==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/TRANSCRIPTION 02-JAN-08 2JZB . COMPND 2 MOLECULE: DNA-DIRECTED RNA POLYMERASE SUBUNIT ALPHA; . SOURCE 2 ORGANISM_SCIENTIFIC: YERSINIA PSEUDOTUBERCULOSIS; . AUTHOR S.PRASCH,K.SCHWEIMER,P.ROESCH . 151 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9599.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 94 62.3 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 . 2 1.3 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 . 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 . 3 2.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 17.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 57 37.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.3 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 2 2 2 0 2 0 0 0 1 0 0 0 1 0 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 . 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 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 1 249 A F 0 0 109 0, 0.0 5,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 111.4 3.6 -34.5 6.4 2 250 A D >> - 0 0 75 1,-0.2 4,-1.9 2,-0.1 3,-0.6 -0.256 360.0-146.8 -50.2 121.7 5.3 -32.2 9.0 3 251 A P H 3> S+ 0 0 94 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.786 96.9 61.5 -64.7 -26.6 4.3 -33.8 12.4 4 252 A I H 34 S+ 0 0 31 2,-0.2 26,-0.3 1,-0.2 27,-0.1 0.867 106.0 46.8 -69.6 -32.0 4.2 -30.4 14.0 5 253 A L H <4 S+ 0 0 6 -3,-0.6 26,-2.9 25,-0.2 27,-0.3 0.934 112.8 47.2 -75.1 -45.2 1.4 -29.4 11.6 6 254 A L H < S+ 0 0 36 -4,-1.9 -2,-0.2 24,-0.2 -1,-0.2 0.901 95.5 90.8 -64.0 -37.3 -0.6 -32.5 12.1 7 255 A R S < S- 0 0 105 -4,-2.2 23,-2.1 -5,-0.2 24,-0.3 -0.308 93.1-103.8 -59.6 141.9 -0.2 -32.2 15.9 8 256 A P B >> -A 29 0A 47 0, 0.0 3,-3.4 0, 0.0 4,-0.9 -0.446 23.0-120.1 -68.9 133.6 -3.0 -30.1 17.5 9 257 A V G >4 S+ 0 0 0 19,-1.2 3,-0.6 1,-0.3 10,-0.2 0.808 117.1 64.3 -44.9 -25.4 -2.1 -26.6 18.4 10 258 A D G 34 S+ 0 0 68 18,-0.5 -1,-0.3 1,-0.2 9,-0.1 0.849 91.4 61.6 -69.6 -30.6 -3.0 -27.7 21.9 11 259 A D G <4 S+ 0 0 75 -3,-3.4 -1,-0.2 -7,-0.1 -2,-0.2 0.780 76.6 119.2 -66.7 -22.6 -0.2 -30.2 21.8 12 260 A L S << S- 0 0 12 -4,-0.9 7,-0.1 -3,-0.6 6,-0.1 -0.132 