==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE, LYASE/DNA 19-OCT-05 2BCV . COMPND 2 MOLECULE: 5'-D(P*GP*CP*CP*G)-3'; . SOURCE 2 SYNTHETIC: YES; . AUTHOR M.GARCIA-DIAZ,K.BEBENEK,J.M.KRAHN,L.C.PEDERSEN,T.A.KUNKEL . 323 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16445.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 224 69.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 7 2.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 32 9.9 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 . 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 . 16 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 44 13.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 113 35.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 2.5 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 1 0 2 1 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 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 PARALLEL BRIDGES PER LADDER . 0 4 0 2 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 ANTIPARALLEL BRIDGES PER LADDER . 2 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 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 1 253 A N 0 0 108 0, 0.0 36,-0.1 0, 0.0 38,-0.1 0.000 360.0 360.0 360.0 157.8 31.1 9.3 26.9 2 254 A L > - 0 0 18 1,-0.1 3,-1.3 2,-0.1 4,-0.2 0.993 360.0-165.7 75.2 80.1 29.8 5.8 26.2 3 255 A H T 3 S+ 0 0 70 1,-0.3 4,-0.4 2,-0.2 -1,-0.1 0.250 77.9 91.0 -76.3 16.5 30.3 4.5 22.7 4 256 A I T 3 S+ 0 0 18 1,-0.2 4,-0.4 2,-0.1 -1,-0.3 0.398 83.8 64.4 -84.3 2.0 27.8 1.6 23.5 5 257 A T S X> S+ 0 0 25 -3,-1.3 4,-3.3 2,-0.2 3,-1.3 0.890 82.1 65.3 -89.1 -50.3 25.5 4.4 22.2 6 258 A E H 3> S+ 0 0 138 1,-0.3 4,-0.6 -4,-0.2 -2,-0.1 0.773 105.5 51.0 -46.1 -26.1 26.7 4.6 18.6 7 259 A K H 3> S+ 0 0 28 -4,-0.4 4,-0.9 2,-0.2 -1,-0.3 0.809 112.2 43.5 -81.9 -33.2 25.3 1.1 18.3 8 260 A L H <> S+ 0 0 6 -3,-1.3 4,-2.4 -4,-0.4 -2,-0.2 0.804 105.5 63.9 -78.2 -30.4 21.9 1.9 19.8 9 261 A E H X S+ 0 0 98 -4,-3.3 4,-2.1 1,-0.2 -1,-0.2 0.818 98.7 56.3 -61.1 -30.6 21.8 5.1 17.7 10 262 A V H X S+ 0 0 73 -4,-0.6 4,-1.9 -5,-0.3 -1,-0.2 0.918 108.8 44.3 -67.3 -45.2 21.7 2.8 14.7 11 263 A L H X S+ 0 0 4 -4,-0.9 4,-2.5 2,-0.2 5,-0.2 0.855 110.7 56.9 -67.1 -35.2 18.6 1.0 16.0 12 264 A A H X S+ 0 0 8 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.940 109.6 42.5 -61.1 -50.3 17.1 4.3 16.9 13 265 A K H X S+ 0 0 33 -4,-2.1 4,-3.1 2,-0.2 5,-0.3 0.876 112.3 55.9 -64.9 -38.5 17.3 5.7 13.4 14 266 A A H X S+ 0 0 3 -4,-1.9 4,-1.5 