 27.5 112 309 A D H > S+ 0 0 118 -4,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.938 113.0 44.2 -53.8 -50.5 36.9 21.1 29.1 113 310 A R H X S+ 0 0 144 -4,-2.1 4,-1.2 1,-0.2 -1,-0.2 0.839 111.3 55.9 -63.2 -33.8 39.1 18.4 30.7 114 311 A F H X S+ 0 0 2 -4,-2.0 4,-1.1 -5,-0.2 3,-0.4 0.950 108.8 46.0 -62.8 -50.2 39.1 16.5 27.4 115 312 A L H >X S+ 0 0 54 -4,-2.9 4,-2.0 1,-0.2 3,-0.6 0.898 107.2 56.9 -60.6 -43.4 40.5 19.5 25.5 116 313 A S H 3X S+ 0 0 67 -4,-2.2 4,-0.9 1,-0.3 -1,-0.2 0.838 105.1 53.7 -56.8 -33.4 43.2 20.2 28.2 117 314 A Q H 3< S+ 0 0 10 -4,-1.2 -1,-0.3 -3,-0.4 -2,-0.2 0.816 111.4 44.8 -71.6 -30.4 44.3 16.6 27.5 118 315 A L H << S+ 0 0 5 -4,-1.1 6,-0.4 -3,-0.6 -2,-0.2 0.712 117.1 44.8 -85.4 -21.7 44.6 17.4 23.8 119 316 A S H < S+ 0 0 93 -4,-2.0 -2,-0.2 4,-0.2 -1,-0.2 0.459 84.3 109.8-103.8 -1.7 46.3 20.7 24.3 120 317 A K S >X S- 0 0 53 -4,-0.9 3,-2.2 -5,-0.2 4,-0.6 -0.287 89.4 -55.8 -68.9 162.4 48.9 19.9 26.9 121 318 A P T 34 S- 0 0 118 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 -0.060 121.5 -5.2 -44.3 121.7 52.6 19.8 25.9 122 319 A G T 3> S+ 0 0 42 -3,-0.2 4,-1.8 1,-0.1 5,-0.1 0.316 102.6 107.1 77.9 -8.4 53.3 17.5 22.9 123 320 A A H <> S+ 0 0 0 -3,-2.2 4,-2.6 2,-0.2 5,-0.2 0.971 78.4 45.8 -67.3 -55.2 49.8 16.1 22.8 124 321 A A H X S+ 0 0 25 -4,-0.6 4,-1.9 -6,-0.4 -1,-0.2 0.886 115.5 48.6 -55.5 -41.1 48.6 17.8 19.6 125 322 A L H > S+ 0 0 126 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.869 110.4 50.9 -68.9 -36.0 51.8 16.9 17.8 126 323 A Y H X S+ 0 0 45 -4,-1.8 4,-0.7 2,-0.2 -2,-0.2 0.924 109.3 50.5 -66.8 -43.2 51.6 13.3 18.9 127 324 A L H >X S+ 0 0 0 -4,-2.6 3,-0.8 1,-0.2 4,-0.7 0.891 109.2 51.5 -61.9 -40.3 48.0 13.0 17.7 128 325 A Q H >< S+ 0 0 104 -4,-1.9 3,-0.9 1,-0.2 -1,-0.2 0.881 103.8 58.6 -65.0 -35.6 49.0 14.4 14.3 129 326 A S H 3< S+ 0 0 87 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.692 91.4 70.7 -67.5 -18.0 51.9 11.9 14.0 130 327 A I H << S- 0 0 68 -3,-0.8 -1,-0.2 -4,-0.7 2,-0.2 0.888 118.4 -74.6 -65.9 -36.7 49.4 9.1 14.3 131 328 A G XX - 0 0 34 -3,-0.9 3,-1.7 -4,-0.7 4,-0.5 -0.800 62.0 -46.5 155.2 164.4 48.1 9.9 10.8 132 329 A E T 34 S+ 0 0 188 1,-0.2 -4,-0.0 -2,-0.2 -3,-0.0 -0.280 121.1 10.2 -57.6 135.7 46.2 12.3 8.7 133 330 A G T 3> S+ 0 0 12 1,-0.1 4,-2.7 158,-0.1 -1,-0.2 0.207 95.6 106.5 81.7 -15.2 42.8 13.2 10.2 134 331 A F H <> S+ 0 0 18 -3,-1.7 4,-3.2 2,-0.2 5,-0.2 0.944 79.4 48.2 -62.9 -49.3 43.4 11.6 13.6 135 332 A K H X S+ 0 0 14 -4,-0.5 4,-1.9 -8,-0.3 -1,-0.2 0.878 116.7 43.6 -59.1 -40.4 43.8 14.9 15.5 136 333 A E H >>S+ 0 0 38 2,-0.2 4,-2.6 1,-0.2 5,-0.5 0.900 114.5 49.3 -71.5 -42.8 40.7 