76.0-127.2 -43.6 131.4 2.2 -27.3 21.5 13 261 A E S S+ 0 0 188 3,-0.0 -1,-0.2 45,-0.0 3,-0.1 0.808 87.8 94.5 -55.9 -24.8 4.5 -27.4 24.5 14 262 A L S S- 0 0 34 1,-0.1 5,-0.1 40,-0.1 40,-0.0 -0.164 96.7 -82.0 -62.3 163.6 3.4 -23.7 25.1 15 263 A T >> - 0 0 86 1,-0.1 3,-1.6 3,-0.1 4,-0.9 -0.198 45.8-100.5 -62.9 161.1 0.5 -23.1 27.4 16 264 A V H 3> S+ 0 0 85 1,-0.3 4,-4.0 2,-0.2 5,-0.3 0.819 118.9 76.7 -54.8 -26.1 -3.0 -23.6 26.0 17 265 A R H 3> S+ 0 0 145 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.925 91.4 52.3 -51.9 -44.1 -3.0 -19.7 25.8 18 266 A S H <> S+ 0 0 5 -3,-1.6 4,-1.2 1,-0.2 5,-0.2 0.964 116.7 37.3 -58.8 -50.6 -0.8 -20.0 22.7 19 267 A A H X S+ 0 0 1 -4,-0.9 4,-3.6 1,-0.2 5,-0.4 0.870 108.8 65.1 -70.5 -33.6 -3.2 -22.5 21.0 20 268 A N H X S+ 0 0 70 -4,-4.0 4,-1.9 -5,-0.2 -1,-0.2 0.902 99.7 54.1 -56.4 -38.2 -6.2 -20.6 22.4 21 269 A C H < S+ 0 0 18 -4,-1.9 4,-0.4 -5,-0.3 -2,-0.2 0.997 121.0 27.0 -60.6 -64.6 -5.2 -17.6 20.2 22 270 A L H >< S+ 0 0 9 -4,-1.2 3,-2.7 1,-0.2 5,-0.5 0.952 120.0 57.3 -64.7 -46.6 -5.1 -19.5 16.9 23 271 A K H >X S+ 0 0 87 -4,-3.6 3,-2.4 1,-0.3 4,-0.9 0.873 91.8 72.1 -53.0 -34.0 -7.6 -22.1 18.0 24 272 A A T 3< S+ 0 0 68 -4,-1.9 -1,-0.3 -5,-0.4 -2,-0.2 0.799 89.5 61.9 -53.8 -23.6 -10.0 -19.2 18.6 25 273 A E T <4 S- 0 0 28 -3,-2.7 -1,-0.3 -4,-0.4 -2,-0.2 0.155 133.2 -92.6 -89.1 22.6 -10.1 -19.0 14.8 26 274 A A T <4 S+ 0 0 89 -3,-2.4 2,-0.5 1,-0.2 -2,-0.2 0.890 82.5 144.6 71.9 36.5 -11.6 -22.5 14.7 27 275 A I < + 0 0 3 -4,-0.9 -1,-0.2 -5,-0.5 -2,-0.1 -0.923 17.2 157.5-112.2 127.4 -8.2 -24.1 14.3 28 276 A H + 0 0 109 -2,-0.5 -19,-1.2 1,-0.2 2,-0.5 0.662 64.5 57.8-116.7 -30.3 -7.4 -27.4 15.9 29 277 A Y B >> S-A 8 0A 83 -21,-0.3 3,-1.8 1,-0.1 4,-0.7 -0.888 76.6-135.9-106.6 127.8 -4.4 -28.7 13.8 30 278 A I H >> S+ 0 0 0 -23,-2.1 3,-1.5 -2,-0.5 4,-1.2 0.842 100.5 78.4 -48.3 -30.2 -1.3 -26.6 13.5 31 279 A G H >> S+ 0 0 0 -26,-2.9 4,-1.6 -24,-0.3 3,-0.7 0.930 86.3 56.7 -46.5 -48.6 -1.4 -27.4 9.8 32 280 A D H <> S+ 0 0 25 -3,-1.8 4,-1.7 -27,-0.3 -1,-0.3 0.876 97.8 64.6 -53.4 -33.0 -4.2 -24.8 9.4 33 281 A L H << S+ 0 0 2 -3,-1.5 3,-0.4 -4,-0.7 -1,-0.3 0.949 103.3 44.5 -56.8 -46.9 -1.6 -22.4 