2,-0.2 -2,-0.2 0.938 111.0 42.4 -59.1 -50.5 16.1 2.4 12.0 15 267 A Y H <>S+ 0 0 34 -4,-2.5 5,-2.4 2,-0.2 -1,-0.2 0.909 115.1 52.8 -62.9 -42.0 12.9 2.4 14.0 16 268 A S H ><5S+ 0 0 64 -4,-2.4 3,-2.0 1,-0.2 -2,-0.2 0.946 109.1 45.3 -60.5 -53.6 12.5 6.1 13.3 17 269 A V H 3<5S+ 0 0 13 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.813 110.6 57.0 -62.7 -27.3 12.7 5.9 9.5 18 270 A Q T 3<5S- 0 0 71 -4,-1.5 -1,-0.3 -5,-0.3 -2,-0.2 0.465 120.8-110.7 -81.9 0.2 10.4 2.9 9.7 19 271 A G T < 5S+ 0 0 35 -3,-2.0 2,-2.1 -4,-0.2 3,-0.2 0.474 78.2 130.9 88.7 -0.2 7.8 5.0 11.4 20 272 A D >< + 0 0 60 -5,-2.4 4,-2.4 1,-0.2 5,-0.2 -0.469 27.9 165.7 -84.8 67.8 8.0 3.4 14.9 21 273 A K H > + 0 0 115 -2,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.829 66.2 49.8 -54.6 -42.0 8.3 6.9 16.5 22 274 A W H > S+ 0 0 161 -3,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.926 111.9 46.2 -67.7 -44.9 7.5 5.9 20.1 23 275 A R H > S+ 0 0 106 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.923 114.6 50.2 -62.2 -40.8 10.0 3.0 20.2 24 276 A A H X S+ 0 0 10 -4,-2.4 4,-3.0 2,-0.2 -2,-0.2 0.884 107.8 52.9 -62.3 -39.6 12.5 5.4 18.6 25 277 A L H X S+ 0 0 36 -4,-2.3 4,-2.7 2,-0.2 -2,-0.2 0.954 106.6 53.3 -61.2 -47.3 11.7 7.9 21.2 26 278 A G H X S+ 0 0 34 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.927 111.5 45.0 -52.4 -48.6 12.4 5.3 23.9 27 279 A Y H X S+ 0 0 11 -4,-2.3 4,-3.5 1,-0.2 5,-0.3 0.924 109.7 55.1 -62.6 -44.5 15.8 4.7 22.3 28 280 A A H X S+ 0 0 33 -4,-3.0 4,-2.2 1,-0.2 -1,-0.2 0.902 110.0 47.2 -54.3 -43.6 16.6 8.4 21.9 29 281 A K H X S+ 0 0 113 -4,-2.7 4,-2.5 2,-0.2 -1,-0.2 0.947 114.6 45.5 -63.4 -50.9 15.9 8.8 25.7 30 282 A A H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.921 114.0 48.4 -58.6 -47.8 18.1 5.8 26.6 31 283 A I H X S+ 0 0 14 -4,-3.5 4,-2.1 1,-0.2 -1,-0.2 0.884 112.2 51.0 -60.2 -39.2 20.9 6.9 24.3 32 284 A N H X S+ 0 0 67 -4,-2.2 4,-0.9 -5,-0.3 -2,-0.2 0.890 108.0 51.0 -66.1 -42.2 20.6 10.4 25.7 33 285 A A H X S+ 0 0 18 -4,-2.5 4,-0.5 2,-0.2 3,-0.5 0.915 110.6 49.4 -62.4 -43.8 20.9 9.2 29.3 34 286 A L H >< S+ 0 0 2 -4,-2.2 3,-1.2 1,-0.2 -2,-0.2 0.931 110.6 48.6 -61.2 -47.9 24.0 7.2 28.5 35 287 A K H 3< S+ 0 0 55 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.672 112.3 52.7 -66.9 -16.1 25.7 10.1 26.8 36 288 A S H 3< S+ 0 0 89 -4,-0.9 -1,-0.2 -3,-0.5 -2,-0.2 0.447 87.0 99.0-100.2 -3.1 24.8 12.3 29.8 37 289 A F S << S- 0 0 35 -3,-1.2 4,-0.0 -4,-0.5 -3,-0.0 -0.487 72.5-128.2 -85.6 158.7 26.2 10.1 32.6 38 290 A H