==== 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 LIPID DEGRADATION 25-SEP-96 1DJI . COMPND 2 MOLECULE: PHOSPHOINOSITIDE-SPECIFIC PHOSPHOLIPASE C, . SOURCE 2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS; . AUTHOR L.-O.ESSEN,O.PERISIC,R.L.WILLIAMS . 1070 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 46455.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 724 67.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 70 6.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 148 13.8 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 0.2 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 . 1 0.1 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 . 86 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 125 11.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 235 22.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 13 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 4 2 0 0 1 6 3 7 1 0 0 2 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 6 5 3 6 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 . 7 6 2 2 0 0 2 6 2 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 . 4 2 0 0 0 0 0 2 2 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 1 200 A E > 0 0 191 0, 0.0 4,-3.4 0, 0.0 5,-0.4 0.000 360.0 360.0 360.0 -71.8 70.4 11.3 33.0 2 201 A I H > + 0 0 146 1,-0.2 4,-0.9 2,-0.2 5,-0.0 0.740 360.0 32.9 -47.1 -28.6 73.8 10.1 34.4 3 202 A E H > S+ 0 0 160 2,-0.2 4,-2.2 3,-0.1 5,-0.3 0.837 119.3 50.0 -94.5 -45.8 74.2 8.0 31.1 4 203 A T H > S+ 0 0 95 2,-0.2 4,-0.6 1,-0.2 -2,-0.2 0.669 120.4 38.8 -67.6 -14.8 72.3 10.4 28.8 5 204 A F H X S+ 0 0 138 -4,-3.4 4,-3.0 2,-0.2 5,-0.4 0.884 110.8 54.9 -95.3 -58.4 74.6 13.2 30.2 6 205 A Y H X S+ 0 0 178 -4,-0.9 4,-1.6 -5,-0.4 -2,-0.2 0.855 114.6 44.0 -39.7 -48.3 77.9 11.4 30.5 7 206 A K H < S+ 0 0 153 -4,-2.2 -1,-0.2 2,-0.2 -2,-0.2 0.926 112.9 48.7 -68.2 -50.2 77.6 10.5 26.8 8 207 A M H >< S+ 0 0 133 -4,-0.6 3,-1.1 -5,-0.3 -2,-0.2 0.858 113.6 45.9 -58.2 -46.2 76.4 13.9 25.5 9 208 A L H 3< S+ 0 0 85 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.928 121.6 40.2 -63.2 -43.5 79.2 15.8 27.3 10 209 A T T 3< S+ 0 0 103 -4,-1.6 2,-0.4 -5,-0.4 -1,-0.3 -0.052 97.5 112.6 -93.9 29.6 81.6 13.2 26.0 11 210 A Q < - 0 0 92 -3,-1.1 2,-0.5 4,-0.0 -3,-0.0 -0.901 44.1-169.5-113.7 136.9 80.0 13.0 22.6 12 211 A R >> - 0 0 41 -2,-0.4 4,-2.4 1,-0.1 3,-0.7 -0.842 6.6-172.8-128.3 97.7 81.5 14.0 19.2 13 212 A A H 3> S+ 0 0 40 -2,-0.5 4,-3.6 1,-0.3 5,-0.2 0.853 87.7 56.4 -50.8 -47.1 79.2 14.1 16.2 14 213 A E H 3> S+ 0 0 16 1,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.874 110.1 47.7 -58.9 -34.4 82.0 14.8 13.8 15 214 A I H <> S+ 0 0 4 -3,-0.7 4,-2.8 2,-0.2 5,-0.3 0.959 110.9 50.1 -69.7 -49.7 83.7 11.7 15.0 16 215 A D H X S+ 0 0 24 -4,-2.4 4,-3.1 1,-0.2 -2,-0.2 0.948 112.0 48.1 -50.0 -53.9 80.4 9.7 14.8 17 216 A R H X S+ 0 0 138 -4,-3.6 4,-3.0 1,-0.2 5,-0.2 0.936 111.1 50.7 -53.3 -52.1 79.9 10.9 11.2 18 217 A A H X S+ 0 0 2 -4,-2.2 4,-2.1 -5,-0.2 -1,-0.2 0.884 112.1 45.9 -56.5 -42.9 83.5 10.1 10.3 19 218 A F H X S+ 0 0 14 -4,-2.8 4,-4.1 2,-0.2 5,-0.4 0.936 111.6 53.9 -65.8 -44.0 83.2 6.6 11.7 20 219 A E H X S+ 0 0 105 -4,-3.1 4,-5.8 -5,-0.3 -2,-0.2 0.954 108.5 47.5 -53.4 -57.6 79.9 6.2 9.9 21 220 A E H < S+ 0 0 122 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.943 118.2 42.5 -51.3 -48.5 81.2 7.1 6.5 22 221 A A H < S+ 0 0 13 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.926 130.2 25.9 -63.7 -47.1 84.1 4.8 7.0 23 222 A A H >< S- 0 0 2 -4,-4.1 3,-0.8 1,-0.2 -2,-0.2 0.756 86.9-172.5 -90.9 -27.4 82.0 2.0 8.5 24 223 A G T 3< - 0 0 36 -4,-5.8 -1,-0.2 -5,-0.4 -2,-0.1 -0.480 68.5 -8.6 70.6-136.9 78.7 2.7 7.0 25 224 A S T 3 S+ 0 0 135 -2,-0.2 -1,-0.3 -4,-0.1 -2,-0.1 0.909 114.4 95.0 -56.5 -50.5 75.8 0.5 8.3 26 225 A A S < S- 0 0 47 -3,-0.8 -3,-0.1 1,-0.2 3,-0.0 0.036 72.2-139.8 -47.1 151.7 78.1 -1.8 10.3 27 226 A E S S+ 0 0 181 -4,-0.0 46,-0.4 45,-0.0 2,-0.3 0.465 85.7 46.2 -92.1 -4.0 78.8 -1.0 13.9 28 227 A T S S- 0 0 32 -5,-0.2 2,-0.6 44,-0.1 44,-0.2 -0.884 79.3-120.3-136.4 162.9 82.3 -2.0 13.4 29 228 A L E -A 71 0A 0 42,-2.5 42,-3.1 -2,-0.3 2,-0.2 -0.948 27.0-149.2-107.2 120.9 85.2 -1.4 11.0 30 229 A S E >> -A 70 0A 39 -2,-0.6 4,-2.8 40,-0.2 3,-0.6 -0.607 30.1-108.0 -82.3 148.9 86.6 -4.5 9.4 31 230 A V H 3> S+ 0 0 31 38,-1.4 4,-2.9 1,-0.3 5,-0.2 0.856 122.7 54.4 -43.9 -41.9 90.3 -4.5 8.6 32 231 A E H 3> S+ 0 0 145 