==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER BINDING PROTEIN 15-MAR-96 1VIN . COMPND 2 MOLECULE: CYCLIN A; . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR M.E.M.NOBLE,J.A.E.ENDICOTT,N.R.BROWN . 252 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12255.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 176 69.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 5 2.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 35 13.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 129 51.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 2.4 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 1 1 0 2 1 0 0 0 1 1 1 1 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 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 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 1 181 A D >> 0 0 143 0, 0.0 4,-1.6 0, 0.0 3,-0.6 0.000 360.0 360.0 360.0 140.8 38.9 10.5 43.0 2 182 A I H 3> + 0 0 98 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.819 360.0 59.6 -51.5 -38.9 40.1 12.9 40.3 3 183 A H H 3> S+ 0 0 13 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.929 106.7 44.5 -60.4 -51.1 37.7 15.6 41.3 4 184 A T H <> S+ 0 0 60 -3,-0.6 4,-1.6 2,-0.2 -1,-0.2 0.836 112.2 54.2 -59.6 -37.3 39.0 16.1 44.8 5 185 A Y H X S+ 0 0 116 -4,-1.6 4,-3.2 2,-0.2 3,-0.5 0.962 109.1 47.8 -61.0 -51.2 42.6 15.9 43.5 6 186 A L H X S+ 0 0 4 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.871 109.8 53.0 -58.7 -37.5 41.8 18.7 41.1 7 187 A R H X S+ 0 0 70 -4,-2.1 4,-0.6 -5,-0.2 -1,-0.2 0.809 113.5 43.0 -70.6 -29.6 40.2 20.8 43.8 8 188 A E H >X S+ 0 0 117 -4,-1.6 4,-1.5 -3,-0.5 3,-0.6 0.928 115.4 48.6 -80.1 -47.5 43.2 20.5 46.0 9 189 A M H 3X S+ 0 0 48 -4,-3.2 4,-1.7 1,-0.2 -2,-0.2 0.818 103.2 60.4 -62.2 -34.2 45.8 21.1 43.2 10 190 A E H 3X S+ 0 0 2 -4,-2.3 4,-0.6 -5,-0.2 -1,-0.2 0.839 105.7 47.7 -65.6 -33.0 44.0 24.2 41.9 11 191 A V H << S+ 0 0 68 -4,-0.6 3,-0.4 -3,-0.6 -1,-0.2 0.876 113.8 48.2 -72.0 -37.6 44.5 26.0 45.2 12 192 A K H < S+ 0 0 161 -4,-1.5 -2,-0.2 1,-0.2 -1,-0.2 0.728 116.3 44.0 -72.5 -24.7 48.1 24.9 45.2 13 193 A C H < S+ 0 0 10 -4,-1.7 -1,-0.2 -5,-0.1 -2,-0.2 0.433 84.2 120.8-101.4 0.5 48.6 26.0 41.6 14 194 A K < - 0 0 118 -4,-0.6 3,-0.1 -3,-0.4 157,-0.1 -0.387 58.8-128.1 -71.8 136.2 46.9 29.4 41.7 15 195 A P - 0 0 23 0, 0.0 2,-0.4 0, 0.0 46,-0.2 -0.325 40.5 -81.9 -75.5 165.7 48.8 32.5 40.9 16 196 A K > - 0 0 144 44,-0.4 3,-1.4 1,-0.1 4,-0.2 -0.546 39.1-137.5 -69.6 125.5 48.8 35.5 43.2 17 197 A V T 3 S+ 0 0 89 -2,-0.4 3,-0.3 1,-0.3 -1,-0.1 0.888 97.2 31.6 -52.2 -49.2 45.6 37.5 42.6 18 198 A G T > S+ 0 0 37 1,-0.2 3,-0.9 2,-0.1 4,-0.5 -0.177 77.1 125.2-106.1 44.1 47.1 41.0 42.7 19 199 A Y G X + 0 0 8 -3,-1.4 3,-1.4 1,-0.2 4,-0.4 0.851 62.9 70.2 -68.9 -31.4 50.6 40.2 41.3 20 200 A M G > S+ 0 0 22 -3,-0.3 3,-0.8 1,-0.3 -1,-0.2 0.744 88.0 64.2 -59.4 -24.1 50.3 42.8 38.6 21 201 A K G < S+ 0 0 197 -3,-0.9 -1,-0.3 1,-0.2 -2,-0.2 0.830 101.3 50.4 -70.8 -28.5 50.5 45.6 41.1 22 202 A K G < S+ 0 0 178 -3,-1.4 -1,-0.2 -4,-0.5 -2,-0.2 0.488 87.1 100.1 -87.5 -4.1 54.0 