10.9 34 282 A V H << S+ 0 0 0 -4,-1.2 -1,-0.3 -3,-0.7 -2,-0.2 0.795 105.2 65.2 -69.0 -23.2 0.6 -22.9 7.8 35 283 A Q H < S+ 0 0 61 -4,-1.6 2,-0.4 -5,-0.3 -1,-0.2 0.901 104.5 48.6 -66.2 -37.0 -2.5 -22.5 5.7 36 284 A R S < S- 0 0 86 -4,-1.7 31,-0.2 -3,-0.4 32,-0.2 -0.820 91.1-121.9-104.4 143.1 -2.9 -18.9 6.8 37 285 A T > - 0 0 34 -2,-0.4 4,-1.4 1,-0.1 5,-0.2 -0.494 23.3-116.4 -80.0 151.8 0.0 -16.4 6.7 38 286 A E H > S+ 0 0 60 1,-0.2 4,-3.5 2,-0.2 3,-0.4 0.909 115.4 61.0 -54.5 -39.5 1.0 -14.7 10.0 39 287 A V H > S+ 0 0 82 1,-0.3 4,-1.4 2,-0.2 -1,-0.2 0.970 101.2 50.5 -53.0 -55.3 0.0 -11.4 8.4 40 288 A E H 4 S+ 0 0 106 1,-0.2 -1,-0.3 2,-0.2 -2,-0.2 0.852 115.1 46.4 -53.2 -30.6 -3.6 -12.6 8.0 41 289 A L H >< S+ 0 0 5 -4,-1.4 3,-1.9 -3,-0.4 6,-0.3 0.909 106.5 54.7 -79.6 -42.4 -3.4 -13.5 11.7 42 290 A L H 3< S+ 0 0 40 -4,-3.5 -2,-0.2 1,-0.3 -1,-0.2 0.690 98.4 67.8 -65.0 -12.8 -1.7 -10.3 12.9 43 291 A K T 3< S+ 0 0 105 -4,-1.4 -1,-0.3 -5,-0.3 -2,-0.1 0.303 90.9 78.7 -89.1 12.3 -4.7 -8.5 11.2 44 292 A T S X S- 0 0 24 -3,-1.9 3,-1.0 1,-0.1 93,-0.0 -0.966 70.1-146.6-124.8 138.7 -7.0 -10.0 13.8 45 293 A P T 3 S+ 0 0 20 0, 0.0 76,-0.8 0, 0.0 -1,-0.1 0.775 88.8 84.2 -70.8 -27.1 -7.6 -8.8 17.4 46 294 A N T 3 S+ 0 0 71 74,-0.1 2,-0.3 75,-0.1 76,-0.1 0.801 81.6 78.5 -48.3 -24.4 -8.2 -12.4 18.7 47 295 A L S < S- 0 0 5 -3,-1.0 2,-0.3 -6,-0.3 74,-0.2 -0.649 75.2-150.6 -87.6 143.1 -4.4 -12.5 18.9 48 296 A G > - 0 0 17 -2,-0.3 4,-2.1 72,-0.1 71,-0.1 -0.751 27.4-110.7-110.5 160.4 -2.7 -10.7 21.9 49 297 A K H > S+ 0 0 118 69,-0.5 4,-1.2 68,-0.3 -1,-0.1 0.924 122.7 47.6 -54.9 -42.3 0.8 -9.1 22.0 50 298 A K H > S+ 0 0 127 68,-0.3 4,-1.8 1,-0.2 -1,-0.2 0.904 106.1 58.2 -67.4 -37.8 1.9 -11.9 24.3 51 299 A S H > S+ 0 0 4 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.913 100.2 57.9 -59.2 -39.4 0.4 -14.5 21.9 52 300 A L H X S+ 0 0 64 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.929 102.7 54.0 -58.0 -42.7 2.6 -13.2 19.1 53 301 A T H X S+ 0 0 74 -4,-1.2 4,-2.1 1,-0.2 -1,-0.2 0.955 106.5 51.1 -58.0 -48.3 5.7 -13.9 21.3 54 302 A E H X S+ 0 0 21 -4,-1.8 4,-2.2 1,-0.2 5,-0.3 0.929 107.6 53.9 -56.6 -42.8 4.7 -17.6 21.7 55 303 A I H X S+ 0 0 