==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER GENE REGULATION 20-OCT-00 1G2N . COMPND 2 MOLECULE: ULTRASPIRACLE PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HELIOTHIS VIRESCENS; . AUTHOR I.M.L.BILLAS,L.MOULINIER,N.ROCHEL,D.MORAS,STRUCTURAL . 246 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12846.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 181 73.6 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 . 8 3.3 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 0.4 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 . 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 . 8 3.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 128 52.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 2.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 0 2 1 0 2 1 0 1 0 0 0 0 0 1 0 0 0 1 0 1 0 0 1 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 . 1 0 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 1 203 A A 0 0 148 0, 0.0 2,-0.2 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 151.0 16.5 28.8 40.2 2 204 A A - 0 0 78 1,-0.1 3,-0.1 3,-0.0 0, 0.0 -0.677 360.0 -62.2-100.5 157.7 13.1 28.0 38.6 3 205 A V S S- 0 0 107 -2,-0.2 -1,-0.1 1,-0.1 2,-0.1 -0.141 72.4-120.5 -39.5 106.3 9.7 28.5 40.4 4 206 A Q - 0 0 77 -3,-0.1 2,-0.3 1,-0.0 -1,-0.1 -0.329 27.8-156.8 -65.5 134.8 10.4 26.1 43.2 5 207 A E - 0 0 111 -2,-0.1 2,-1.2 -3,-0.1 5,-0.2 -0.839 25.7-114.0-110.3 145.6 8.1 23.1 43.6 6 208 A L + 0 0 3 -2,-0.3 2,-0.3 59,-0.1 181,-0.1 -0.687 65.6 138.7 -79.2 98.8 7.4 21.1 46.8 7 209 A S > - 0 0 30 -2,-1.2 4,-2.1 1,-0.1 5,-0.2 -0.946 67.7-110.4-141.5 162.5 8.9 17.8 45.6 8 210 A I H > S+ 0 0 21 -2,-0.3 4,-2.2 1,-0.2 5,-0.2 0.894 117.4 55.3 -59.7 -41.1 11.1 14.9 46.9 9 211 A E H > S+ 0 0 134 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.925 109.1 46.0 -59.6 -45.7 13.9 16.0 44.6 10 212 A R H > S+ 0 0 47 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.874 111.0 52.0 -65.7 -38.7 13.9 19.5 46.0 11 213 A L H X S+ 0 0 1 -4,-2.1 4,-1.6 2,-0.2 -1,-0.2 0.868 108.2 52.7 -66.1 -34.7 13.8 18.3 49.6 12 214 A L H X S+ 0 0 58 -4,-2.2 4,-1.0 2,-0.2 -2,-0.2 0.902 108.5 49.7 -67.6 -37.7 16.8 16.1 48.9 13 215 A E H X S+ 0 0 83 -4,-1.8 4,-0.9 1,-0.2 3,-0.4 0.908 112.0 49.3 -64.6 -40.5 18.7 19.0 47.5 14 216 A M H < S+ 0 0 12 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.757 101.6 62.2 -69.4 -27.7 17.8 21.0 50.7 15 217 A E H < S+ 0 0 52 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.830 