44.6 42.0 23 203 A Q < - 0 0 18 -3,-0.8 44,-0.0 -4,-0.4 46,-0.0 -0.763 54.2-167.9 -86.2 116.2 55.1 44.6 38.3 24 204 A P S S+ 0 0 113 0, 0.0 -1,-0.1 0, 0.0 45,-0.1 0.707 81.5 28.1 -76.8 -21.0 57.0 47.8 37.5 25 205 A D S S+ 0 0 46 43,-0.5 2,-0.3 2,-0.0 45,-0.2 0.601 110.4 61.8-117.7 -18.7 57.1 47.5 33.7 26 206 A I - 0 0 5 42,-0.2 2,-0.3 -6,-0.1 -3,-0.1 -0.766 56.5-162.7-114.9 159.4 54.1 45.5 32.6 27 207 A T > - 0 0 69 -2,-0.3 4,-2.1 1,-0.1 3,-0.3 -0.833 38.5-102.4-131.4 170.4 50.3 45.9 32.9 28 208 A N H > S+ 0 0 57 -2,-0.3 4,-2.7 1,-0.2 136,-0.2 0.875 121.7 58.1 -56.9 -39.7 47.0 43.8 32.6 29 209 A S H > S+ 0 0 85 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.871 104.8 48.1 -59.1 -41.3 46.6 45.3 29.1 30 210 A M H > S+ 0 0 49 -3,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.930 111.1 52.0 -66.0 -41.9 50.0 43.9 28.0 31 211 A R H X S+ 0 0 6 -4,-2.1 4,-2.5 1,-0.2 5,-0.2 0.905 105.5 55.3 -61.7 -40.4 49.0 40.5 29.4 32 212 A A H X S+ 0 0 5 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.924 109.3 46.3 -60.0 -44.7 45.7 40.6 27.5 33 213 A I H X S+ 0 0 101 -4,-1.8 4,-2.1 1,-0.2 -1,-0.2 0.940 111.7 52.3 -64.2 -45.8 47.5 41.1 24.2 34 214 A L H X S+ 0 0 12 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.921 111.0 45.6 -56.0 -49.4 50.0 38.3 25.0 35 215 A V H X S+ 0 0 2 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.920 111.3 53.2 -62.7 -40.7 47.3 35.8 25.8 36 216 A D H X S+ 0 0 18 -4,-2.3 4,-1.5 -5,-0.2 -1,-0.2 0.863 107.8 51.8 -60.9 -37.0 45.4 36.7 22.7 37 217 A W H X S+ 0 0 42 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.896 106.6 52.6 -70.2 -38.8 48.5 36.1 20.7 38 218 A L H X S+ 0 0 0 -4,-2.0 4,-3.0 1,-0.2 5,-0.2 0.848 104.2 56.3 -66.5 -34.5 49.0 32.6 22.2 39 219 A V H X S+ 0 0 1 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.935 108.3 48.8 -61.0 -41.1 45.4 31.8 21.2 40 220 A E H X S+ 0 0 96 -4,-1.5 4,-2.5 1,-0.2 -2,-0.2 0.929 111.4 49.3 -61.5 -45.8 46.6 32.8 17.7 41 221 A V H X S+ 0 0 2 -4,-2.4 4,-2.6 1,-0.2 5,-0.2 0.918 109.3 50.9 -58.9 -48.3 49.7 30.5 18.0 42 222 A G H <>S+ 0 0 10 -4,-3.0 5,-2.7 2,-0.2 4,-0.4 0.884 110.0 51.1 -58.5 -38.6 47.6 27.6 19.3 43 223 A E H ><5S+ 0 0 89 -4,-2.0 3,-1.0 -5,-0.2 -2,-0.2 0.972 111.8 47.6 -62.0 -50.6 45.3 28.0 16.3 44 224 A E H 3<5S+ 0 0 117 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.829 118.4 37.3 -60.4 -43.9 48.3 28.0 13.9 45 225 A Y T 3<5S- 0 0 41 -4,-2.6 -1,-0.3 -5,-0.1 -2,-0.2 0.343 109.7-121.9 -92.3 8.0 50.1 25.0 15.3 46 226 A K T < 5 + 0 0 169 -3,-1.0 -3,-0.2 -4,-0.4 2,-0.1 0.918 49.4 175.8 52.7 50.1 46.7 23.3 15.9 47 227 A L < - 0 0 16 -5,-2.7 -1,-0.2 -6,-0.2 38,-0.0 -0.453 35.5 -96.1 -84.9 153.9 47.4 22.9 19.6 48 228 A Q > - 0 0 117 1,-0.1 4,-1.0 -2,-0.1 3,-0.5 -0.355 26.6-124.2 -63.7 151.0 45.0 21.6 22.2 49 229 A N H > S+ 0 0 15 1,-0.2 4,-1.9 2,-0.2 -1,-0.1 0.773 111.7 65.7 -67.5 -25.6 43.0 24.2 24.1 50 230 A E H > S+ 0 0 22 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.877 96.3 54.0 -61.9 -39.7 44.3 22.5 27.2 51 231 A T H > S+ 0 0 0 -3,-0.5 4,-2.5 1,-0.2 -1,-0.2 0.871 106.7 