S S+ 0 0 107 -2,-0.1 -1,-0.1 1,-0.1 -4,-0.0 0.610 81.9 36.6 -81.9 -14.8 29.6 10.7 34.3 39 291 A K S S- 0 0 53 -38,-0.1 -1,-0.1 -37,-0.0 -2,-0.1 -0.995 88.2 -90.0-145.1 150.1 31.2 7.3 34.0 40 292 A P - 0 0 85 0, 0.0 2,-0.4 0, 0.0 -2,-0.1 -0.224 45.3-120.6 -53.7 133.4 31.4 4.3 31.6 41 293 A V + 0 0 10 1,-0.1 3,-0.1 -4,-0.0 6,-0.0 -0.652 42.4 159.1 -81.6 130.8 28.7 1.7 32.2 42 294 A T + 0 0 81 -2,-0.4 2,-0.3 1,-0.1 -1,-0.1 -0.187 51.8 60.6-145.5 45.2 30.1 -1.8 33.1 43 295 A S > - 0 0 47 1,-0.1 4,-1.1 15,-0.0 -1,-0.1 -0.868 67.5-133.0-173.0 137.0 27.2 -3.6 34.9 44 296 A Y H >> S+ 0 0 119 -2,-0.3 4,-1.9 1,-0.2 3,-1.0 0.940 113.3 46.9 -57.2 -50.7 23.6 -4.7 34.2 45 297 A Q H 3> S+ 0 0 74 1,-0.3 4,-1.8 2,-0.2 -1,-0.2 0.834 107.0 58.4 -61.3 -33.5 22.4 -3.3 37.5 46 298 A E H 34 S+ 0 0 76 1,-0.2 4,-0.4 2,-0.2 -1,-0.3 0.760 107.4 49.1 -67.9 -23.9 24.3 -0.1 36.7 47 299 A A H X< S+ 0 0 2 -4,-1.1 3,-0.9 -3,-1.0 -2,-0.2 0.917 109.3 47.4 -80.9 -48.6 22.2 0.2 33.5 48 300 A C H 3< S+ 0 0 49 -4,-1.9 5,-0.3 1,-0.2 -2,-0.2 0.858 103.5 65.0 -61.5 -35.8 18.8 -0.3 34.9 49 301 A S T 3< S+ 0 0 88 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.810 84.2 91.2 -57.3 -31.6 19.5 2.1 37.7 50 302 A I S X S- 0 0 27 -3,-0.9 3,-1.9 -4,-0.4 2,-0.4 -0.498 87.5-117.9 -71.5 127.9 19.8 4.9 35.1 51 303 A P T 3 S+ 0 0 114 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.517 103.0 33.2 -68.2 122.6 16.5 6.7 34.5 52 304 A G T 3 S+ 0 0 49 -2,-0.4 2,-0.5 1,-0.2 -22,-0.1 0.272 100.8 95.2 113.2 -7.1 15.5 6.1 30.8 53 305 A I < + 0 0 10 -3,-1.9 -1,-0.2 -5,-0.3 2,-0.1 -0.971 51.4 177.6-120.6 119.5 17.0 2.7 30.7 54 306 A G > - 0 0 39 -2,-0.5 4,-3.1 -3,-0.1 5,-0.3 -0.382 48.6 -80.3-107.5-171.4 14.8 -0.4 31.4 55 307 A K H > S+ 0 0 55 1,-0.2 4,-3.3 2,-0.2 5,-0.2 0.932 127.6 49.4 -55.8 -51.0 15.3 -4.1 31.4 56 308 A R H > S+ 0 0 153 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.937 115.9 41.7 -54.8 -52.5 15.1 -4.4 27.6 57 309 A M H > S+ 0 0 19 2,-0.2 4,-1.7 1,-0.2 3,-0.5 0.926 117.4 46.2 -63.8 -47.2 17.6 -1.6 27.0 58 310 A A H X S+ 0 0 0 -4,-3.1 4,-2.7 1,-0.2 -2,-0.2 0.925 106.7 59.8 -60.7 -44.3 20.0 -2.7 29.7 59 311 A E H X S+ 0 0 119 -4,-3.3 4,-1.1 -5,-0.3 -1,-0.2 0.824 108.8 44.8 -52.6 -33.9 19.7 -6.2 28.5 60 312 A K H X S+ 0 0 29 -4,-1.2 4,-1.8 -3,-0.5 -1,-0.3 0.798 108.5 55.8 -81.4 -31.3 21.0 -4.9 25.1 61 313 A I H X S+ 0 0 7 -4,-1.7 4,-0.8 2,-0.2 -2,-0.2 0.869 101.6 60.0 -67.4 -35.4 23.8 -2.9 26.8 62 314 A I H >X S+ 0 0 38 -4,-2.7 4,-3.8 1,-0.2 3,-1.4 0.955 106.9 