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.946 111.3 43.9 -61.6 -45.6 89.3 -4.2 4.9 33 232 A R H <> S+ 0 0 108 -3,-0.6 4,-2.1 2,-0.2 -2,-0.2 0.878 111.8 53.5 -68.8 -33.0 87.2 -1.2 5.6 34 233 A L H X S+ 0 0 0 -4,-2.8 4,-3.4 2,-0.2 3,-0.4 0.980 107.8 50.9 -62.1 -53.6 89.9 0.3 7.9 35 234 A V H X S+ 0 0 24 -4,-2.9 4,-2.1 1,-0.3 5,-0.3 0.889 108.6 51.8 -51.5 -39.8 92.5 -0.1 5.1 36 235 A T H X S+ 0 0 65 -4,-1.9 4,-3.7 -5,-0.2 5,-0.5 0.918 111.2 47.9 -66.0 -34.9 90.1 1.6 2.8 37 236 A F H X>S+ 0 0 6 -4,-2.1 4,-2.3 -3,-0.4 5,-2.1 0.974 109.3 52.6 -66.0 -51.9 89.9 4.4 5.3 38 237 A L H <5S+ 0 0 0 -4,-3.4 6,-3.7 3,-0.2 -1,-0.2 0.813 122.4 31.1 -51.7 -36.2 93.6 4.6 5.7 39 238 A Q H X5S+ 0 0 91 -4,-2.1 4,-0.6 -5,-0.3 -2,-0.2 0.911 123.2 41.9 -91.3 -55.6 94.0 4.9 1.9 40 239 A H H <5S+ 0 0 120 -4,-3.7 -3,-0.2 -5,-0.3 -2,-0.2 0.941 134.6 13.8 -58.9 -49.3 90.9 6.7 0.8 41 240 A Q T <5S+ 0 0 38 -4,-2.3 -3,-0.2 -5,-0.5 -4,-0.1 0.890 133.2 38.1 -95.6 -51.3 90.8 9.3 3.6 42 241 A Q T 4> S- 0 0 14 -2,-0.4 4,-2.0 1,-0.0 3,-1.1 -0.938 84.9 -78.8-174.4 163.4 97.7 -2.0 3.9 49 248 A P H 3> S+ 0 0 89 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.750 126.0 61.7 -44.3 -31.3 96.4 -4.7 6.3 50 249 A A H 3> S+ 0 0 81 2,-0.2 4,-1.3 3,-0.2 5,-0.1 0.952 108.6 40.0 -64.6 -48.8 99.7 -4.5 8.1 51 250 A L H X> S+ 0 0 28 -3,-1.1 4,-2.5 -5,-0.5 3,-1.2 0.990 117.0 49.9 -60.9 -60.1 99.2 -0.9 9.0 52 251 A A H 3X S+ 0 0 0 -4,-2.0 4,-2.6 1,-0.3 5,-0.2 0.880 110.7 50.3 -44.0 -48.9 95.4 -1.4 9.8 53 252 A L H 3X S+ 0 0 56 -4,-2.8 4,-2.1 -5,-0.2 -1,-0.3 0.796 110.5 48.7 -66.4 -28.5 96.2 -4.4 12.0 54 253 A S H - 0 0 38 1,-0.2 4,-3.2 8,-0.1 5,-0.2 -0.570 61.2-159.2 -76.4 120.1 87.5 -3.9 22.7 63 262 A E H > S+ 0 0 133 -2,-0.5 4,-2.5 2,-0.2 5,-0.3 0.890 94.8 52.2 -62.0 -40.0 89.0 -7.4 23.2 64 263 A T H > S+ 0 0 92 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.989 115.9 38.8 -59.2 -58.6 86.3 -8.9 21.1 65 264 A A H 4>S+ 0 0 3 2,-0.2 5,-3.3 1,-0.2 -2,-0.2 0.853 114.9 54.1 -59.7 -40.5 87.0 -6.5 18.2 66 265 A K H ><5S+ 0 0 74 -4,-3.2 3,-2.2 3,-0.2 -1,-0.2 0.993 113.1 41.6 -58.1 -59.5 90.7 -6.6 18.7 67 266 A A H 3<5S+ 0 0 72 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.855 115.6 50.9 -55.4 -39.5 90.9 -10.4 18.5 68 267 A Q T 3<5S- 0 0 113 -4,-2.4 -1,-0.3 -5,-0.3 -2,-0.2 0.174 117.6-114.1 -87.8 19.5 88.4 -10.4 15.6 69 268 A R T < 5S+ 0 0 148 -3,-2.2 -38,-1.4 1,-0.2 2,-0.3 0.886 72.8 126.7 47.3 54.2 90.5 -7.8 13.8 70 269 A Q E < -A 30 0A 61 -5,-3.3 2,-0.5 -40,-0.2 -40,-0.2 -0.921 52.3-134.4-134.2 158.2 87.9 -5.0 13.9 71 270 A M E -A 29 0A 0 -42,-3.1 -42,-2.5 -2,-0.3 2,-0.1 -0.967 14.4-154.7-121.7 127.8 87.8 -1.4 15.0 72 271 A T > - 0 0 24 -2,-0.5 4,-2.4 -44,-0.2 5,-0.1 -0.422 37.8-101.8 -88.7 168.4 85.0 0.1 17.2 73 272 A K H > S+ 0 0 82 -46,-0.4 4,-2.9 1,-0.2 5,-0.2 0.915 125.8 56.6 -58.5 -36.9 84.2 3.7 17.2 74 273 A D H > S+ 0 0 110 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.938 108.7 43.5 -58.0 -50.4 86.1 3.9 20.4 75 274 A G H > S+ 0 0 0 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.835 110.7 57.9 -64.1 -32.2 89.2 2.5 18.8 76 275 A F H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.966 110.3 42.5 -61.7 -51.2 88.6 4.8 15.9 77 276 A L H X S+ 0 0 44 -4,-2.9 4,-1.7 1,-0.2 -2,-0.2 0.903 112.0 54.1 -61.9 -43.4 88.7 7.8 18.2 78 277 A M H X S+ 0 0 100 -4,-2.6 4,-0.8 -5,-0.2 3,-0.3 0.922 110.2 47.3 -58.0 -44.4 91.7 6.5 20.1 79 278 A Y H >< S+ 0 0 1 -4,-2.5 3,-1.3 1,-0.2 6,-0.7 0.962 110.6 52.1 -60.3 -49.7 93.5 6.1 16.9 80 279 A L H 3< S+ 0 0 0 -4,-2.5 410,-0.5 1,-0.3 -1,-0.2 0.715 112.5 45.2 -58.5 -26.6 92.5 9.6 15.8 81 280 A L H 3< S+ 0 0 63 -4,-1.7 -1,-0.3 -3,-0.3 -2,-0.2 0.531 101.1 91.7 -95.7 -8.1 93.8 11.1 19.1 82 281 A S S XX S- 0 0 18 -3,-1.3 4,-0.9 -4,-0.8 3,-0.7 -0.148 98.3 -93.7 -78.6 178.7 97.1 9.1 19.0 83 282 A A T 34 S+ 0 0 38 1,-0.3 7,-0.4 2,-0.2 -1,-0.1 0.721 129.1 55.8 -62.7 -22.8 100.5 10.0 17.7 84 283 A D T 34 S+ 0 0 32 -5,-0.2 -1,-0.3 1,-0.2 6,-0.1 0.735 108.0 45.9 -82.4 -25.5 99.3 8.1 14.5 85 284 A G T <4 S+ 0 0 0 -3,-0.7 405,-1.7 -6,-0.7 -2,-0.2 0.488 88.6 120.3 -93.1 -5.7 96.2 10.4 14.2 86 285 A N B < -b 490 0B 13 -4,-0.9 4,-0.3 403,-0.2 405,-0.2 -0.340 67.4-136.2 -59.4 135.3 98.5 13.5 14.8 87 286 A A S S+ 0 0 0 403,-1.9 398,-2.7 1,-0.1 2,-0.8 0.748 94.6 77.8 -66.6 -20.4 98.5 16.1 12.0 88 287 A F B S-J 484 0C 10 402,-0.3 396,-0.2 396,-0.2 -2,-0.1 -0.817 104.3-106.4 -93.4 109.5 102.2 16.2 12.5 89 288 A S > - 0 0 7 394,-3.5 3,-0.8 -2,-0.8 4,-0.4 -0.016 21.1-154.7 -40.5 114.0 103.6 13.1 10.9 90 289 A L G > S+ 0 0 65 -7,-0.4 3,-1.6 -4,-0.3 -1,-0.2 0.874 94.1 60.8 -56.9 -41.0 104.7 10.5 13.4 91 290 A A G > S+ 0 0 59 1,-0.3 3,-0.6 2,-0.1 -1,-0.3 0.866 102.3 50.9 -57.5 -37.1 107.2 9.1 10.9 92 291 A H G < S+ 0 0 34 -3,-0.8 263,-2.2 1,-0.2 264,-0.3 0.514 88.8 84.5 -79.3 -4.1 109.0 12.4 10.8 93 292 A R G < S+ 0 0 84 -3,-1.6 2,-0.3 -4,-0.4 -1,-0.2 0.171 89.3 54.5 -86.5 22.4 109.2 12.5 14.6 94 293 A R S < S- 0 0 149 -3,-0.6 261,-0.5 262,-0.0 2,-0.3 -0.968 109.2 -79.7-146.0 153.0 112.3 10.3 14.5 95 294 A V + 0 0 48 -2,-0.3 260,-0.1 260,-0.3 -2,-0.1 -0.406 65.4 144.6 -59.6 117.8 115.6 10.9 12.7 96 295 A Y + 0 0 69 -2,-0.3 -1,-0.2 -4,-0.2 2,-0.2 0.344 36.1 99.9-134.6 -2.3 114.8 9.8 9.1 97 296 A Q S S- 0 0 39 1,-0.1 2,-0.8 -5,-0.1 263,-0.0 -0.512 85.7 -86.2 -92.3 163.7 116.8 12.2 7.0 98 297 A D > - 0 0 71 -2,-0.2 3,-0.5 1,-0.2 -1,-0.1 -0.486 41.9-177.5 -66.6 107.0 120.2 11.8 5.2 99 298 A M T 3 + 0 0 6 -2,-0.8 131,-2.2 1,-0.2 132,-0.3 0.104 60.3 83.1 -96.0 25.4 122.6 12.7 7.9 100 299 A D T 3 + 0 0 111 129,-0.1 -1,-0.2 128,-0.1 128,-0.1 0.341 64.1 95.6-112.0 7.7 125.8 12.3 5.8 101 300 A Q S < S- 0 0 36 -3,-0.5 129,-0.2 1,-0.1 2,-0.1 -0.468 86.5 -77.0 -93.7 169.3 126.1 15.6 3.9 102 301 A P > - 0 0 20 0, 0.0 3,-3.0 0, 0.0 126,-0.3 -0.396 45.5-107.5 -67.2 143.4 128.2 18.6 4.9 103 302 A L G > S+ 0 0 1 124,-2.4 3,-2.0 1,-0.3 125,-0.1 0.755 114.9 69.5 -37.0 -39.8 126.9 20.8 7.7 104 303 A S G 3 S+ 0 0 0 1,-0.3 -1,-0.3 199,-0.2 200,-0.2 0.551 89.3 64.7 -63.5 -8.3 126.1 23.6 5.2 105 304 A H G < S+ 0 0 24 -3,-3.0 257,-3.3 198,-0.1 2,-0.3 0.401 94.2 70.6 -93.6 -0.9 123.3 21.4 3.8 106 305 A Y E < S-K 361 0D 0 -3,-2.0 2,-0.3 255,-0.3 255,-0.3 -0.853 79.5-124.3-117.2 153.2 121.1 21.4 7.0 107 306 A L E -K 360 0D 20 253,-3.1 253,-2.2 -2,-0.3 2,-0.5 -0.727 38.2-149.9 -85.4 141.8 119.1 24.1 8.7 108 307 A V E -K 359 0D 2 223,-2.3 225,-0.5 -2,-0.3 2,-0.4 -0.981 15.8-116.5-125.4 128.8 120.6 24.1 12.2 109 308 A S - 0 0 0 249,-2.1 31,-2.3 -2,-0.5 30,-2.2 -0.458 46.7-177.3 -63.6 116.0 118.7 25.0 15.4 110 309 A S E -lm 140 334E 1 223,-0.6 225,-1.8 -2,-0.4 2,-0.3 -0.975 19.1-152.4-130.0 140.3 120.5 