16.3 13.9 137 334 A A H X>S+ 0 0 12 -4,-2.7 5,-2.3 1,-0.2 4,-2.1 0.934 112.4 48.9 -62.3 -45.2 38.7 13.1 14.4 138 335 A V H <5S+ 0 0 0 -4,-3.2 -2,-0.2 3,-0.2 -1,-0.2 0.921 116.6 40.9 -59.9 -48.0 39.8 12.9 18.1 139 336 A Q H <5S+ 0 0 37 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.894 130.3 21.0 -71.4 -43.1 38.9 16.5 18.9 140 337 A Y H <5S+ 0 0 7 -4,-2.6 -3,-0.2 -5,-0.2 -2,-0.2 0.686 131.4 31.8-104.8 -18.5 35.6 17.0 17.0 141 338 A V T >X< S+ 0 0 34 -4,-1.9 3,-1.9 1,-0.3 -1,-0.2 0.864 99.9 67.5 -57.1 -37.1 31.0 8.8 19.6 146 343 A L T 3< S+ 0 0 0 -4,-2.9 -1,-0.3 1,-0.3 4,-0.2 0.612 93.2 60.4 -60.9 -11.6 31.6 8.6 23.4 147 344 A L T X> S+ 0 0 2 -3,-2.1 4,-1.7 -5,-0.2 3,-1.3 0.660 78.2 91.4 -87.8 -19.3 27.9 9.2 23.9 148 345 A A H <> S+ 0 0 11 -3,-1.9 4,-2.8 -4,-0.4 5,-0.2 0.850 80.9 54.8 -44.6 -48.5 26.9 6.1 22.0 149 346 A P H 3> S+ 0 0 0 0, 0.0 4,-2.5 0, 0.0 -1,-0.3 0.850 106.9 53.1 -58.6 -32.4 26.9 3.8 25.2 150 347 A V H <> S+ 0 0 1 -3,-1.3 4,-2.2 -4,-0.2 -2,-0.2 0.964 111.2 43.4 -68.4 -49.8 24.5 6.2 26.8 151 348 A Y H X S+ 0 0 66 -4,-1.7 4,-1.9 1,-0.2 -1,-0.2 0.939 115.6 51.3 -58.0 -46.9 22.0 6.2 23.9 152 349 A H H X S+ 0 0 19 -4,-2.8 4,-1.0 1,-0.2 -1,-0.2 0.910 111.7 43.9 -58.1 -48.6 22.3 2.4 23.7 153 350 A C H X S+ 0 0 1 -4,-2.5 4,-1.1 1,-0.2 3,-0.3 0.857 109.8 56.3 -69.4 -33.7 21.7 1.7 27.4 154 351 A L H X S+ 0 0 58 -4,-2.2 4,-0.9 1,-0.2 3,-0.2 0.882 104.6 53.9 -64.4 -36.1 18.8 4.1 27.6 155 352 A H H X S+ 0 0 66 -4,-1.9 4,-2.9 1,-0.2 -1,-0.2 0.795 96.9 67.2 -68.4 -27.4 17.1 2.2 24.8 156 353 A Y H X S+ 0 0 2 -4,-1.0 4,-3.0 -3,-0.3 5,-0.3 0.936 96.1 54.3 -55.0 -50.2 17.5 -1.1 26.7 157 354 A F H X S+ 0 0 24 -4,-1.1 4,-1.1 -3,-0.2 -1,-0.2 0.881 114.1 40.9 -53.3 -41.1 15.1 0.2 29.3 158 355 A E H X S+ 0 0 99 -4,-0.9 4,-2.1 2,-0.2 -1,-0.2 0.880 112.8 54.8 -76.0 -38.1 12.5 0.8 26.6 159 356 A L H X S+ 0 0 5 -4,-2.9 4,-2.5 1,-0.2 -2,-0.2 0.922 106.8 50.5 -59.3 -48.8 13.3 -2.4 24.7 160 357 A L H X S+ 0 0 2 -4,-3.0 4,-2.2 1,-0.2 -1,-0.2 0.865 109.0 51.8 -61.1 -37.2 12.8 -4.6 27.8 161 358 A K H X S+ 0 0 134 -4,-1.1 4,-2.2 -5,-0.3 -1,-0.2 0.940 111.4 46.6 -65.2 -47.0 9.4 -3.0 28.5 162 359 A Q H X S+ 0 0 44 -4,-2.1 4,-1.7 1,-0.2 -2,-0.2 0.880 112.3 50.0 -63.7 -39.5 8.2 -3.7 24.9 163 360 A L H X S+ 0 0 2 -4,-2.5 4,-1.6 2,-0.2 -1,-0.2 0.924 109.1 52.3 -64.3 -43.6 9.5 -7.3 24.9 164 361 A E H < S+ 0 0 36 -4,-2.2 3,-0.3 1,-0.2 -2,-0.2 0.925 111.8 46.0 -56.9 -47.4 7.7 -7.9 28.2 165 362 A E H < S+ 0 0 155 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.808 119.6 40.6 -67.2 -30.3 4.4 -6.6 26.8 166 363 A K H < S+ 0 0 66 -4,-1.7 -162,-0.4 -5,-0.2 -1,-0.2 0.525 81.9 125.2 -98.4 -7.0 4.8 -8.6 23.6 167 364 A S < - 0 0 7 -4,-1.6 -86,-0.0 -3,-0.3 -3,-0.0 -0.284 42.0-164.6 -59.4 136.3 6.1 -11.9 24.9 168 365 A E S S+ 0 0 148 -89,-0.0 2,-0.4 1,-0.0 -1,-0.1 0.163 71.2 73.3-103.6 12.4 4.1 -14.9 23.9 169 366 A D > - 0 0 47 1,-0.1 4,-3.0 -92,-0.1 5,-0.2 -0.994 68.7-149.8-132.1 126.0 5.7 -17.2 26.5 170 367 A Q H > S+ 0 0 113 -2,-0.4 4,-2.1 1,-0.2 -1,-0.1 0.863 100.5 48.7 -62.9 -38.8 4.9 -16.9 30.2 171 368 A E H > S+ 0 0 158 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.894 113.2 48.4 -68.8 -38.2 8.3 -18.0 31.4 172 369 A D H > S+ 0 0 4 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.938 109.7 52.5 -65.7 -45.9 9.9 -15.5 29.0 173 370 A K H X S+ 0 0 43 -4,-3.0 4,-2.5 1,-0.2 -2,-0.2 0.914 108.1 51.8 -54.9 -45.6 7.6 -12.8 30.2 174 371 A E H X S+ 0 0 82 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.910 107.5 50.7 -58.5 -47.8 8.6 -13.5 33.8 175 372 A C H X S+ 0 0 28 -4,-2.0 4,-2.5 1,-0.2 -1,-0.2 0.926 111.4 49.7 -56.4 -46.4 12.4 -13.3 33.0 176 373 A L H X S+ 0 0 0 -4,-2.3 4,-2.8 2,-0.2 -2,-0.2 0.918 108.3 51.3 -59.9 -46.8 11.8 -9.9 31.3 177 374 A K H X S+ 0 0 84 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.920 112.3 48.5 -55.5 -43.9 9.8 -8.5 34.3 178 375 A Q H X S+ 0 0 94 -4,-2.3 4,-2.9 2,-0.2 -2,-0.2 0.887 109.5 50.8 -64.6 -41.4 12.7 -9.6 36.5 179 376 A A H X S+ 0 0 0 -4,-2.5 4,-1.0 2,-0.2 -2,-0.2 0.955 109.4 51.7 -61.8 -47.9 15.3 -8.0 34.3 180 377 A I H >< S+ 0 0 42 -4,-2.8 3,-0.9 1,-0.2 4,-0.4 0.933 112.5 46.0 -52.7 -48.6 13.4 -4.8 34.3 181 378 A T H >< S+ 0 0 94 -4,-2.3 3,-1.8 1,-0.2 4,-0.3 0.934 109.1 53.1 -60.7 -50.4 13.2 -4.9 38.1 182 379 A A H 3< S+ 0 0 37 -4,-2.9 4,-0.3 1,-0.3 -1,-0.2 0.607 109.4 52.2 -62.7 -12.4 16.9 -5.7 38.5 183 380 A L T S+ 0 0 85 -3,-1.8 4,-2.5 -4,-0.4 5,-0.3 0.848 82.7 50.7 -55.7 -38.7 15.8 -0.1 38.2 185 382 A N H > S+ 0 0 129 -4,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.954 111.2 46.8 -65.5 -48.9 18.8 1.3 40.1 186 383 A V H > S+ 0 0 3 -4,-0.3 4,-2.5 1,-0.2 5,-0.2 0.907 114.4 50.2 -57.6 -42.1 21.0 1.7 37.0 187 384 A Q H X S+ 0 0 58 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.927 111.8 42.9 -65.5 -49.6 18.0 3.4 35.2 188 385 A S H X S+ 0 0 64 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.881 114.6 54.5 -66.4 -33.2 17.2 5.9 37.9 189 386 A G H X S+ 0 0 13 -4,-2.4 4,-1.5 -5,-0.3 -2,-0.2 0.942 113.0 39.9 -63.4 -47.0 20.9 6.5 38.3 190 387 A X H X S+ 0 0 0 -4,-2.5 4,-3.0 1,-0.2 -2,-0.2 0.866 110.4 61.1 -70.0 -34.2 21.3 7.3 34.6 191 388 A E H X S+ 0 0 125 -4,-2.7 4,-1.4 1,-0.2 -1,-0.2 0.905 104.5 47.7 -58.5 -43.2 18.1 9.2 34.6 192 389 A K H X S+ 0 0 164 -4,-2.0 