20 -4,-2.2 4,-3.8 1,-0.2 5,-0.3 0.957 105.5 52.7 -57.9 -48.3 4.2 -17.9 17.9 56 304 A K H X S+ 0 0 158 -4,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.920 106.5 54.7 -54.7 -41.6 7.8 -16.6 17.4 57 305 A D H X S+ 0 0 105 -4,-2.1 4,-0.5 2,-0.2 3,-0.3 0.968 115.2 37.2 -58.3 -51.4 9.0 -19.3 19.8 58 306 A V H ><>S+ 0 0 16 -4,-2.2 3,-1.5 1,-0.2 5,-0.6 0.903 113.0 58.4 -68.7 -37.2 7.3 -22.1 17.8 59 307 A L H ><5S+ 0 0 42 -4,-3.8 3,-2.1 -5,-0.3 -1,-0.2 0.821 90.7 72.6 -62.0 -26.4 8.1 -20.4 14.5 60 308 A A H 3<5S+ 0 0 64 -4,-1.8 -1,-0.3 -5,-0.3 -2,-0.2 0.854 90.7 58.0 -58.2 -30.0 11.8 -20.6 15.6 61 309 A S T <<5S- 0 0 84 -3,-1.5 -1,-0.3 -4,-0.5 -2,-0.2 0.678 99.7-142.2 -74.1 -13.4 11.5 -24.4 14.8 62 310 A R T < 5S+ 0 0 182 -3,-2.1 -3,-0.1 -4,-0.4 -2,-0.1 0.703 74.1 111.8 61.2 13.5 10.5 -23.4 11.3 63 311 A G S > - 0 0 47 0, 0.0 4,-1.7 0, 0.0 3,-0.6 -0.220 33.4 -94.3 -70.5 163.1 -0.1 -33.6 2.0 76 324 A A T 34 S+ 0 0 102 1,-0.2 4,-0.1 2,-0.2 0, 0.0 0.831 125.0 67.1 -49.4 -28.2 0.8 -36.4 -0.4 77 325 A S T 34 S+ 0 0 72 1,-0.2 -1,-0.2 2,-0.1 4,-0.1 0.982 100.1 44.7 -58.7 -56.5 2.6 -37.9 2.6 78 326 A I T <4 S+ 0 0 37 -3,-0.6 -1,-0.2 2,-0.1 -2,-0.2 0.891 89.2 164.4 -56.4 -36.5 -0.6 -38.5 4.5 79 327 A A < - 0 0 61 -4,-1.7 -2,-0.1 1,-0.2 -3,-0.0 0.062 69.1 -39.7 44.5-166.7 -2.1 -40.0 1.3 80 328 A D 0 0 151 1,-0.3 -1,-0.2 -4,-0.1 -2,-0.1 0.904 360.0 360.0 -55.5 -38.5 -5.3 -42.0 1.8 81 329 A E 0 0 218 -4,-0.1 -1,-0.3 -3,-0.0 -2,-0.2 -0.691 360.0 360.0-147.5 360.0 -3.7 -43.5 5.0 82 !* 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 83 426 B G 0 0 101 0, 0.0 26,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 128.2 -6.2 6.8 39.5 84 427 B D - 0 0 149 1,-0.1 22,-0.0 2,-0.0 23,-0.0 0.881 360.0-157.3 -56.9 -34.7 -8.0 9.1 37.1 85 428 B N - 0 0 66 1,-0.2 23,-0.1 22,-0.1 -1,-0.1 0.938 15.6-167.6 58.0 44.4 -6.8 6.9 34.2 86 429 B K - 0 0 148 1,-0.1 2,-0.2 20,-0.1 -1,-0.2 -0.444 22.5-112.9 -67.8 136.5 -7.2 9.8 31.8 87 430 B P - 0 0 13 0, 0.0 25,-0.2 0, 0.0 24,-0.1 -0.449 30.3-118.3 -70.3 136.5 -6.9 8.7 28.1 88 431 B A > - 0 0 28 23,-3.3 4,-3.2 -2,-0.2 5,-0.4 -0.313 27.8-106.2 -71.1 159.5 -3.9 10.0 26.2 89 432 B D H > S+ 0 0 138 