28.1 16.7 111 310 A S E - m 0 335E 2 29,-3.1 2,-0.5 -2,-0.4 3,-0.4 -0.802 11.5-138.0-110.3 143.6 120.2 30.3 19.7 112 311 A H S S- 0 0 18 223,-3.2 225,-0.2 -2,-0.3 4,-0.2 -0.881 83.4 -15.9-106.5 127.1 121.1 34.0 20.1 113 312 A N S > S- 0 0 9 -2,-0.5 3,-2.7 1,-0.1 -1,-0.2 0.934 79.8-169.4 45.8 53.7 122.9 35.3 23.2 114 313 A T T 3 S+ 0 0 3 -3,-0.4 19,-0.2 1,-0.3 -1,-0.1 0.655 72.2 69.2 -44.9 -30.6 121.9 32.0 24.8 115 314 A Y T 3 S+ 0 0 0 27,-0.6 11,-2.2 14,-0.1 14,-0.3 0.654 80.7 95.2 -68.2 -19.2 122.9 33.0 28.2 116 315 A L B < -U 125 0F 2 -3,-2.7 9,-0.2 9,-0.2 222,-0.1 -0.565 46.3-175.8 -81.9 140.3 120.0 35.5 28.5 117 316 A L S S- 0 0 49 7,-2.2 8,-0.1 -2,-0.2 -1,-0.1 0.591 75.9 -0.2-102.6 -23.5 116.7 34.7 30.1 118 317 A E S S- 0 0 107 6,-0.8 220,-0.1 1,-0.4 -2,-0.1 -0.119 109.7 -4.5-132.5-129.1 115.0 38.0 29.4 119 318 A D - 0 0 39 -2,-0.1 -1,-0.4 1,-0.1 197,-0.2 -0.126 59.6-115.8 -72.0 171.7 115.8 41.3 27.7 120 319 A Q S S+ 0 0 12 195,-2.6 42,-0.2 1,-0.1 196,-0.1 0.496 101.7 46.2 -87.2 -7.4 119.2 42.4 26.2 121 320 A L S S- 0 0 80 194,-0.5 40,-3.0 40,-0.1 41,-0.1 0.790 128.3 -8.3-108.8 -39.9 119.9 45.3 28.5 122 321 A T S S+ 0 0 91 38,-0.2 41,-0.2 39,-0.1 -2,-0.1 0.443 93.9 110.2-138.9 -6.7 119.3 44.6 32.2 123 322 A G S S- 0 0 4 -4,-0.2 40,-1.5 1,-0.1 2,-0.1 -0.070 72.0 -78.0 -68.5 178.3 117.6 41.2 32.6 124 323 A P - 0 0 43 0, 0.0 -7,-2.2 0, 0.0 -6,-0.8 -0.307 30.1-149.1 -82.3 159.8 119.3 38.1 34.1 125 324 A S B +U 116 0F 8 -9,-0.2 2,-0.3 39,-0.1 -9,-0.2 -0.879 26.2 165.2-118.4 153.8 121.8 35.6 32.6 126 325 A S >> - 0 0 29 -11,-2.2 3,-0.8 -2,-0.3 4,-0.7 -0.948 52.0-123.4-171.5 149.8 121.9 32.0 33.7 127 326 A T H >> S+ 0 0 43 -2,-0.3 4,-2.2 1,-0.3 3,-0.6 0.815 111.7 70.5 -63.2 -29.3 123.1 28.5 32.9 128 327 A E H 3> S+ 0 0 70 1,-0.3 4,-3.3 2,-0.2 -1,-0.3 0.919 90.7 59.6 -53.1 -40.6 119.5 27.6 33.0 129 328 A A H <> S+ 0 0 9 -3,-0.8 4,-1.9 -14,-0.3 -1,-0.3 0.857 107.4 44.5 -56.3 -40.8 119.2 29.6 29.8 130 329 A Y H <>S+ 0 0 2 -4,-1.9 5,-2.5 -5,-0.3 3,-0.5 0.900 111.9 48.8 -56.7 -41.5 117.8 25.9 24.9 134 333 A L H ><5S+ 0 0 0 -4,-1.9 3,-1.9 1,-0.3 -1,-0.3 0.900 108.1 53.7 -66.7 -37.7 119.6 22.6 24.8 135 334 A C H 3<5S+ 0 0 52 -4,-2.7 -1,-0.3 1,-0.3 -2,-0.2 0.716 