52.1 -60.9 -41.0 47.9 23.6 26.3 52 232 A L H X S+ 0 0 5 -4,-1.0 4,-1.9 2,-0.2 -1,-0.2 0.918 109.6 48.4 -63.7 -41.8 46.6 27.2 26.0 53 233 A H H X S+ 0 0 6 -4,-1.9 4,-2.0 1,-0.2 -2,-0.2 0.928 112.2 49.3 -65.0 -43.4 45.1 27.0 29.5 54 234 A L H X S+ 0 0 1 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.905 108.4 53.4 -60.9 -42.9 48.3 25.5 30.9 55 235 A A H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.905 107.6 50.7 -61.9 -44.6 50.5 28.2 29.3 56 236 A V H X S+ 0 0 3 -4,-1.9 4,-2.3 1,-0.2 -1,-0.2 0.900 110.0 50.2 -61.5 -45.6 48.4 31.0 30.8 57 237 A N H X S+ 0 0 21 -4,-2.0 4,-2.3 2,-0.2 5,-0.2 0.908 110.1 50.5 -56.7 -43.4 48.7 29.4 34.2 58 238 A Y H X S+ 0 0 0 -4,-2.5 4,-2.8 1,-0.2 -2,-0.2 0.949 111.2 48.2 -61.3 -50.0 52.5 29.1 33.8 59 239 A I H X S+ 0 0 2 -4,-2.6 4,-2.7 1,-0.2 -1,-0.2 0.878 112.8 47.8 -58.0 -42.1 52.8 32.8 32.9 60 240 A D H X S+ 0 0 8 -4,-2.3 4,-0.6 2,-0.2 -44,-0.4 0.872 113.6 46.2 -71.1 -35.2 50.6 33.9 35.8 61 241 A R H < S+ 0 0 36 -4,-2.3 4,-0.3 -5,-0.2 3,-0.3 0.902 114.3 50.2 -72.1 -35.2 52.5 31.8 38.3 62 242 A F H >X S+ 0 0 2 -4,-2.8 4,-3.3 -5,-0.2 3,-2.1 0.966 111.3 46.2 -63.9 -51.3 55.8 33.1 36.8 63 243 A L H 3< S+ 0 0 2 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.615 104.7 63.9 -67.6 -14.1 54.8 36.8 37.0 64 244 A S T 3< S+ 0 0 27 -4,-0.6 -1,-0.3 -3,-0.3 -2,-0.2 0.553 117.7 26.4 -82.6 -11.6 53.6 36.1 40.5 65 245 A S T <4 S+ 0 0 88 -3,-2.1 2,-0.4 -4,-0.3 -2,-0.2 0.704 121.2 46.1-118.1 -37.7 57.2 35.3 41.4 66 246 A M < - 0 0 70 -4,-3.3 -1,-0.3 -5,-0.1 2,-0.2 -0.924 69.1-131.4-122.6 135.4 59.4 37.3 39.0 67 247 A S - 0 0 85 -2,-0.4 2,-0.3 -3,-0.1 -44,-0.1 -0.486 28.7-165.3 -75.0 144.2 59.4 40.8 37.7 68 248 A V - 0 0 14 -2,-0.2 -43,-0.5 -5,-0.1 2,-0.4 -0.979 19.6-128.8-135.4 146.4 59.7 41.2 33.9 69 249 A L > - 0 0 118 -2,-0.3 3,-3.2 1,-0.1 4,-0.5 -0.774 33.4-115.7 -90.9 139.3 60.5 44.0 31.5 70 250 A R G >> S+ 0 0 139 -2,-0.4 3,-1.1 1,-0.3 4,-0.6 0.772 113.8 68.4 -44.5 -31.1 57.9 44.4 28.7 71 251 A G G 34 S+ 0 0 50 1,-0.3 -1,-0.3 2,-0.1 4,-0.1 0.711 106.9 37.4 -64.1 -21.8 60.7 43.6 26.3 72 252 A K G <> S+ 0 0 100 -3,-3.2 4,-2.2 2,-0.1 -1,-0.3 0.320 88.6 95.5-110.1 2.3 60.8 40.0 27.6 73 253 A L H <> S+ 0 0 12 -3,-1.1 4,-2.2 -4,-0.5 -2,-0.1 0.929 86.5 49.5 -60.0 -44.7 57.0 39.5 28.2 74 254 A Q H X S+ 0 0 56 -4,-0.6 4,-2.6 1,-0.2 -1,-0.2 0.836 108.8 52.6 -63.6 -32.7 56.6 37.8 24.8 75 255 A L H > S+ 0 0 3 2,-0.2 4,-3.2 1,-0.2 5,-0.2 0.913 106.8 52.9 -70.6 -38.8 59.6 35.5 25.6 76 256 A V H X S+ 0 0 1 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.947 112.2 46.3 -60.3 -43.6 57.9 34.5 28.9 77 257 A G H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.911 113.0 47.7 -64.9 -43.3 54.8 33.7 26.8 78 258 A T H X S+ 0 0 0 -4,-2.6 4,-1.9 2,-0.2 -2,-0.2 0.910 113.3 49.1 -65.2 -38.6 56.8 31.8 24.2 79 259 A A H X S+ 0 0 0 -4,-3.2 4,-2.7 1,-0.2 -2,-0.2 0.937 110.6 50.4 -67.2 -45.5 58.6 29.8 26.9 80 260 A A H X S+ 0 0 0 -4,-2.7 4,-2.5 -5,-0.2 -2,-0.2 0.892 110.4 48.8 -60.5 -40.4 55.4 29.0 28.7 81 261 A M H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 -1,-0.2 0.837 111.1 51.6 -68.1 -35.8 53.7 27.7 25.4 82 262 A L H X S+ 0 0 0 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.948 111.7 46.4 -62.9 -50.6 56.8 25.6 24.8 83 263 A L H X S+ 0 0 6 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.913 114.4 47.6 -58.2 -43.5 56.6 24.2 28.3 84 264 A A H X S+ 0 0 0 -4,-2.5 4,-3.0 2,-0.2 5,-0.5 0.909 110.7 50.6 -67.4 -42.7 52.9 23.5 27.9 85 265 A S H X S+ 0 0 0 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.915 112.3 47.2 -63.2 -40.6 53.2 21.9 24.5 86 266 A K H < S+ 0 0 105 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.858 116.6 44.3 -66.6 -40.0 56.0 19.5 25.7 87 267 A F H < S+ 0 0 90 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.899 132.4 17.6 -70.4 -41.6 53.9 18.7 28.8 88 268 A E H < S+ 0 0 72 -4,-3.0 -3,-0.2 -5,-0.2 -2,-0.2 0.816 103.4 82.0-100.8 -44.2 50.6 18.2 27.0 89 269 A E < - 0 0 28 -4,-2.0 -42,-0.0 -5,-0.5 0, 0.0 -0.436 58.1-149.5 -73.4 146.1 51.0 17.8 23.2 90 270 A I S S+ 0 0 136 1,-0.3 -1,-0.1 -2,-0.1 -5,-0.0 0.854 103.1 25.1 -79.3 -38.1 51.9 14.4 21.6 91 271 A Y S S- 0 0 205 -3,-0.0 -1,-0.3 -6,-0.0 -5,-0.1 -0.697 86.1-175.9-121.4 72.5 53.8 16.3 18.8 92 272 A P - 0 0 41 0, 0.0 -10,-0.1 0, 0.0 -6,-0.0 -0.443 32.9-105.0 -70.3 147.2 54.7 19.5 20.4 93 273 A P - 0 0 15 0, 0.0 2,-0.2 0, 0.0 -4,-0.1 -0.363 39.1-109.1 -65.6 157.4 56.5 22.0 18.0 94 274 A E >> - 0 0 141 1,-0.1 3,-2.1 -3,-0.1 4,-1.4 -0.523 30.2-100.4 -86.4 157.4 60.3 22.4 18.4 95 275 A V H 3> S+ 0 0 18 1,-0.3 4,-2.0 2,-0.2 5,-0.2 0.837 122.2 65.0 -39.4 -46.0 62.0 25.5 19.8 96 276 A A H 3> S+ 0 0 68 1,-0.2 4,-2.6 2,-0.2 -1,-0.3 0.863 102.5 47.0 -47.4 -44.9 62.7 26.5 16.2 97 277 A E H <> S+ 0 0 67 -3,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.921 111.0 49.4 -65.9 -46.7 59.0 26.9 15.5 98 278 A F H X S+ 0 0 0 -4,-1.4 4,-0.6 2,-0.2 -1,-0.2 0.737 112.3 50.0 -66.5 -23.4 58.4 28.9 18.7 99 279 A V H ><>S+ 0 0 14 -4,-2.0 5,-1.2 -5,-0.3 3,-1.1 0.932 108.2 53.6 -76.2 -47.0 61.3 31.1 17.6 100 280 A Y H ><5S+ 0 0 147 -4,-2.6 3,-2.0 1,-0.3 -2,-0.2 0.888 103.4 56.6 -52.8 -44.9 59.8 31.4 14.1 101 281 A I H 3<5S+ 0 0 15 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.775 96.4 62.0 -61.8 -30.4 56.4 32.6 15.5 102 282 A T T X<5S- 0 0 1 -3,-1.1 3,-0.6 -4,-0.6 -1,-0.3 0.378 115.1-117.7 -76.1 6.4 58.1 35.5 17.4 103 283 A D T < 5 - 0 0 138 -3,-2.0 -3,-0.2 1,-0.2 -2,-0.2 0.902 68.5 -60.0 58.2 38.6 59.1 36.7 13.9 104 284 A D T 3 - 0 0 77 -2,-0.3 4,-1.9 1,-0.1 3,-0.3 -0.521 31.1-109.3 -94.3 166.9 66.9 33.6 19.3 108 288 A K H > S+ 0 0 107 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.880 120.9 55.3 -62.1 -39.5 66.6 29.9 20.1 109 289 A K H > S+ 0 0 113 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.819 106.5 52.0 -62.9 -33.5 69.2 30.3 22.8 110 290 A Q H > S+ 0 0 55 -3,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.889 109.8 47.1 -69.1 -43.7 67.0 33.0 24.4 111 291 A V H X S+ 0 0 0 -4,-1.9 4,-2.9 2,-0.2 -2,-0.2 0.951 110.7 54.1 -63.5 -45.2 64.0 30.7 24.3 112 292 A L H X S+ 0 0 40 -4,-2.8 4,-1.9 1,-0.2 -2,-0.2 0.890 108.7 47.8 -55.2 -42.7 66.1 27.9 25.9 113 293 A R H X S+ 0 0 165 -4,-1.8 4,-2.0 2,-0.2 -1,-0.2 0.924 113.3 46.4 -67.0 -44.7 67.2 30.1 28.8 114 294 A M H X S+ 0 0 17 -4,-2.0 4,-3.3 2,-0.2 5,-0.4 0.924 108.0 58.3 -62.8 -42.7 63.7 31.4 29.6 115 295 A E H X S+ 0 0 15 -4,-2.9 4,-2.1 1,-0.2 -1,-0.2 0.940 109.5 43.6 -52.6 -46.3 62.4 27.8 29.3 116 296 A H H X S+ 0 0 120 -4,-1.9 4,-1.9 -5,-0.2 -1,-0.2 0.866 114.7 51.1 -70.3 -29.9 64.8 26.9 32.1 117 297 A L H X S+ 0 0 60 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.934 112.1 43.5 -71.6 -47.5 63.9 30.0 34.1 118 298 A V H X S+ 0 0 1 -4,-3.3 4,-2.5 2,-0.2 6,-0.2 0.933 113.7 53.1 -62.2 -47.0 60.1 29.6 34.0 119 299 A L H <>S+ 0 0 40 -4,-2.1 5,-2.5 -5,-0.4 6,-0.2 0.916 111.8 44.6 -55.5 -44.6 60.5 25.9 34.8 120 300 A K H ><5S+ 0 0 124 -4,-1.9 3,-1.5 1,-0.2 -1,-0.2 0.911 112.9 50.8 -66.9 -43.5 62.7 26.6 37.8 121 301 A V H 3<5S+ 0 0 32 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.814 105.1 57.5 -62.7 -33.0 60.3 29.4 39.0 122 302 A L T ><5S- 0 0 5 -4,-2.5 3,-2.3 -5,-0.2 -1,-0.3 0.310 114.7-117.5 -80.7 8.6 57.4 27.0 38.7 123 303 A A T < 5 - 0 0 58 -3,-1.5 -3,-0.2 1,-0.3 -2,-0.1 0.776 62.0 -74.2 59.5 25.0 59.2 24.6 41.1 124 304 A F T 3 - 0 0 6 -2,-0.3 4,-1.5 1,-0.1 3,-0.3 -0.651 37.8-104.0-108.8 169.5 42.7 24.2 34.3 131 311 A I H > S+ 0 0 8 1,-0.2 4,-2.6 -2,-0.2 3,-0.4 0.929 121.8 54.5 -53.1 -48.5 39.2 25.4 33.4 132 312 A N H > S+ 0 0 17 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.823 102.6 56.8 -56.6 -36.4 39.0 22.7 30.7 133 313 A Q H > S+ 0 0 51 -3,-0.3 4,-0.9 2,-0.2 -1,-0.2 0.892 111.8 41.5 -64.1 -41.1 39.9 19.9 33.2 134 314 A F H >X S+ 0 0 0 -4,-1.5 4,-2.6 -3,-0.4 3,-0.6 0.903 111.5 55.2 -72.5 -40.8 36.9 20.8 35.4 135 315 A L H 3X S+ 0 0 1 -4,-2.6 4,-3.0 1,-0.3 -2,-0.2 0.851 102.2 58.8 -57.9 -39.0 34.6 21.3 32.4 136 316 A T H 3< S+ 0 0 81 -4,-2.0 4,-0.3 -5,-0.2 -1,-0.3 0.886 109.6 43.3 -59.2 -35.6 35.6 17.8 31.4 137 317 A Q H X< S+ 0 0 37 -4,-0.9 3,-1.2 -3,-0.6 4,-0.3 0.914 114.1 50.1 -76.4 -42.9 34.2 16.5 34.7 138 318 A Y H >< S+ 0 0 1 -4,-2.6 3,-2.6 1,-0.3 4,-0.3 0.905 98.7 66.0 -61.1 -44.3 31.1 18.8 34.6 139 319 A F G >< S+ 0 0 28 -4,-3.0 3,-0.8 1,-0.3 -1,-0.3 0.677 89.3 69.0 -52.8 -21.3 30.2 17.6 31.0 140 320 A L G < S+ 0 0 128 -3,-1.2 -1,-0.3 -4,-0.3 -2,-0.2 0.700 95.3 53.0 -71.3 -23.7 29.6 14.1 32.5 141 321 A H G < S+ 0 0 32 -3,-2.6 2,-1.6 -4,-0.3 -1,-0.2 0.443 79.2 105.8 -88.6 -3.2 26.5 15.4 34.3 142 322 A Q S < S- 0 0 15 -3,-0.8 -1,-0.0 -4,-0.3 -3,-0.0 -0.693 70.7-148.2 -79.8 89.9 25.2 16.8 31.0 143 323 A Q S S+ 0 0 183 -2,-1.6 2,-0.7 1,-0.2 -1,-0.2 0.850 83.9 18.1 -28.4 -90.0 22.5 14.1 30.6 144 324 A P S S- 0 0 106 0, 0.0 -1,-0.2 0, 0.0 -3,-0.0 -0.861 105.6-111.5 -91.0 125.0 22.5 13.8 26.8 145 325 A A - 0 0 73 -2,-0.7 2,-0.5 1,-0.1 -2,-0.1 -0.217 30.1-159.8 -51.7 137.7 25.7 15.4 25.7 146 326 A N > - 0 0 57 1,-0.1 4,-1.9 -7,-0.1 3,-0.2 -0.917 6.3-165.4-127.0 102.0 25.2 18.7 23.9 147 327 A C H > S+ 0 0 74 -2,-0.5 4,-2.8 1,-0.2 5,-0.2 0.860 88.3 53.3 -53.1 -48.3 28.1 19.7 21.8 148 328 A K H > S+ 0 0 79 