105.7 46.7 -67.9 -33.7 18.9 18.2 53.0 16 218 A S H < S+ 0 0 85 -4,-1.0 -1,-0.2 -3,-0.4 -2,-0.2 0.718 88.3 106.1 -81.5 -25.3 22.5 18.4 51.8 17 219 A L < - 0 0 101 -4,-0.9 2,-0.5 1,-0.1 44,-0.0 -0.273 51.4-163.8 -59.5 141.0 22.7 22.2 52.0 18 220 A V - 0 0 139 3,-0.0 2,-0.2 0, 0.0 -1,-0.1 -0.946 10.6-161.8-129.6 105.2 24.8 23.6 54.8 19 221 A A - 0 0 61 -2,-0.5 3,-0.1 1,-0.1 41,-0.0 -0.506 38.1 -80.4 -88.3 157.9 24.2 27.3 55.4 20 222 A D - 0 0 96 1,-0.2 2,-0.2 -2,-0.2 -1,-0.1 -0.367 66.9 -89.9 -55.5 127.5 26.5 29.7 57.3 21 223 A P - 0 0 101 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 -0.200 48.3-136.9 -45.3 104.6 25.6 29.0 60.9 22 224 A S - 0 0 24 225,-0.3 34,-0.1 -2,-0.2 35,-0.1 -0.379 35.3 -84.5 -66.1 145.1 22.8 31.5 61.6 23 225 A E - 0 0 116 1,-0.1 2,-0.4 33,-0.1 -1,-0.1 -0.286 57.8-138.4 -50.2 127.9 23.1 33.3 64.9 24 226 A E - 0 0 43 -3,-0.1 2,-0.2 2,-0.0 29,-0.1 -0.767 10.2-143.8-105.3 146.1 21.5 30.9 67.3 25 227 A F - 0 0 28 -2,-0.4 2,-1.9 27,-0.2 3,-0.3 -0.621 31.4-100.6-100.2 157.9 19.1 31.5 70.2 26 228 A Q + 0 0 98 -2,-0.2 205,-0.2 1,-0.2 208,-0.1 -0.457 57.3 147.3 -77.0 66.6 19.0 29.8 73.6 27 229 A F S S+ 0 0 1 -2,-1.9 204,-2.7 1,-0.2 2,-0.4 0.902 78.2 32.1 -64.3 -39.9 16.1 27.3 73.0 28 230 A L B S+A 230 0A 18 -3,-0.3 2,-0.3 20,-0.3 202,-0.2 -0.960 81.0 146.9-120.9 133.9 17.8 25.0 75.3 29 231 A R - 0 0 59 200,-2.2 2,-0.8 -2,-0.4 16,-0.1 -0.971 48.7-120.1-166.7 152.7 20.0 26.0 78.2 30 232 A V + 0 0 26 -2,-0.3 199,-0.1 11,-0.1 198,-0.1 -0.854 50.2 166.9 -93.9 110.0 21.3 25.2 81.7 31 233 A G > - 0 0 13 -2,-0.8 3,-1.3 197,-0.6 14,-0.0 -0.411 54.0 -79.4-114.0-168.6 20.1 28.3 83.7 32 234 A P T 3 S+ 0 0 140 0, 0.0 -2,-0.0 0, 0.0 196,-0.0 0.659 128.7 54.3 -70.1 -13.9 19.9 29.2 87.4 33 235 A D T 3 S+ 0 0 73 195,-0.2 2,-0.5 2,-0.0 196,-0.1 0.496 83.1 109.1 -96.1 -3.5 16.6 27.2 87.7 34 236 A S < - 0 0 7 -3,-1.3 194,-0.2 1,-0.1 193,-0.1 -0.614 61.1-149.7 -78.0 121.5 18.2 24.0 86.3 35 237 A N + 0 0 82 -2,-0.5 -1,-0.1 191,-0.2 193,-0.1 0.352 53.2 131.5 -74.0 12.0 18.6 21.2 88.9 36 238 A V - 0 0 14 191,-0.3 5,-0.1 1,-0.1 -2,-0.1 -0.457 65.1-114.5 -66.8 126.1 21.7 19.8 87.1 37 239 A P >> - 0 0 63 0, 0.0 3,-2.6 0, 0.0 4,-0.9 -0.337 26.6-109.1 -60.3 147.1 24.5 19.3 89.7 38 240 A P H >> S+ 0 0 115 0, 0.0 3,-1.2 0, 0.0 4,-0.6 0.860 117.6 59.6 -45.5 -43.8 27.5 21.6 89.2 39 241 A K H 34 S+ 0 0 161 1,-0.3 -3,-0.0 2,-0.1 3,-0.0 0.704 111.8 38.4 -63.6 -18.1 29.6 18.7 88.1 40 242 A F H <> S+ 0 0 76 -3,-2.6 4,-2.4 2,-0.1 5,-0.3 