103.1 58.7 -69.8 -16.5 116.5 20.8 26.0 136 335 A K T <<5S- 0 0 77 -4,-1.3 -1,-0.3 -3,-0.5 -2,-0.2 0.249 127.6-102.1 -93.0 10.9 114.6 22.4 23.2 137 336 A G T < 5 + 0 0 7 -3,-1.9 -28,-0.2 1,-0.2 -3,-0.2 0.491 63.4 164.9 84.7 5.9 117.0 20.8 20.8 138 337 A C < - 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0 0 11 -5,-1.1 3,-0.3 -6,-0.2 -1,-0.2 -0.426 60.9-119.0 -67.0 73.2 43.4 22.0 -43.9 533 175 B Q - 0 0 74 -2,-3.0 464,-0.2 1,-0.2 465,-0.2 0.154 35.0-115.7 -23.7 72.6 43.6 25.8 -44.0 534 176 B V - 0 0 22 -10,-0.2 -1,-0.2 -9,-0.1 4,-0.0 0.221 28.3-132.3 -21.0 103.5 40.4 26.2 -46.0 535 177 B D - 0 0 11 -3,-0.3 -1,-0.1 1,-0.1 461,-0.1 -0.214 20.4-116.4 -64.4 160.3 41.3 27.7 -49.3 536 178 B D S S- 0 0 67 459,-0.3 4,-0.4 1,-0.1 -1,-0.1 0.959 81.7 -19.9 -63.2-101.6 39.2 30.7 -50.4 537 179 B G S > S+ 0 0 47 2,-0.2 4,-2.4 1,-0.1 5,-0.2 0.423 125.0 80.7 -91.5 -2.9 37.1 30.5 -53.6 538 180 B Y H > S+ 0 0 74 1,-0.2 4,-2.6 2,-0.2 5,-0.3 0.988 89.2 53.0 -64.6 -52.4 39.3 27.6 -54.6 539 181 B A H > S+ 0 0 1 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.818 110.6 46.3 -49.5 -39.4 37.2 25.4 -52.3 540 182 B R H > S+ 0 0 116 -4,-0.4 4,-3.8 2,-0.2 -1,-0.2 0.948 110.6 51.4 -69.3 -52.4 34.0 26.5 -54.0 541 183 B K H X S+ 0 0 115 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.940 114.5 43.6 -49.1 -51.6 35.3 26.1 -57.5 542 184 B I H X S+ 0 0 4 -4,-2.6 4,-0.8 2,-0.2 -1,-0.2 0.878 112.5 52.8 -62.5 -42.6 36.5 22.6 -56.7 543 185 B F H >X S+ 0 0 2 -4,-2.0 3,-1.3 -5,-0.3 4,-0.8 0.952 109.5 49.8 -58.2 -48.9 33.2 21.9 -54.9 544 186 B R H >< S+ 0 0 105 -4,-3.8 3,-1.7 1,-0.3 -2,-0.2 0.935 105.5 56.6 -52.8 -54.1 31.4 23.0 -58.1 545 187 B E H 3< S+ 0 0 98 -4,-2.6 -1,-0.3 1,-0.3 -2,-0.2 0.675 108.6 49.7 -54.0 -20.6 33.5 20.8 -60.3 546 188 B C H << S+ 0 0 4 -3,-1.3 2,-1.1 -4,-0.8 -1,-0.3 0.605 86.9 90.9 -97.6 -13.0 32.4 17.9 -58.2 547 189 B D << + 0 0 5 -3,-1.7 3,-0.4 -4,-0.8 -1,-0.1 -0.711 43.3 174.3 -89.5 96.9 28.7 18.4 -58.2 548 190 B H S S+ 0 0 153 -2,-1.1 -1,-0.2 1,-0.2 6,-0.1 0.976 79.1 54.6 -61.2 -53.3 27.2 16.5 -61.1 549 191 B S S S- 0 0 50 4,-0.2 -1,-0.2 1,-0.1 -2,-0.1 0.652 95.7-137.5 -52.4 -29.7 23.6 17.4 -60.0 550 192 B Q S S+ 0 0 149 -3,-0.4 -1,-0.1 3,-0.2 -2,-0.1 