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.912 109.8 49.5 -57.5 -39.6 27.0 23.3 21.2 149 329 A V H > S+ 0 0 0 -3,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.886 111.9 50.4 -65.7 -37.3 26.7 23.8 25.0 150 330 A E H X S+ 0 0 53 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.915 110.3 47.7 -65.9 -44.0 30.1 22.3 25.4 151 331 A S H X S+ 0 0 8 -4,-2.8 4,-2.0 1,-0.2 -1,-0.2 0.783 112.3 49.7 -70.0 -28.5 31.7 24.6 22.8 152 332 A L H X S+ 0 0 0 -4,-1.8 4,-2.6 2,-0.2 5,-0.2 0.882 108.3 52.5 -77.7 -36.6 30.1 27.7 24.4 153 333 A A H X S+ 0 0 0 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.931 112.4 47.2 -63.1 -42.0 31.3 26.7 27.8 154 334 A M H X S+ 0 0 39 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.937 109.5 52.4 -63.3 -46.0 34.8 26.4 26.3 155 335 A F H X S+ 0 0 2 -4,-2.0 4,-2.2 1,-0.2 -2,-0.2 0.924 112.3 45.2 -55.5 -47.1 34.5 29.8 24.6 156 336 A L H X S+ 0 0 0 -4,-2.6 4,-1.4 1,-0.2 -1,-0.2 0.894 110.0 54.9 -64.7 -43.5 33.5 31.5 27.8 157 337 A G H X S+ 0 0 0 -4,-2.3 4,-0.5 -5,-0.2 3,-0.3 0.915 109.0 49.0 -57.8 -41.7 36.2 29.7 29.7 158 338 A E H >X S+ 0 0 0 -4,-2.6 3,-1.7 1,-0.2 4,-0.7 0.910 102.3 59.6 -66.3 -43.0 38.8 31.1 27.1 159 339 A L H >X S+ 0 0 15 -4,-2.2 3,-1.0 1,-0.3 4,-0.8 0.841 98.6 61.7 -52.7 -35.6 37.6 34.7 27.3 160 340 A S H 3< S+ 0 0 5 -4,-1.4 -1,-0.3 -3,-0.3 -2,-0.2 0.765 92.4 63.9 -63.4 -29.6 38.4 34.6 31.0 161 341 A L H << S+ 0 0 16 -3,-1.7 -1,-0.2 -4,-0.5 -2,-0.2 0.755 96.3 60.7 -66.7 -21.8 42.1 34.0 30.3 162 342 A I H << S+ 0 0 7 -3,-1.0 2,-0.8 -4,-0.7 -1,-0.2 0.942 99.6 54.5 -72.3 -45.0 42.3 37.3 28.6 163 343 A D X - 0 0 33 -4,-0.8 4,-1.1 1,-0.2 -1,-0.2 -0.773 52.3-179.1-101.5 99.8 41.4 39.5 31.6 164 344 A A H > + 0 0 8 -2,-0.8 4,-2.7 -136,-0.2 5,-0.3 0.810 67.5 89.3 -61.3 -33.4 43.4 39.1 34.7 165 345 A D H 4 S- 0 0 116 1,-0.2 -1,-0.2 2,-0.2 -147,-0.0 -0.955 108.9 -2.6-105.8 117.7 41.1 41.7 36.2 166 346 A P H >4 S+ 0 0 21 0, 0.0 3,-2.5 0, 0.0 -1,-0.2 -0.998 127.4 65.3 -96.7 -5.0 38.8 40.3 37.5 167 347 A Y H >< S+ 0 0 7 -4,-1.1 3,-2.0 1,-0.3 -2,-0.2 0.688 85.8 72.1 -53.7 -23.3 39.4 36.6 36.6 168 348 A L T 3< S+ 0 0 31 -4,-2.7 -1,-0.3 1,-0.3 -3,-0.1 0.749 88.8 68.5 -63.5 -18.7 42.5 36.2 38.7 169 349 A K T < S+ 0 0 114 -3,-2.5 2,-0.3 -5,-0.3 -1,-0.3 0.574 93.4 70.7 -74.0 -12.7 40.1 36.3 41.7 170 350 A Y S < S- 0 0 45 -3,-2.0 0, 0.0 -4,-0.2 0, 0.0 -0.857 77.5-124.8-113.6 150.4 38.5 33.0 40.8 171 351 A L >> - 0 0 48 -2,-0.3 4,-1.9 1,-0.1 3,-0.6 -0.467 34.4-110.8 -81.2 153.0 39.6 29.4 40.9 172 352 A P H 3> S+ 0 0 27 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.823 116.9 56.2 -53.4 -37.8 39.4 27.3 37.7 173 353 A S H 3> S+ 0 0 0 2,-0.2 4,-1.6 1,-0.2 5,-0.1 0.835 107.9 48.5 -63.6 -38.6 36.5 25.2 39.1 174 354 A V H <> S+ 0 0 25 -3,-0.6 4,-2.6 2,-0.2 5,-0.2 0.917 112.8 46.2 -67.0 -45.5 34.4 28.2 39.8 175 355 A I H X S+ 0 0 8 -4,-1.9 4,-2.7 1,-0.2 -2,-0.2 0.884 112.6 51.5 -66.7 -38.3 35.0 29.7 36.3 176 356 A A H X S+ 0 0 0 -4,-2.3 4,-2.2 -5,-0.2 -1,-0.2 0.869 110.6 48.9 -64.8 -38.7 34.3 26.4 34.8 177 357 A A H X S+ 0 0 0 -4,-1.6 4,-2.8 2,-0.2 -2,-0.2 0.955 