0.429 90.9 92.1-109.3 0.4 27.3 17.9 85.1 41 243 A R H S+ 0 0 63 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.915 115.1 47.9 -66.4 -36.3 28.4 18.7 79.7 44 246 A V H X S+ 0 0 35 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.916 111.7 51.5 -68.5 -38.1 24.6 19.3 79.8 45 247 A S H X S+ 0 0 31 -4,-2.6 4,-2.2 -5,-0.3 -1,-0.2 0.899 107.5 53.3 -62.6 -39.5 25.2 22.9 78.6 46 248 A S H X S+ 0 0 60 -4,-2.2 4,-1.8 -5,-0.2 -1,-0.2 0.900 108.6 49.4 -61.8 -41.0 27.3 21.5 75.8 47 249 A L H X S+ 0 0 67 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.897 109.3 52.1 -65.3 -39.8 24.5 19.2 74.8 48 250 A C H X S+ 0 0 10 -4,-2.4 4,-2.5 1,-0.2 -20,-0.3 0.883 108.6 51.5 -62.5 -37.4 22.0 22.1 74.9 49 251 A Q H X S+ 0 0 109 -4,-2.2 4,-1.7 2,-0.2 -1,-0.2 0.857 107.4 51.7 -68.6 -34.8 24.3 24.1 72.6 50 252 A I H X S+ 0 0 31 -4,-1.8 4,-2.0 1,-0.2 -2,-0.2 0.924 111.8 48.8 -65.7 -42.7 24.5 21.1 70.1 51 253 A G H X S+ 0 0 7 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.921 108.0 52.6 -62.2 -45.6 20.7 21.2 70.2 52 254 A N H X S+ 0 0 5 -4,-2.5 4,-2.1 1,-0.2 -27,-0.2 0.830 107.7 51.9 -60.0 -36.0 20.5 24.9 69.6 53 255 A K H X S+ 0 0 146 -4,-1.7 4,-2.1 2,-0.2 -1,-0.2 0.910 110.4 48.2 -66.7 -42.7 22.7 24.7 66.6 54 256 A Q H X S+ 0 0 42 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.874 111.2 50.6 -67.4 -33.6 20.5 22.0 65.1 55 257 A I H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.898 107.7 53.0 -69.6 -39.3 17.4 24.1 65.8 56 258 A A H X S+ 0 0 8 -4,-2.1 4,-1.9 1,-0.2 -2,-0.2 0.929 109.4 49.2 -59.2 -44.4 19.0 27.1 64.1 57 259 A A H X S+ 0 0 59 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.878 107.9 55.1 -62.4 -39.8 19.6 24.8 61.1 58 260 A L H X S+ 0 0 23 -4,-1.9 4,-3.0 1,-0.2 -1,-0.2 0.887 105.7 51.5 -61.2 -39.5 16.0 23.7 61.2 59 261 A V H X S+ 0 0 5 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.929 110.5 47.7 -63.0 -44.3 14.8 27.3 61.1 60 262 A V H X S+ 0 0 24 -4,-1.9 4,-0.9 1,-0.2 -1,-0.2 0.883 113.8 49.1 -62.0 -40.1 16.9 28.0 58.0 61 263 A W H >X S+ 0 0 21 -4,-2.2 3,-0.8 2,-0.2 4,-0.5 0.944 110.7 48.6 -65.8 -48.6 15.6 24.8 56.4 62 264 A A H >< S+ 0 0 1 -4,-3.0 3,-2.1 1,-0.3 -2,-0.2 0.943 106.4 56.9 -58.4 -48.8 11.9 25.5 57.1 63 265 A R H 3< S+ 0 0 65 -4,-2.4 6,-0.4 1,-0.3 -1,-0.3 0.786 108.3 49.2 -52.7 -30.1 12.2 29.0 55.7 64 266 A D H << S+ 0 0 80 -4,-0.9 -1,-0.3 -3,-0.8 -2,-0.2 0.473 78.8 116.6 -92.9 -2.2 13.5 27.5 52.4 65 267 A I S XX S- 0 0 2 -3,-2.1 3,-2.4 -4,-0.5 4,-0.5 -0.496 85.9 -92.2 -64.3 