4,-0.7 1,-0.2 -1,-0.2 0.915 114.2 47.5 -65.0 -41.9 19.4 11.7 37.1 193 390 A I H < S+ 0 0 23 -4,-1.5 3,-0.5 1,-0.2 6,-0.2 0.911 114.6 45.2 -65.1 -43.5 22.6 12.1 35.2 194 391 A C H < S+ 0 0 15 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.640 103.3 61.9 -78.6 -17.3 21.0 12.6 31.8 195 392 A S H < S+ 0 0 77 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.699 75.2 108.2 -83.5 -19.7 18.2 15.0 32.8 196 393 A K S X S- 0 0 119 -4,-0.7 4,-2.9 -3,-0.5 5,-0.2 -0.311 83.6-112.2 -57.1 141.5 20.7 17.8 33.9 197 394 A S H > S+ 0 0 94 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.845 110.2 46.0 -45.7 -54.9 20.6 20.6 31.4 198 395 A L H > S+ 0 0 103 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.963 116.4 44.7 -58.4 -53.2 24.1 20.3 29.9 199 396 A A H > S+ 0 0 2 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.953 111.6 54.2 -54.4 -50.9 23.9 16.5 29.4 200 397 A K H X S+ 0 0 138 -4,-2.9 4,-1.8 1,-0.2 -1,-0.2 0.861 110.1 47.4 -51.5 -39.9 20.4 16.9 28.0 201 398 A R H X S+ 0 0 173 -4,-2.1 4,-2.1 -5,-0.2 -1,-0.2 0.891 111.6 50.2 -70.7 -39.9 21.7 19.4 25.5 202 399 A R H X S+ 0 0 45 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.951 111.9 46.5 -63.3 -49.9 24.7 17.1 24.5 203 400 A L H < S+ 0 0 19 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.893 114.0 48.3 -59.3 -41.9 22.5 14.0 24.0 204 401 A S H >< S+ 0 0 89 -4,-1.8 3,-1.0 -5,-0.3 -1,-0.2 0.870 107.8 58.7 -65.4 -35.7 20.0 16.1 22.0 205 402 A E H 3< S+ 0 0 75 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.918 115.5 31.1 -59.5 -47.9 23.0 17.4 20.1 206 403 A S T 3< 0 0 32 -4,-2.0 -1,-0.2 1,-0.1 -2,-0.2 0.063 360.0 360.0-102.2 24.0 24.2 14.0 18.9 207 404 A A < 0 0 110 -3,-1.0 -2,-0.1 -5,-0.1 -1,-0.1 0.981 360.0 360.0 -81.8 360.0 20.8 12.3 18.7 208 ! 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 0.0 209 418 A A > 0 0 129 0, 0.0 3,-0.7 0, 0.0 4,-0.2 0.000 360.0 360.0 360.0 94.8 11.7 10.9 1.6 210 419 A I T 3> + 0 0 86 1,-0.2 4,-1.9 2,-0.1 5,-0.2 0.064 360.0 115.7 -86.9 24.7 13.8 13.4 -0.5 211 420 A K H 3> S+ 0 0 167 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.823 74.7 50.7 -62.5 -32.4 10.9 15.9 0.0 212 421 A K H <> S+ 0 0 143 -3,-0.7 4,-2.1 2,-0.2 -1,-0.2 0.909 105.5 54.7 -72.5 -43.6 13.2 18.1 2.0 213 422 A X H > S+ 0 0 6 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.914 113.8 40.7 -56.8 -45.9 16.0 18.1 -0.7 214 423 A N H X S+ 0 0 83 -4,-1.9 4,-1.4 1,-0.2 -1,-0.2 0.828 113.3 54.9 -72.6 -31.5 13.5 19.3 -3.4 215 424 A E H < S+ 0 0 139 -4,-1.4 -2,-0.2 -5,-0.2 -1,-0.2 0.792 110.6 46.7 -70.9 -28.0 11.9 21.7 -1.0 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