44.0 -55.7 -54.0 25.0 -6.0 28.5 63 315 A E H 3X>S+ 0 0 63 -4,-1.1 4,-3.1 1,-0.3 5,-1.6 0.872 104.0 64.0 -60.0 -39.4 25.6 -7.7 25.2 64 316 A I H 3<5S+ 0 0 26 -4,-1.8 -1,-0.3 3,-0.2 -2,-0.2 0.744 119.0 27.9 -57.3 -21.3 27.3 -4.6 23.8 65 317 A L H <<5S+ 0 0 90 -3,-1.4 -2,-0.2 -4,-0.8 -1,-0.2 0.767 124.4 45.9-106.8 -41.2 29.9 -5.2 26.6 66 318 A E H <5S+ 0 0 94 -4,-3.8 -3,-0.2 -5,-0.2 -2,-0.2 0.660 135.5 16.4 -77.7 -17.5 29.7 -9.0 27.0 67 319 A S T <5S- 0 0 65 -4,-3.1 -3,-0.2 -5,-0.3 -1,-0.1 0.577 88.7-135.3-126.0 -26.8 29.8 -9.5 23.2 68 320 A G S > - 0 0 15 -2,-0.3 3,-2.0 1,-0.1 4,-0.7 -0.881 8.9-156.9-104.8 109.2 24.5 -6.4 19.1 71 323 A R G >4 S+ 0 0 56 -2,-0.7 3,-0.6 1,-0.3 -1,-0.1 0.783 91.4 67.7 -51.6 -30.9 22.9 -9.4 17.4 72 324 A K G >4 S+ 0 0 81 1,-0.2 3,-1.2 2,-0.2 -1,-0.3 0.817 92.8 59.5 -61.2 -31.6 19.8 -7.2 16.8 73 325 A L G X4 S+ 0 0 51 -3,-2.0 3,-1.4 1,-0.3 -1,-0.2 0.839 94.3 62.4 -66.9 -34.5 21.8 -5.0 14.4 74 326 A D G << S+ 0 0 85 -4,-0.7 -1,-0.3 -3,-0.6 -2,-0.2 0.322 104.1 52.2 -74.9 10.9 22.6 -7.9 12.1 75 327 A H G < S+ 0 0 158 -3,-1.2 2,-0.3 2,-0.1 -1,-0.3 0.231 73.9 126.3-129.7 12.3 18.8 -8.2 11.4 76 328 A I S < S- 0 0 47 -3,-1.4 -3,-0.0 1,-0.1 -65,-0.0 -0.571 71.0 -97.5 -75.3 133.5 17.8 -4.7 10.4 77 329 A S > - 0 0 55 -2,-0.3 3,-1.0 1,-0.2 -1,-0.1 -0.091 20.1-128.6 -50.4 145.5 16.0 -4.6 7.1 78 330 A E T 3 S+ 0 0 161 1,-0.2 4,-0.5 2,-0.1 -1,-0.2 0.667 105.0 71.7 -69.3 -16.7 18.1 -3.7 4.0 79 331 A S T >> S+ 0 0 14 1,-0.2 4,-2.4 2,-0.1 3,-0.6 0.781 76.2 81.6 -69.7 -29.2 15.4 -1.1 3.3 80 332 A V H <> S+ 0 0 11 -3,-1.0 4,-2.6 1,-0.2 5,-0.2 0.858 87.4 50.0 -47.8 -51.2 16.5 1.1 6.2 81 333 A P H 3> S+ 0 0 83 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.888 114.2 47.4 -59.7 -35.4 19.4 2.9 4.5 82 334 A V H <> S+ 0 0 22 -3,-0.6 4,-2.8 -4,-0.5 -2,-0.2 0.889 110.1 51.1 -72.0 -39.0 17.2 3.7 1.5 83 335 A L H X S+ 0 0 5 -4,-2.4 4,-3.3 2,-0.2 -1,-0.2 0.887 111.1 49.5 -64.0 -38.0 14.3 5.0 3.8 84 336 A E H X S+ 0 0 89 -4,-2.6 4,-0.6 -5,-0.2 -2,-0.2 0.919 110.5 50.2 -65.8 -43.2 16.9 7.2 5.5 85 337 A L H >< S+ 0 0 53 -4,-2.1 3,-0.7 -5,-0.2 -2,-0.2 0.944 116.3 41.5 -58.6 -49.9 18.1 8.4 2.1 86 338 A F H >< S+ 0 0 0 -4,-2.8 3,-1.9 1,-0.2 -2,-0.2 0.918 112.0 53.0 -65.9 -47.1 14.5 9.2 1.0 87 339 A S H 3< S+ 0 0 31 -4,-3.3 -1,-0.2 1,-0.3 -2,-0.2 0.521 96.4 69.8 -71.5 -1.0 13.3 10.7 4.3 88 340 A N T << S+ 0 0 65 -3,-0.7 2,-0.5 -4,-0.6 -1,-0.3 0.419 75.0 100.2 -92.6 1.9 16.3 13.1 4.2 89 341 A I S X S- 0 0 2 -3,-1.9 3,-2.2 3,-0.1 36,-0.1 -0.777 90.8-108.8 -84.0 125.4 14.6 14.9 1.3 90 342 A W T 3 S+ 0 0 66 -2,-0.5 34,-0.4 1,-0.3 35,-0.2 -0.346 105.6 24.6 -57.0 126.2 12.9 18.0 2.8 91 343 A G T 3 S+ 0 0 35 1,-0.2 2,-0.5 -4,-0.2 -1,-0.3 0.353 102.1 98.6 100.7 -6.4 9.2 17.4 2.6 92 344 A A < + 0 0 9 -3,-2.2 -1,-0.2 -6,-0.1 2,-0.1 -0.965 47.4 174.2-117.3 128.5 9.3 13.6 2.7 93 345 A G > - 0 0 36 -2,-0.5 4,-2.6 -3,-0.1 5,-0.2 -0.328 52.6 -67.1-113.9-160.0 8.8 11.7 5.9 94 346 A T H > S+ 0 0 37 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.884 128.7 53.7 -60.0 -41.1 8.6 8.0 6.8 95 347 A K H > S+ 0 0 163 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.925 113.5 41.3 -62.1 -45.0 5.2 7.5 5.0 96 348 A T H > S+ 0 0 35 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.921 114.2 52.5 -68.5 -44.3 6.5 8.9 1.7 97 349 A A H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.932 111.7 46.2 -57.7 -46.2 9.9 7.1 2.0 98 350 A Q H X S+ 0 0 74 -4,-2.7 4,-2.7 -5,-0.2 -1,-0.2 0.875 112.0 51.6 -65.0 -36.9 8.1 3.7 2.7 99 351 A M H X S+ 0 0 87 -4,-1.8 4,-2.0 -5,-0.2 -2,-0.2 0.960 110.9 46.9 -64.8 -50.1 5.8 4.3 -0.2 100 352 A W H <>S+ 0 0 2 -4,-3.0 5,-2.5 1,-0.2 -2,-0.2 0.888 113.7 49.2 -58.0 -40.4 8.6 5.1 -2.7 101 353 A Y H ><5S+ 0 0 39 -4,-2.2 3,-2.1 -5,-0.2 -1,-0.2 0.925 108.3 52.3 -66.1 -43.9 10.5 2.0 -1.4 102 354 A Q H 3<5S+ 0 0 150 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.866 106.3 56.0 -59.5 -34.5 7.4 -0.2 -1.8 103 355 A Q T 3<5S- 0 0 103 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.411 126.7-101.5 -79.7 3.7 7.2 1.1 -5.4 104 356 A G T < 5S+ 0 0 40 -3,-2.1 -3,-0.2 1,-0.3 -2,-0.1 0.433 70.7 147.4 94.8 -2.8 10.7 -0.0 -6.1 105 357 A F < + 0 0 18 -5,-2.5 -1,-0.3 -6,-0.2 3,-0.1 -0.459 10.7 164.2 -67.6 139.8 12.6 3.3 -5.8 106 358 A R + 0 0 106 1,-0.2 2,-0.3 -2,-0.1 -1,-0.1 0.470 55.9 28.8-133.7 -10.0 16.1 2.7 -4.4 107 359 A S S > S- 0 0 42 1,-0.1 4,-1.8 -22,-0.0 -1,-0.2 -0.941 79.1-105.0-148.3 168.5 18.1 5.9 -5.1 108 360 A L H > S+ 0 0 37 -2,-0.3 4,-3.7 1,-0.2 5,-0.2 0.802 120.2 59.6 -67.2 -28.0 17.7 9.6 -5.6 109 361 A E H > S+ 0 0 99 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.910 105.2 49.8 -64.9 -39.7 18.2 9.1 -9.4 110 362 A D H >>S+ 0 0 44 2,-0.2 4,-2.4 1,-0.2 5,-0.7 0.902 113.9 45.3 -62.6 -42.1 15.1 6.8 -9.2 111 363 A I H X5S+ 0 0 0 -4,-1.8 4,-1.4 3,-0.2 -2,-0.2 0.946 112.0 51.4 -66.3 -49.0 13.3 9.6 -7.3 112 364 A R H <5S+ 0 0 144 -4,-3.7 -2,-0.2 1,-0.2 -1,-0.2 0.875 120.9 32.6 -56.2 -42.0 14.4 12.3 -9.7 113 365 A S H <5S+ 0 0 59 