0.628 72.1 117.7 73.7 15.3 24.1 21.1 -59.9 551 193 B T S S- 0 0 85 2,-0.2 3,-0.1 0, 0.0 -1,-0.1 0.425 87.4-113.6 -89.2 -5.0 22.2 21.2 -56.6 552 194 B D S S+ 0 0 65 1,-0.3 -32,-0.4 -8,-0.1 2,-0.3 0.854 80.5 116.9 71.6 37.6 25.1 22.5 -54.7 553 195 B S - 0 0 36 -34,-0.1 2,-0.7 -9,-0.1 -1,-0.3 -0.973 60.9-134.6-134.5 147.1 25.3 19.3 -52.7 554 196 B L B -X 518 0H 0 -36,-2.6 -36,-2.3 -2,-0.3 -7,-0.1 -0.889 19.1-155.8-111.5 108.4 28.0 16.7 -52.5 555 197 B E > - 0 0 109 -2,-0.7 4,-1.4 -38,-0.2 -38,-0.1 -0.234 40.3 -85.9 -70.3 167.8 26.9 13.1 -52.7 556 198 B D H >> S+ 0 0 124 -40,-0.3 3,-1.4 1,-0.2 4,-1.2 0.911 126.1 38.5 -39.1 -71.4 28.9 10.3 -51.2 557 199 B E H >> S+ 0 0 147 1,-0.3 4,-2.0 2,-0.2 3,-0.9 0.916 111.4 57.2 -49.4 -57.1 31.2 9.6 -54.2 558 200 B E H 3> S+ 0 0 10 1,-0.3 4,-1.7 2,-0.2 -1,-0.3 0.736 101.9 59.8 -50.4 -24.7 31.6 13.3 -55.2 559 201 B I H > - 0 0 37 1,-0.2 4,-2.2 -2,-0.1 3,-1.0 -0.835 6.8-172.5-112.9 94.4 50.1 16.2 -55.0 570 212 B A H 3> S+ 0 0 63 -2,-0.7 4,-3.1 1,-0.3 5,-0.3 0.860 82.9 58.1 -50.2 -46.7 50.9 15.9 -58.6 571 213 B E H 3> S+ 0 0 46 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.840 109.7 46.9 -56.8 -33.4 54.6 16.2 -58.2 572 214 B I H <> S+ 0 0 4 -3,-1.0 4,-2.7 2,-0.2 -1,-0.2 0.914 108.8 53.8 -74.5 -44.7 54.4 13.2 -55.9 573 215 B D H X S+ 0 0 35 -4,-2.2 4,-2.9 1,-0.2 -2,-0.2 0.954 111.7 45.7 -53.5 -51.7 52.2 11.2 -58.3 574 216 B R H X S+ 0 0 162 -4,-3.1 4,-2.6 1,-0.2 5,-0.2 0.888 109.9 53.1 -62.4 -40.6 54.7 11.7 -61.1 575 217 B A H X S+ 0 0 4 -4,-1.6 4,-1.9 -5,-0.3 -1,-0.2 0.942 112.7 44.7 -61.1 -44.6 57.7 10.9 -58.9 576 218 B F H X S+ 0 0 13 -4,-2.7 4,-3.9 2,-0.2 5,-0.4 0.969 111.0 54.0 -61.8 -52.2 56.0 7.6 -57.9 577 219 B E H X S+ 0 0 119 -4,-2.9 4,-3.5 1,-0.2 -2,-0.2 0.925 108.0 49.0 -51.2 -46.0 55.0 6.8 -61.4 578 220 B E H < S+ 0 0 100 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.921 117.5 42.5 -61.0 -40.9 58.5 7.2 -62.8 579 221 B A H < S+ 0 0 12 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.919 124.0 34.5 -70.2 -46.3 59.8 5.0 -60.1 580 222 B A H >< S- 0 0 1 -4,-3.9 3,-0.7 1,-0.2 2,-0.4 0.829 85.3-173.8 -78.8 -36.0 57.1 2.4 -60.2 581 223 B G T 3< - 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