113.8 44.7 -66.7 -46.5 31.0 26.2 36.7 178 358 A A H X S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.2 5,-0.2 0.925 114.2 51.0 -63.2 -41.5 29.9 29.7 35.8 179 359 A A H X S+ 0 0 0 -4,-2.7 4,-2.0 -5,-0.2 -1,-0.2 0.867 112.1 46.3 -64.2 -40.3 30.9 29.0 32.2 180 360 A F H X S+ 0 0 0 -4,-2.2 4,-3.0 2,-0.2 5,-0.2 0.937 113.5 47.5 -68.9 -49.8 28.9 25.7 32.1 181 361 A H H X S+ 0 0 1 -4,-2.8 4,-3.3 1,-0.2 5,-0.2 0.970 114.6 47.2 -54.6 -52.3 25.8 27.2 33.7 182 362 A L H X S+ 0 0 0 -4,-2.8 4,-2.9 1,-0.2 -1,-0.2 0.881 113.1 47.3 -58.7 -42.1 25.9 30.2 31.3 183 363 A A H X S+ 0 0 0 -4,-2.0 4,-2.0 -5,-0.2 5,-0.3 0.913 114.2 48.1 -67.2 -44.1 26.4 28.0 28.2 184 364 A L H X>S+ 0 0 10 -4,-3.0 4,-3.5 2,-0.2 5,-1.0 0.951 114.3 46.2 -58.6 -51.0 23.6 25.7 29.3 185 365 A Y H X5S+ 0 0 42 -4,-3.3 4,-1.2 4,-0.3 -2,-0.2 0.915 112.7 49.1 -60.1 -48.4 21.2 28.6 30.0 186 366 A T H <5S+ 0 0 33 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.875 123.2 31.3 -61.4 -39.0 22.0 30.4 26.7 187 367 A V H <5S+ 0 0 45 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.858 139.2 13.3 -89.3 -39.3 21.6 27.3 24.6 188 368 A T H <5S- 0 0 49 -4,-3.5 -3,-0.2 -5,-0.3 -2,-0.2 0.622 88.2-120.8-115.5 -17.0 18.9 25.3 26.5 189 369 A G S < - 0 0 25 0, 0.0 4,-2.4 0, 0.0 3,-0.2 -0.251 7.3-133.6 -60.0 140.3 22.7 20.7 37.5 194 374 A E H > S+ 0 0 125 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.883 109.9 58.5 -60.7 -39.9 21.7 19.4 40.9 195 375 A S H > S+ 0 0 54 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.902 110.1 44.6 -58.4 -36.3 24.1 16.5 40.4 196 376 A L H >>S+ 0 0 0 2,-0.2 4,-3.1 1,-0.2 5,-0.6 0.880 108.3 55.5 -74.5 -38.5 26.8 19.2 40.0 197 377 A V H X5S+ 0 0 22 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.934 114.2 42.5 -59.4 -41.6 25.6 21.2 43.0 198 378 A Q H <5S+ 0 0 129 -4,-2.8 -2,-0.2 2,-0.2 -1,-0.2 0.936 117.3 45.2 -69.5 -48.7 26.0 18.1 45.0 199 379 A K H <5S+ 0 0 113 -4,-2.6 -2,-0.2 -5,-0.2 -3,-0.2 0.876 126.8 27.5 -63.2 -43.5 29.3 17.0 43.5 200 380 A T H <5S- 0 0 9 -4,-3.1 -3,-0.2 2,-0.2 -2,-0.2 0.763 92.9-131.8 -91.4 -30.3 31.0 20.4 43.7 201 381 A G << + 0 0 52 -4,-1.9 2,-0.4 -5,-0.6 -4,-0.2 0.513 66.4 128.7 85.3 5.2 29.2 22.0 46.6 202 382 A Y - 0 0 23 -6,-0.5 -1,-0.4 -5,-0.1 2,-0.3 -0.784 36.5-174.4 -96.3 141.8 28.7 25.1 44.4 203 383 A T > - 0 0 47 -2,-0.4 4,-2.4 -3,-0.1 5,-0.2 -0.820 44.2 -99.9-125.2 167.0 25.3 26.6 44.0 204 384 A L T 4 S+ 0 0 54 -2,-0.3 4,-0.5 1,-0.2 7,-0.1 0.753 124.4 58.1 -61.4 -19.9 24.1 29.5 41.7 205 385 A E T >4 S+ 0 0 145 2,-0.2 3,-1.1 1,-0.2 -1,-0.2 0.972 109.7 39.8 -73.2 -52.0 24.3 31.6 44.8 206 386 A T T 34 S+ 0 0 63 1,-0.3 4,-0.3 2,-0.1 -2,-0.2 0.787 117.8 51.3 -66.7 -27.5 28.0 30.9 45.4 207 387 A L T 3X S+ 0 0 1 -4,-2.4 4,-2.4 1,-0.2 -1,-0.3 0.523 85.3 93.6 -85.2 -8.7 28.6 31.1 41.6 208 388 A K H <> S+ 0 0 104 -3,-1.1 4,-2.2 -4,-0.5 5,-0.2 0.892 79.1 52.8 -55.0 -48.3 26.8 34.5 41.4 209 389 A P H > S+ 0 0 70 0, 0.0 4,-1.8 0, 0.0 3,-0.3 0.967 115.8 39.2 -55.7 -51.0 29.9 36.7 41.7 210 390 A C H > S+ 0 0 0 -4,-0.3 4,-3.2 1,-0.2 5,-0.2 0.863 114.5 55.9 -64.9 -36.3 