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.779 134.2 17.0 -91.0 -27.9 13.3 10.4 -12.8 114 366 A Q H <5S+ 0 0 139 -4,-2.4 -3,-0.2 -5,-0.2 -2,-0.1 0.657 94.4 95.9-121.8 -19.0 10.2 8.5 -11.7 115 367 A A << - 0 0 17 -4,-1.4 2,-0.9 -5,-0.7 -4,-0.0 -0.434 69.3-125.4 -79.3 149.9 8.7 9.8 -8.5 116 368 A S - 0 0 114 -2,-0.1 2,-0.3 0, 0.0 -1,-0.1 -0.834 37.4-161.2 -93.3 105.1 5.9 12.3 -8.3 117 369 A L - 0 0 50 -2,-0.9 2,-0.1 -5,-0.1 -5,-0.0 -0.648 14.0-131.9 -95.0 145.6 7.3 15.1 -6.2 118 370 A T > - 0 0 66 -2,-0.3 4,-2.5 1,-0.1 5,-0.2 -0.429 38.8-100.6 -81.3 166.0 5.5 17.8 -4.3 119 371 A T H > S+ 0 0 114 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.909 125.0 48.5 -54.6 -44.0 6.8 21.4 -4.7 120 372 A Q H > S+ 0 0 67 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.904 111.0 49.0 -64.6 -42.7 8.6 21.1 -1.4 121 373 A Q H > S+ 0 0 11 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.860 107.4 55.0 -67.4 -34.4 10.2 17.8 -2.1 122 374 A A H X S+ 0 0 46 -4,-2.5 4,-2.0 2,-0.2 -1,-0.2 0.896 111.0 46.2 -64.6 -38.3 11.4 19.0 -5.5 123 375 A I H X S+ 0 0 18 -4,-1.6 4,-1.5 -5,-0.2 -2,-0.2 0.905 111.2 52.5 -69.4 -40.1 13.1 21.9 -3.7 124 376 A G H < S+ 0 0 1 -4,-2.4 7,-0.2 -34,-0.4 -2,-0.2 0.889 110.7 46.5 -62.3 -39.6 14.5 19.4 -1.2 125 377 A L H >< S+ 0 0 34 -4,-2.5 3,-1.6 1,-0.2 4,-0.2 0.901 107.7 56.9 -70.0 -39.2 16.0 17.2 -3.8 126 378 A K H 3< S+ 0 0 75 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.818 120.8 30.0 -60.5 -30.9 17.4 20.2 -5.7 127 379 A H T 3X S+ 0 0 18 -4,-1.5 4,-2.9 1,-0.1 -1,-0.3 -0.053 80.9 135.7-117.9 30.8 19.3 21.1 -2.5 128 380 A Y T <4 S+ 0 0 30 -3,-1.6 4,-0.4 1,-0.2 -1,-0.1 0.887 76.9 37.1 -46.1 -54.8 19.7 17.6 -1.0 129 381 A S T >> S+ 0 0 83 -4,-0.2 3,-1.3 1,-0.2 4,-0.5 0.913 115.6 53.1 -68.3 -43.5 23.4 18.0 0.0 130 382 A D G >4 S+ 0 0 12 1,-0.3 3,-1.3 2,-0.2 -2,-0.2 0.901 105.6 55.2 -59.7 -38.7 23.1 21.6 1.1 131 383 A F G 3< S+ 0 0 17 -4,-2.9 -1,-0.3 1,-0.3 -2,-0.2 0.625 105.3 53.3 -70.6 -11.9 20.2 20.7 3.4 132 384 A L G <4 S+ 0 0 91 -3,-1.3 2,-0.3 -4,-0.4 -1,-0.3 0.486 98.0 83.8 -98.3 -5.3 22.3 18.1 5.1 133 385 A E << - 0 0 107 -3,-1.3 2,-0.3 -4,-0.5 -3,-0.0 -0.698 68.0-141.3-100.8 151.4 25.1 20.6 5.9 134 386 A R - 0 0 120 -2,-0.3 40,-0.2 101,-0.1 41,-0.1 -0.737 16.1-134.0-105.0 155.8 25.4 23.0 8.8 135 387 A M E -A 173 0A 0 38,-2.7 38,-2.8 -2,-0.3 2,-0.1 -0.780 27.3 -99.2-109.4 155.0 26.8 26.5 8.4 136 388 A P E >> -A 172 0A 59 0, 0.0 4,-1.3 0, 0.0 3,-1.2 -0.463 37.5-117.2 -67.3 145.2 29.3 28.2 10.7 137 