1,-0.2 4,-2.8 2,-0.2 -1,-0.1 0.873 122.3 57.3 -55.4 -33.8 -4.5 12.2 23.2 90 433 B D H 4 S+ 0 0 98 2,-0.2 -1,-0.2 1,-0.2 22,-0.1 0.959 112.1 38.5 -63.7 -48.3 -3.4 9.2 21.0 91 434 B L H >4 S+ 0 0 3 20,-0.4 3,-0.9 1,-0.2 -2,-0.2 0.903 120.7 46.1 -70.1 -38.4 -6.2 7.0 22.5 92 435 B L H 3< S+ 0 0 49 -4,-3.2 -2,-0.2 1,-0.2 -1,-0.2 0.852 111.4 52.0 -73.1 -31.4 -8.7 9.9 22.6 93 436 B N T 3< S+ 0 0 136 -4,-2.8 -1,-0.2 -5,-0.4 2,-0.2 0.383 84.2 121.3 -84.8 7.7 -7.8 10.9 19.0 94 437 B L X - 0 0 9 -3,-0.9 3,-1.1 -5,-0.1 2,-0.2 -0.517 67.5-122.7 -72.3 133.8 -8.3 7.3 17.9 95 438 B E T 3 S+ 0 0 178 -2,-0.2 3,-0.1 1,-0.2 -1,-0.1 -0.537 95.4 31.4 -76.9 140.8 -11.0 7.1 15.2 96 439 B G T 3 S+ 0 0 56 1,-0.2 2,-0.4 -2,-0.2 -1,-0.2 0.501 103.9 93.8 92.2 3.0 -14.0 4.8 16.0 97 440 B V < - 0 0 21 -3,-1.1 -1,-0.2 -5,-0.1 2,-0.2 -0.987 58.4-156.2-130.8 137.1 -13.7 5.6 19.8 98 441 B D > - 0 0 72 -2,-0.4 4,-3.1 -3,-0.1 5,-0.3 -0.546 38.0 -98.2-103.7 173.5 -15.5 8.3 21.8 99 442 B R H > S+ 0 0 172 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.918 125.1 52.4 -58.3 -40.5 -14.5 10.0 25.0 100 443 B D H > S+ 0 0 99 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.963 113.0 42.7 -61.6 -49.5 -16.8 7.6 26.9 101 444 B L H > S+ 0 0 17 1,-0.2 4,-2.6 2,-0.2 5,-0.3 0.916 113.0 53.7 -64.4 -39.9 -15.2 4.5 25.3 102 445 B A H X S+ 0 0 0 -4,-3.1 4,-2.5 1,-0.2 -1,-0.2 0.907 108.7 49.9 -62.6 -38.3 -11.7 6.0 25.8 103 446 B F H X S+ 0 0 90 -4,-2.4 4,-2.3 -5,-0.3 -2,-0.2 0.957 110.9 48.0 -66.2 -48.0 -12.4 6.5 29.5 104 447 B K H < S+ 0 0 86 -4,-2.2 4,-0.4 1,-0.2 -2,-0.2 0.946 114.8 45.8 -58.9 -46.4 -13.6 2.9 30.0 105 448 B L H ><>S+ 0 0 5 -4,-2.6 3,-1.4 1,-0.2 5,-0.7 0.924 112.8 50.3 -64.1 -41.2 -10.6 1.5 28.1 106 449 B A H ><5S+ 0 0 0 -4,-2.5 3,-1.3 -5,-0.3 -1,-0.2 0.851 94.8 72.4 -66.4 -30.7 -8.2 3.9 30.1 107 450 B A T 3<5S+ 0 0 61 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.755 86.5 67.9 -56.8 -18.5 -9.9 2.7 33.3 108 451 B R T < 5S- 0 0 84 -3,-1.4 -1,-0.3 -4,-0.4 -2,-0.1 0.014 131.1 -92.5 -90.6 31.6 -7.9 -0.6 32.7 109 452 B G T < 5S+ 0 0 46 -3,-1.3 -2,-0.2 1,-0.3 -3,-0.1 0.244 89.3 134.6 79.8 -18.9 -4.6 1.2 33.3 110 453 B V < + 0 0 0 -5,-0.7 -1,-0.3 