128.1 10.7 24.9 52.1 66 268 A P T 34 S+ 0 0 9 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.171 107.2 1.4 -46.2 128.0 8.8 25.8 48.9 67 269 A H T >> S+ 0 0 54 -4,-0.1 3,-0.8 -3,-0.1 4,-0.6 0.238 98.6 111.3 77.4 -10.9 5.9 28.1 49.7 68 270 A F G X4 S+ 0 0 0 -3,-2.4 3,-1.5 1,-0.3 -5,-0.1 0.919 75.9 51.2 -61.1 -44.6 6.6 28.2 53.5 69 271 A S G 3< S+ 0 0 67 -4,-0.5 -1,-0.3 -6,-0.4 4,-0.1 0.665 100.1 66.6 -68.0 -14.1 7.7 31.9 53.5 70 272 A Q G <4 S+ 0 0 149 -3,-0.8 -1,-0.3 2,-0.1 -2,-0.2 0.699 83.7 94.4 -77.1 -20.6 4.4 32.7 51.7 71 273 A L S << S- 0 0 8 -3,-1.5 5,-0.1 -4,-0.6 -4,-0.0 -0.337 98.9 -82.0 -68.4 154.5 2.5 31.6 54.8 72 274 A E >> - 0 0 93 1,-0.1 4,-2.0 101,-0.1 3,-0.9 -0.311 43.1-122.6 -55.0 138.5 1.4 34.3 57.3 73 275 A M H 3> S+ 0 0 69 1,-0.3 4,-2.4 2,-0.2 5,-0.2 0.889 110.6 54.3 -54.3 -45.7 4.5 35.0 59.5 74 276 A E H 3> S+ 0 0 93 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.789 108.9 50.4 -63.2 -25.2 2.7 34.2 62.7 75 277 A D H <> S+ 0 0 1 -3,-0.9 4,-2.6 2,-0.2 -1,-0.2 0.885 106.1 54.5 -78.0 -38.2 1.7 30.8 61.2 76 278 A Q H X S+ 0 0 6 -4,-2.0 4,-2.3 1,-0.2 5,-0.2 0.941 109.2 49.9 -56.1 -47.7 5.3 30.1 60.2 77 279 A I H X S+ 0 0 3 -4,-2.4 4,-2.9 1,-0.2 5,-0.2 0.923 110.5 48.5 -58.5 -47.3 6.3 30.7 63.8 78 280 A L H X S+ 0 0 50 -4,-1.6 4,-2.2 1,-0.2 -1,-0.2 0.887 109.9 51.7 -63.6 -38.0 3.7 28.4 65.2 79 281 A L H X S+ 0 0 0 -4,-2.6 4,-1.2 2,-0.2 -1,-0.2 0.925 114.8 41.7 -65.5 -42.9 4.6 25.6 62.8 80 282 A I H X S+ 0 0 6 -4,-2.3 4,-2.0 -5,-0.2 3,-0.4 0.917 114.3 51.6 -69.1 -42.8 8.3 25.8 63.7 81 283 A K H < S+ 0 0 61 -4,-2.9 4,-0.3 -5,-0.2 -1,-0.2 0.880 112.7 47.4 -61.3 -36.7 7.5 26.2 67.4 82 284 A G H < S+ 0 0 42 -4,-2.2 4,-0.2 -5,-0.2 -1,-0.2 0.741 121.1 32.9 -79.5 -17.7 5.3 23.1 67.3 83 285 A S H X S+ 0 0 5 -4,-1.2 4,-2.8 -3,-0.4 5,-0.3 0.568 85.9 92.4-116.7 -7.6 7.6 20.8 65.4 84 286 A W H X S+ 0 0 3 -4,-2.0 4,-2.3 1,-0.2 5,-0.2 0.897 92.2 46.6 -56.7 -41.3 11.2 21.6 66.4 85 287 A N H > S+ 0 0 8 -4,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.934 113.6 47.7 -68.0 -44.5 11.3 19.1 69.2 86 288 A E H > S+ 0 0 23 -4,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.920 112.5 50.4 -59.9 -43.5 9.8 16.3 67.0 87 289 A L H X S+ 0 0 8 -4,-2.8 4,-2.2 2,-0.2 -2,-0.2 0.884 109.2 50.9 -64.9 -38.7 12.2 17.1 64.2 88 290 A L H X S+ 0 0 18 -4,-2.3 4,-2.0 -5,-0.3 -1,-0.2 0.936 113.5 44.8 -64.1 -44.2 15.2 17.0 66.5 89 291 A L H X S+ 0 0 19 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.861 111.0 54.0 -66.3 -35.5 14.1 13.6 67.8 90 292 A F H X S+ 0 0 1 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.909 109.9 47.3 -66.0 -40.3 13.4 12.3 64.3 91 293 A A H X S+ 0 0 14 -4,-2.2 4,-2.7 2,-0.2 5,-0.2 0.875 110.1 52.6 -67.2 -40.1 16.9 13.3 63.2 92 294 A I H X S+ 0 0 20 -4,-2.0 4,-1.9 1,-0.2 21,-0.4 0.944 110.7 48.1 -61.4 -44.3 18.4 11.6 66.3 93 295 A A H X S+ 0 0 0 -4,-2.5 4,-0.7 2,-0.2 -2,-0.2 0.915 111.3 50.3 -63.0 -40.9 16.5 8.4 65.4 94 296 A W H >< S+ 0 0 49 -4,-2.1 3,-1.0 1,-0.2 4,-0.4 0.948 114.0 43.9 -62.9 -45.7 17.6 8.6 61.8 95 297 A R H >< S+ 0 0 57 -4,-2.7 3,-0.7 1,-0.2 -1,-0.2 0.779 107.6 61.4 -70.8 -26.7 21.3 9.0 62.7 96 298 A S H >< S+ 0 0 0 -4,-1.9 3,-1.5 -5,-0.2 4,-0.3 0.651 80.1 84.0 -76.8 -13.6 21.0 6.3 65.4 97 299 A M G X< S+ 0 0 33 -3,-1.0 3,-1.6 -4,-0.7 -1,-0.2 0.872 84.1 59.2 -57.0 -36.2 20.1 3.6 63.0 98 300 A E G < S+ 0 0 149 -3,-0.7 -1,-0.3 -4,-0.4 -2,-0.1 0.649 101.2 54.4 -69.1 -16.3 23.8 2.9 62.1 99 301 A F G < S+ 0 0 79 -3,-1.5 12,-0.3 -4,-0.2 -1,-0.3 0.335 81.1 115.5 -98.9 5.9 24.6 2.1 65.7 100 302 A L S < S- 0 0 16 -3,-1.6 3,-0.1 -4,-0.3 12,-0.0 -0.563 78.1-101.6 -76.5 139.0 22.0 -0.6 66.0 101 303 A T - 0 0 113 -2,-0.2 -1,-0.1 1,-0.1 -2,-0.1 -0.267 52.1 -84.0 -58.4 143.3 23.3 -4.1 66.6 102 304 A E 0 0 91 1,-0.1 -1,-0.1 -3,-0.1 -3,-0.0 -0.164 360.0 360.0 -50.3 140.9 23.3 -6.2 63.4 103 305 A E 0 0 136 -3,-0.1 -1,-0.1 0, 0.0 -2,-0.1 0.934 360.0 360.0 -59.3 360.0 20.0 -7.9 62.8 104 ! 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 0.0 105 316 A T 0 0 161 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 109.6 16.5 -11.2 71.3 106 317 A T + 0 0 95 2,-0.0 0, 0.0 3,-0.0 0, 0.0 -0.040 360.0 160.9-143.8 29.5 15.3 -7.8 72.5 107 318 A S - 0 0 105 1,-0.1 3,-0.1 3,-0.0 0, 0.0 -0.385 49.7-108.2 -57.3 122.0 18.5 -6.5 74.2 108 319 A P - 0 0 50 0, 0.0 -1,-0.1 0, 0.0 14,-0.1 -0.327 33.5-108.5 -59.3 130.0 18.0 -2.7 74.3 109 320 A P - 0 0 27 0, 0.0 29,-0.1 0, 0.0 -9,-0.1 -0.259 27.0-154.2 -55.7 143.8 20.3 -0.7 71.9 110 321 A Q + 0 0 74 -11,-0.3 12,-2.7 1,-0.1 2,-0.4 0.641 62.8 65.2-102.0 -13.7 23.0 1.1 73.8 111 322 A L E -B 121 0B 54 -12,-0.3 2,-0.4 10,-0.2 10,-0.2 -0.935 51.0-170.4-122.0 132.5 24.0 4.1 71.7 112 323 A M E -B 120 0B 14 8,-2.4 8,-3.0 -2,-0.4 2,-0.9 -0.941 19.9-138.5-114.7 133.3 22.1 7.2 70.6 113 324 A C E +B 119 0B 5 -2,-0.4 6,-0.2 -21,-0.4 -18,-0.2 -0.785 24.6 172.3 -96.9 106.2 23.6 9.5 67.9 114 325 A L E S- 0 0 25 4,-1.3 -1,-0.2 -2,-0.9 5,-0.2 0.738 74.6 -25.3 -80.4 -23.6 23.0 13.1 68.9 115 