389 A R H 3> S+ 0 0 53 34,-2.8 4,-2.0 1,-0.3 5,-0.1 0.807 112.5 69.0 -56.6 -26.2 27.4 30.5 13.1 138 390 A E H 3> S+ 0 0 119 33,-0.3 4,-1.5 1,-0.2 -1,-0.3 0.913 99.9 46.6 -57.4 -44.3 29.2 33.4 11.5 139 391 A E H <> S+ 0 0 11 -3,-1.2 4,-2.0 1,-0.2 -1,-0.2 0.864 106.3 58.9 -66.9 -34.8 27.3 32.9 8.3 140 392 A A H X S+ 0 0 0 -4,-1.3 4,-2.7 1,-0.2 -1,-0.2 0.891 102.6 55.2 -60.2 -37.4 24.1 32.6 10.4 141 393 A T H X S+ 0 0 49 -4,-2.0 4,-2.9 1,-0.2 -1,-0.2 0.938 105.8 50.0 -60.4 -47.9 24.8 36.1 11.7 142 394 A E H X S+ 0 0 80 -4,-1.5 4,-2.1 1,-0.2 -1,-0.2 0.876 112.3 48.0 -59.5 -38.9 25.1 37.5 8.2 143 395 A I H X S+ 0 0 0 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.933 112.0 47.6 -68.6 -45.6 21.7 35.9 7.2 144 396 A E H X S+ 0 0 14 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.931 113.6 49.7 -59.9 -43.7 20.0 37.2 10.4 145 397 A Q H X S+ 0 0 97 -4,-2.9 4,-2.4 1,-0.2 -1,-0.2 0.880 107.1 54.6 -62.4 -39.1 21.4 40.6 9.7 146 398 A T H X S+ 0 0 28 -4,-2.1 4,-1.6 -5,-0.2 -1,-0.2 0.909 112.2 43.8 -61.8 -41.0 20.2 40.5 6.1 147 399 A V H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.904 113.2 50.6 -70.4 -42.4 16.7 39.8 7.3 148 400 A Q H X S+ 0 0 45 -4,-2.7 4,-2.9 1,-0.2 -2,-0.2 0.865 109.2 52.1 -63.5 -37.9 16.8 42.4 10.1 149 401 A K H X S+ 0 0 64 -4,-2.4 4,-0.5 1,-0.2 -1,-0.2 0.909 111.5 45.6 -66.4 -42.9 18.0 45.1 7.6 150 402 A A H X S+ 0 0 7 -4,-1.6 4,-0.5 -5,-0.2 -2,-0.2 0.859 116.0 48.1 -68.2 -35.4 15.2 44.3 5.2 151 403 A A H >X S+ 0 0 1 -4,-2.2 3,-1.5 1,-0.2 4,-0.7 0.974 112.4 44.5 -69.4 -56.2 12.7 44.4 8.1 152 404 A Q H 3< S+ 0 0 69 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.539 97.4 79.5 -67.5 -5.4 13.8 47.6 9.8 153 405 A A H 3< S+ 0 0 80 -4,-0.5 -1,-0.3 1,-0.2 3,-0.2 0.842 107.4 26.3 -71.1 -33.6 14.0 49.2 6.3 154 406 A F H << S+ 0 0 56 -3,-1.5 -2,-0.2 -4,-0.5 -1,-0.2 0.430 142.9 18.2-107.9 -0.9 10.2 49.6 6.3 155 407 A N >< - 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0 0 16 -12,-2.1 2,-0.6 -3,-0.2 -1,-0.2 -0.548 23.6-140.3 -75.6 135.0 -6.0 23.9 32.2 285 537 A V E +H 294 0D 51 9,-1.1 9,-2.8 -2,-0.3 8,-2.2 -0.870 26.5 177.5-100.6 117.0 -8.8 21.3 31.9 286 538 A R E -H 292 0D 70 -2,-0.6 6,-0.2 6,-0.3 5,-0.0 -0.862 21.6-124.2-119.4 154.4 -7.7 18.0 30.3 287 539 A N > - 0 0 71 4,-2.0 3,-1.1 -2,-0.3 -1,-0.1 0.004 44.2 -82.3 -81.2-169.8 -9.6 14.7 29.7 288 540 A T T 3 S+ 0 0 140 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.723 131.4 50.6 -68.1 -22.1 -8.7 11.2 30.7 289 541 A H T 3 S- 0 0 174 2,-0.1 -1,-0.3 0, 0.0 -3,-0.0 0.446 118.9-108.9 -95.9 -2.2 -6.3 11.0 27.7 290 542 A G < + 0 0 16 -3,-1.1 2,-0.3 1,-0.3 -2,-0.1 0.484 68.9 144.1 89.8 2.5 -4.5 14.2 28.6 291 543 A C - 0 0 52 1,-0.1 -4,-2.0 -5,-0.0 2,-0.7 -0.581 61.0-105.4 -77.7 136.3 -5.9 16.2 25.7 292 544 A K E +H 286 0D 107 -2,-0.3 -6,-0.3 -6,-0.2 -1,-0.1 -0.476 49.1 162.5 -65.6 107.2 -6.6 19.9 26.5 293 545 A V E + 0 0 77 -8,-2.2 -7,-0.2 -2,-0.7 -1,-0.2 0.908 64.9 42.0 -89.1 -54.9 -10.4 20.2 26.8 294 546 A G E S-H 285 0D 17 -9,-2.8 -9,-1.1 1,-0.1 -1,-0.2 -0.765 74.7-138.6 -97.2 141.5 -10.6 23.5 28.7 295 547 A P - 0 0 102 0, 0.0 -11,-0.1 0, 0.0 -1,-0.1 0.780 32.7-166.5 -67.1 -30.4 -8.4 26.5 27.8 296 548 A G - 0 0 33 -13,-0.2 2,-0.4 -15,-0.1 -13,-0.2 -0.408 38.1 -46.0 75.2-155.4 -7.6 27.6 31.4 297 549 A R E -G 282 0C 157 -15,-3.2 -15,-2.9 -2,-0.1 2,-0.4 -0.959 48.1-125.2-121.2 134.0 -6.1 31.0 32.0 298 550 A V E -G 281 0C 103 -2,-0.4 -17,-0.3 -17,-0.2 -2,-0.0 -0.611 28.1-140.0 -76.4 127.8 -3.1 32.6 30.2 299 551 A L - 0 0 31 -19,-3.2 -19,-0.5 -2,-0.4 2,-0.3 -0.669 22.1-106.4 -89.2 139.9 -0.4 33.6 32.7 300 552 A P + 0 0 105 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.507 44.2 169.6 -67.6 127.1 1.4 36.9 32.2 301 553 A T + 0 0 14 -2,-0.3 -53,-0.5 -56,-0.3 -52,-0.3 -0.613 10.8 163.1-139.8 76.3 4.9 36.1 31.0 302 554 A P S S+ 0 0 96 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.642 72.6 27.2 -69.1 -15.5 6.7 39.3 29.8 303 555 A T S >> S- 0 0 66 1,-0.1 4,-1.2 -3,-0.1 3,-0.6 -0.962 82.4-111.9-144.2 160.7 10.1 37.5 29.9 304 556 A E H 3> S+ 0 0 13 -2,-0.3 4,-1.9 1,-0.2 3,-0.3 0.878 115.7 61.8 -59.1 -38.7 11.5 34.0 29.6 305 557 A K H 3> S+ 0 0 125 1,-0.2 4,-3.1 2,-0.2 -1,-0.2 0.861 97.0 57.4 -57.1 -37.5 12.4 34.1 33.3 306 558 A D H <> S+ 0 0 29 -3,-0.6 4,-3.2 1,-0.2 5,-0.2 0.914 104.2 53.1 -60.8 -40.6 8.8 34.4 34.2 307 559 A V H X S+ 0 0 0 -4,-1.2 4,-1.1 -3,-0.3 -2,-0.2 0.945 111.9 44.1 -59.5 -48.8 8.1 31.2 32.4 308 560 A F H <>S+ 0 0 1 -4,-1.9 5,-3.1 2,-0.2 3,-0.5 0.934 114.9 50.1 -61.1 -45.7 10.8 29.4 34.3 309 561 A R H ><5S+ 0 0 146 -4,-3.1 3,-3.4 1,-0.2 -2,-0.2 0.964 107.5 51.1 -56.6 -57.1 9.6 31.0 37.6 310 562 A L H 3<5S+ 0 0 52 -4,-3.2 -1,-0.2 1,-0.3 -2,-0.2 0.727 111.5 49.9 -54.9 -23.5 5.9 30.1 37.1 311 563 A L T 3<5S- 0 0 1 -4,-1.1 -1,-0.3 -3,-0.5 -2,-0.2 0.307 117.0-117.5 -97.3 7.9 7.0 26.5 36.5 312 564 A G T < 5 + 0 0 62 -3,-3.4 -3,-0.2 1,-0.2 -2,-0.1 0.861 69.8 136.8 59.5 38.4 9.1 26.6 39.6 313 565 A L < - 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