31.8 35.0 38.9 211 391 A L H X S+ 0 0 0 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.832 105.0 50.6 -65.9 -36.3 28.6 34.6 36.8 212 392 A L H X S+ 0 0 71 -4,-2.2 4,-2.2 -3,-0.3 -1,-0.2 0.956 114.9 44.6 -67.0 -46.6 27.8 38.3 36.9 213 393 A D H X S+ 0 0 47 -4,-1.8 4,-2.3 -5,-0.2 -2,-0.2 0.938 115.0 46.5 -60.6 -51.4 31.4 39.1 35.7 214 394 A L H X S+ 0 0 0 -4,-3.2 4,-2.1 1,-0.2 -1,-0.2 0.810 109.6 56.4 -62.9 -31.4 31.4 36.3 33.0 215 395 A H H X S+ 0 0 13 -4,-1.9 4,-2.4 -5,-0.2 -1,-0.2 0.955 109.3 44.4 -64.6 -49.8 28.0 37.6 31.9 216 396 A Q H X S+ 0 0 72 -4,-2.2 4,-3.0 2,-0.2 5,-0.2 0.911 112.7 51.7 -58.4 -48.9 29.3 41.1 31.3 217 397 A T H X S+ 0 0 23 -4,-2.3 4,-1.5 1,-0.2 -1,-0.2 0.916 110.8 48.9 -53.2 -48.1 32.4 39.8 29.6 218 398 A Y H < S+ 0 0 7 -4,-2.1 -1,-0.2 2,-0.2 -2,-0.2 0.902 113.9 45.6 -60.6 -43.9 30.3 37.7 27.3 219 399 A L H < S+ 0 0 68 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.894 117.9 42.8 -66.9 -41.0 28.0 40.6 26.5 220 400 A R H >X S+ 0 0 159 -4,-3.0 3,-2.6 1,-0.2 4,-0.9 0.601 85.1 103.9 -81.3 -13.9 30.9 43.0 25.9 221 401 A A G >< S+ 0 0 7 -4,-1.5 3,-0.8 1,-0.3 -1,-0.2 0.785 73.4 56.0 -39.0 -49.8 33.0 40.5 23.9 222 402 A P G 34 S+ 0 0 58 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.749 112.8 43.5 -63.1 -16.1 32.3 41.9 20.4 223 403 A Q G <4 S+ 0 0 170 -3,-2.6 -2,-0.2 -4,-0.1 -3,-0.1 0.566 86.9 116.5-102.2 -11.4 33.7 45.3 21.6 224 404 A H S << S- 0 0 57 -4,-0.9 -3,-0.0 -3,-0.8 -7,-0.0 -0.242 72.5-124.0 -57.6 144.9 36.7 43.9 23.5 225 405 A A S S+ 0 0 85 2,-0.0 2,-0.5 1,-0.0 -1,-0.1 0.879 97.8 63.2 -58.8 -43.3 40.1 45.0 22.2 226 406 A Q + 0 0 40 1,-0.1 4,-0.2 2,-0.0 -2,-0.1 -0.771 57.4 168.6 -87.4 131.1 41.3 41.4 21.8 227 407 A Q > + 0 0 47 -2,-0.5 4,-2.3 2,-0.1 5,-0.2 0.318 42.5 103.9-124.5 6.9 39.2 39.3 19.2 228 408 A S H > S+ 0 0 23 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.828 83.5 48.5 -64.2 -34.3 41.1 36.1 18.6 229 409 A I H > S+ 0 0 5 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.973 110.6 50.4 -71.8 -49.1 38.9 33.8 20.7 230 410 A R H 4 S+ 0 0 43 1,-0.2 4,-0.3 2,-0.2 12,-0.2 0.932 112.8 47.7 -51.4 -48.2 35.7 35.2 19.2 231 411 A E H >< S+ 0 0 97 -4,-2.3 3,-1.2 1,-0.2 4,-0.4 0.905 109.9 53.3 -59.7 -42.5 37.2 34.5 15.8 232 412 A K H >< S+ 0 0 10 -4,-2.0 3,-1.1 1,-0.2 6,-0.3 0.919 108.3 49.3 -58.4 -46.7 38.3 31.0 16.8 233 413 A Y T 3< S+ 0 0 0 -4,-2.7 9,-1.5 1,-0.2 10,-0.3 0.381 90.6 80.5 -79.7 7.5 34.8 30.1 18.0 234 414 A K T < S+ 0 0 76 -3,-1.2 -1,-0.2 -4,-0.3 -2,-0.2 0.714 77.2 92.7 -83.4 -21.3 33.1 31.3 14.8 235 415 A N S X >S- 0 0 88 -3,-1.1 5,-2.3 -4,-0.4 3,-1.5 -0.327 89.4-111.2 -77.1 157.1 34.1 28.0 13.0 236 416 A S G > 5S+ 0 0 96 1,-0.3 3,-1.8 3,-0.3 -1,-0.1 0.728 113.6 70.4 -54.0 -30.1 32.0 24.8 12.6 237 417 A K G 3 5S+ 0 0 148 1,-0.3 -1,-0.3 2,-0.1 -4,-0.1 0.924 111.1 33.3 -54.4 -41.3 34.5 23.0 14.9 238 418 A Y G X 5S- 0 0 21 -3,-1.5 3,-2.4 -6,-0.3 -1,-0.3 0.054 116.5-113.5-104.8 22.4 33.0 25.1 17.6 239 419 A H T < 5 - 0 0 80 -3,-1.8 -3,-0.3 1,-0.3 -2,-0.1 0.738 58.1 -82.0 52.5 25.9 29.5 25.2 16.1 240 420 A G T >