1,-0.2 -2,-0.1 -0.372 16.8 156.2 -63.5 139.9 -4.4 1.9 29.5 111 454 B C + 0 0 52 1,-0.3 -23,-3.3 -24,-0.1 -20,-0.4 0.553 56.1 49.5-135.0 -36.0 -3.4 5.5 28.8 112 455 B T S >> S- 0 0 60 -25,-0.2 4,-1.9 -22,-0.1 3,-0.5 -0.842 84.8-115.1-111.0 148.6 -1.8 5.7 25.3 113 456 B L H 3> S+ 0 0 10 -2,-0.3 4,-1.9 1,-0.3 5,-0.2 0.896 119.0 58.6 -46.2 -40.1 -3.3 4.2 22.1 114 457 B E H 3> S+ 0 0 76 1,-0.2 4,-1.8 2,-0.2 3,-0.4 0.961 101.9 52.0 -56.8 -49.6 -0.3 1.8 22.1 115 458 B D H <> S+ 0 0 40 -3,-0.5 4,-1.2 1,-0.2 -1,-0.2 0.908 105.4 56.9 -54.8 -38.8 -1.3 0.5 25.6 116 459 B L H >< S+ 0 0 2 -4,-1.9 3,-0.7 1,-0.2 -1,-0.2 0.927 103.7 52.5 -60.0 -41.5 -4.8 -0.1 24.2 117 460 B A H 3< S+ 0 0 8 -4,-1.9 -68,-0.3 -3,-0.4 -1,-0.2 0.881 101.3 61.3 -63.1 -34.1 -3.2 -2.3 21.4 118 461 B E H 3< S+ 0 0 80 -4,-1.8 -69,-0.5 -5,-0.2 -68,-0.3 0.856 90.0 86.8 -61.9 -30.8 -1.4 -4.3 24.2 119 462 B Q S << S- 0 0 30 -4,-1.2 2,-0.2 -3,-0.7 -70,-0.1 -0.335 75.8-138.7 -67.5 151.9 -4.9 -5.3 25.6 120 463 B G >> - 0 0 11 -72,-0.1 4,-2.1 1,-0.1 3,-0.5 -0.684 27.4-101.3-108.8 165.8 -6.5 -8.4 24.0 121 464 B I H 3> S+ 0 0 12 -76,-0.8 4,-1.5 1,-0.3 -75,-0.1 0.886 126.7 52.6 -53.3 -35.7 -10.1 -8.9 23.0 122 465 B D H 3> S+ 0 0 122 1,-0.2 4,-0.6 2,-0.2 -1,-0.3 0.879 106.9 51.7 -69.4 -34.3 -10.5 -10.9 26.3 123 466 B D H X4 S+ 0 0 68 -3,-0.5 3,-0.6 1,-0.2 4,-0.2 0.853 108.9 50.8 -71.0 -31.3 -9.1 -8.0 28.3 124 467 B L H >< S+ 0 0 0 -4,-2.1 3,-1.9 1,-0.2 6,-0.3 0.827 95.6 70.0 -75.4 -29.0 -11.6 -5.6 26.6 125 468 B A H 3< S+ 0 0 45 -4,-1.5 -1,-0.2 1,-0.3 -2,-0.2 0.800 77.6 82.5 -59.0 -23.7 -14.5 -7.9 27.5 126 469 B D T << S+ 0 0 92 -3,-0.6 2,-0.5 -4,-0.6 -1,-0.3 0.868 89.0 58.9 -50.1 -34.0 -13.8 -6.9 31.2 127 470 B I S X S- 0 0 29 -3,-1.9 3,-0.8 -4,-0.2 -1,-0.1 -0.846 73.4-154.4-100.9 127.8 -15.9 -3.8 30.3 128 471 B E T 3 S+ 0 0 188 -2,-0.5 -1,-0.1 1,-0.2 -2,-0.1 0.870 92.5 70.5 -67.3 -33.1 -19.5 -4.4 29.2 129 472 B G T 3 S+ 0 0 36 -3,-0.1 2,-0.4 2,-0.0 -1,-0.2 0.855 98.0 59.2 -53.0 -31.6 -19.5 -1.1 27.3 130 473 B L S < S- 0 0 4 -3,-0.8 2,-0.2 -6,-0.3 3,-0.0 -0.804 79.3-149.6-101.1 140.5 -17.0 -2.7 24.9 131 474 B T > - 0 0 87 -2,-0.4 4,-4.0 1,-0.1 5,-0.3 -0.674 28.3-110.7-104.1 