326 A M E > S-B 118 0B 60 3,-1.3 3,-1.8 -23,-0.1 -1,-0.3 -0.923 94.2 -56.9-175.5 164.6 25.3 14.3 65.9 116 327 A P T 3 S+ 0 0 113 0, 0.0 3,-0.1 0, 0.0 -3,-0.0 -0.395 126.9 12.4 -57.9 125.1 28.2 12.9 63.8 117 328 A G T 3 S+ 0 0 90 -2,-0.1 2,-0.3 1,-0.1 -4,-0.0 0.675 112.6 92.8 80.8 18.6 31.0 11.9 66.3 118 329 A M E < +B 115 0B 43 -3,-1.8 -4,-1.3 2,-0.0 -3,-1.3 -0.899 46.7 170.5-148.0 110.2 28.8 12.3 69.3 119 330 A T E -B 113 0B 55 -2,-0.3 2,-0.5 -6,-0.2 -6,-0.2 -0.935 24.8-142.1-120.6 148.1 26.9 9.4 70.9 120 331 A L E -B 112 0B 37 -8,-3.0 -8,-2.4 -2,-0.4 2,-0.3 -0.935 22.4-137.0-107.1 125.4 25.1 9.2 74.1 121 332 A H E >> -B 111 0B 71 -2,-0.5 4,-1.5 -10,-0.2 3,-1.4 -0.632 16.3-121.7 -84.8 146.0 25.5 5.9 75.9 122 333 A R H 3> S+ 0 0 49 -12,-2.7 4,-2.7 1,-0.3 5,-0.2 0.823 110.4 62.0 -53.4 -37.2 22.4 4.3 77.5 123 334 A N H 3> S+ 0 0 96 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.853 103.2 48.9 -61.7 -33.0 24.1 4.3 80.9 124 335 A S H <> S+ 0 0 61 -3,-1.4 4,-2.1 2,-0.2 -1,-0.2 0.889 110.3 51.8 -72.7 -37.8 24.4 8.1 80.9 125 336 A A H X>S+ 0 0 1 -4,-1.5 5,-2.4 1,-0.2 4,-0.6 0.915 110.9 48.3 -61.3 -43.6 20.7 8.3 80.0 126 337 A L H ><5S+ 0 0 82 -4,-2.7 3,-0.9 4,-0.2 5,-0.3 0.904 110.2 51.1 -63.5 -41.9 19.9 6.0 82.9 127 338 A Q H 3<5S+ 0 0 141 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.870 108.7 51.2 -65.0 -35.6 21.9 8.0 85.3 128 339 A A H 3<5S- 0 0 58 -4,-2.1 -1,-0.3 -5,-0.1 -2,-0.2 0.564 118.5-111.4 -78.4 -8.9 20.2 11.2 84.2 129 340 A G T <<5S+ 0 0 55 -3,-0.9 -3,-0.2 -4,-0.6 3,-0.2 0.591 92.9 101.6 89.7 14.1 16.8 9.6 84.8 130 341 A V >< + 0 0 30 -5,-2.4 4,-1.9 -6,-0.2 -4,-0.2 -0.021 34.0 119.4-119.2 29.0 15.7 9.5 81.1 131 342 A G H > S+ 0 0 6 -6,-0.4 4,-2.4 -5,-0.3 5,-0.2 0.858 71.8 58.0 -64.1 -34.4 16.3 5.8 80.3 132 343 A Q H > S+ 0 0 137 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.954 110.1 40.9 -61.2 -50.9 12.7 5.2 79.4 133 344 A I H > S+ 0 0 18 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.854 111.4 58.2 -67.2 -33.4 12.5 7.8 76.7 134 345 A F H X S+ 0 0 4 -4,-1.9 4,-2.1 1,-0.2 -1,-0.2 0.959 108.5 46.0 -59.5 -47.0 16.0 6.8 75.4 135 346 A D H X S+ 0 0 40 -4,-2.4 4,-2.3 1,-0.2 5,-0.3 0.882 110.5 53.6 -64.7 -37.0 14.7 3.3 74.9 136 347 A R H X>S+ 0 0 60 -4,-2.0 4,-2.4 2,-0.2 5,-0.8 0.916 107.5 50.9 -63.6 -43.9 11.5 4.6 73.2 137 348 A V H X>S+ 0 0 4 -4,-2.7 5,-2.2 1,-0.2 4,-1.1 0.960 115.0 42.0 -59.7 -47.4 13.5 6.6 70.7 138 349 A L H <>S+ 0 0 1 -4,-2.1 5,-2.4 -5,-0.2 -1,-0.2 0.812 124.9 34.1 -73.3 -25.7 15.7 3.7 69.8 139 350 A S H <>S+ 0 0 48 -4,-2.3 5,-0.8 3,-0.2 -3,-0.2 0.889 123.4 37.5 -95.9 -43.3 12.9 1.1 69.6 140 351 A E H <5S+ 0 0 54 -4,-2.4 -3,-0.2 -5,-0.3 -2,-0.1 0.736 135.4 17.5 -82.4 -21.8 9.8 2.9 68.4 141 352 A L T XS+ 0 0 1 -4,-2.6 5,-2.1 2,-0.2 4,-0.3 0.802 109.6 50.0 -68.8 -30.1 12.8 2.6 60.6 146 357 A R H ><5S+ 0 0 76 -4,-1.9 3,-0.9 -5,-0.2 -1,-0.2 0.912 111.0 49.9 -73.4 -39.3 15.7 0.3 60.0 147 358 A T H 3<5S+ 0 0 98 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.872 112.6 46.8 -64.2 -35.1 13.2 -2.6 59.7 148 359 A L T 3<5S- 0 0 29 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.514 106.4-132.0 -82.5 -6.5 11.1 -0.6 57.2 149 360 A R T < 5 - 0 0 118 -3,-0.9 -3,-0.2 -4,-0.3 -2,-0.1 0.895 29.6-165.2 55.0 42.1 14.3 0.3 55.3 150 361 A V < - 0 0 9 -5,-2.1 -1,-0.2 -6,-0.1 2,-0.1 -0.377 8.1-150.5 -57.5 130.4 13.3 4.0 55.3 151 362 A D > - 0 0 38 -3,-0.1 4,-2.6 1,-0.1 5,-0.2 -0.467 28.0 -94.8-100.3 176.9 15.5 5.7 52.7 152 363 A Q H > S+ 0 0 78 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.896 122.5 53.8 -57.3 -42.5 16.7 9.3 52.4 153 364 A A H > S+ 0 0 7 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.910 112.2 43.2 -59.8 -43.9 13.9 10.3 50.1 154 365 A E H > S+ 0 0 0 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.909 111.5 56.0 -69.5 -40.8 11.2 9.1 52.5 155 366 A Y H X S+ 0 0 6 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.923 109.9 43.3 -57.8 -47.9 13.0 10.6 55.5 156 367 A V H X S+ 0 0 2 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.853 112.7 53.5 -69.6 -31.9 13.1 14.1 54.0 157 368 A A H X S+ 0 0 0 -4,-1.6 4,-2.3 -5,-0.2 -2,-0.2 0.925 109.3 48.7 -65.7 -44.6 9.4 13.8 52.9 158 369 A L H X S+ 0 0 2 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.884 107.3 55.9 -63.7 -38.0 8.4 12.8 56.4 159 370 A K H X S+ 0 0 16 -4,-2.0 4,-2.1 -5,-0.2 -1,-0.2 0.946 108.5 47.3 -58.4 -45.7 10.4 15.8 57.8 160 371 A A H X S+ 0 0 0 -4,-2.0 4,-2.6 1,-0.2 -2,-0.2 0.914 111.9 50.7 -63.3 -40.4 8.4 18.2 55.6 161 372 A I H < S+ 0 0 0 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.896 108.1 52.5 -64.1 -38.0 5.1 16.5 56.7 162 373 A I H < S+ 0 0 4 -4,-2.6 3,-0.3 1,-0.2 -1,-0.2 0.915 113.3 44.5 -63.0 -42.2 6.1 16.8 60.4 163 374 A L H < S+ 0 0 2 -4,-2.1 2,-2.0 1,-0.2 -2,-0.2 0.928 105.8 61.1 -65.7 -48.8 6.7 20.6 59.9 164 375 A L S < S+ 0 0 0 -4,-2.6 -1,-0.2 -5,-0.2 17,-0.1 -0.424 70.8 155.9 -85.7 65.0 3.6 21.2 57.8 165 376 A N > - 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