161.8 -18.0 -5.9 22.9 132 475 B D H > S+ 0 0 92 -2,-0.2 4,-1.8 1,-0.2 5,-0.2 0.902 122.3 43.9 -57.9 -37.6 -15.7 -8.7 21.8 133 476 B E H > S+ 0 0 168 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.941 118.7 41.6 -73.9 -46.1 -16.3 -7.5 18.2 134 477 B K H > S+ 0 0 82 2,-0.2 4,-1.6 1,-0.2 -2,-0.2 0.896 114.3 53.4 -68.7 -37.0 -15.9 -3.8 19.0 135 478 B A H X S+ 0 0 0 -4,-4.0 4,-1.9 2,-0.2 -1,-0.2 0.941 109.9 47.1 -64.1 -44.7 -12.9 -4.5 21.3 136 479 B G H X S+ 0 0 0 -4,-1.8 4,-2.3 -5,-0.3 5,-0.3 0.935 108.4 55.0 -63.9 -43.1 -11.1 -6.4 18.6 137 480 B A H X S+ 0 0 59 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.878 109.2 49.0 -58.8 -34.0 -11.7 -3.7 16.0 138 481 B L H X S+ 0 0 12 -4,-1.6 4,-2.5 2,-0.2 5,-0.3 0.876 108.4 53.7 -74.4 -35.2 -10.1 -1.2 18.5 139 482 B I H X S+ 0 0 0 -4,-1.9 4,-3.0 2,-0.2 5,-0.3 0.979 112.7 41.4 -64.0 -53.9 -7.1 -3.5 19.0 140 483 B M H X S+ 0 0 14 -4,-2.3 4,-3.5 1,-0.2 5,-0.3 0.930 114.3 53.8 -60.7 -42.5 -6.3 -3.8 15.3 141 484 B A H X S+ 0 0 31 -4,-1.8 4,-1.8 -5,-0.3 -1,-0.2 0.951 113.3 42.1 -58.3 -47.4 -7.0 -0.1 14.8 142 485 B A H X S+ 0 0 0 -4,-2.5 4,-1.7 2,-0.2 -2,-0.2 0.957 117.0 46.9 -66.0 -47.7 -4.5 0.9 17.5 143 486 B R H X S+ 0 0 25 -4,-3.0 4,-3.1 -5,-0.3 5,-0.4 0.931 109.6 54.6 -60.8 -42.6 -1.9 -1.7 16.4 144 487 B N H X S+ 0 0 53 -4,-3.5 4,-3.1 -5,-0.3 -1,-0.2 0.912 104.9 54.4 -58.9 -39.2 -2.3 -0.6 12.8 145 488 B I H < S+ 0 0 81 -4,-1.8 -1,-0.2 -5,-0.3 -2,-0.2 0.917 113.7 41.4 -62.3 -40.3 -1.6 3.0 13.9 146 489 B C H >< S+ 0 0 56 -4,-1.7 3,-0.9 2,-0.2 4,-0.4 0.967 120.9 40.2 -72.8 -52.1 1.7 1.9 15.5 147 490 B W H 3< S+ 0 0 171 -4,-3.1 3,-0.4 1,-0.3 -2,-0.2 0.908 128.9 33.8 -64.4 -38.5 2.8 -0.5 12.8 148 491 B F T >< S+ 0 0 103 -4,-3.1 3,-0.8 -5,-0.4 -1,-0.3 0.265 89.3 103.4 -99.2 13.1 1.6 1.9 10.1 149 492 B G T < + 0 0 45 -3,-0.9 -1,-0.2 1,-0.2 -2,-0.1 0.848 69.2 68.5 -63.8 -29.8 2.5 5.0 12.2 150 493 B D T 3 S+ 0 0 164 -4,-0.4 2,-0.4 -3,-0.4 -1,-0.2 0.892 96.5 61.5 -57.4 -36.2 5.6 5.4 10.0 151 494 B E < 0 0 138 -3,-0.8 -3,-0.0 -4,-0.1 0, 0.0 -0.737 360.0 360.0 -93.3 138.7 3.2 6.4 7.1 152 495 B A 0 0 166 -2,-0.4 -2,-0.1 0, 0.0 -1,-0.1 -0.383 360.0 360.0 -57.8 360.0 1.0 9.4 7.5