==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 19-JUL-00 1GC4 . COMPND 2 MOLECULE: ASPARTATE AMINOTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS THERMOPHILUS; . AUTHOR H.URA,T.NAKAI,K.HIROTSU,S.KURAMITSU . 1532 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 53888.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1144 74.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 100 6.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 82 5.4 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 . 116 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 191 12.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 552 36.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 40 2.6 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 0 4 4 1 3 0 8 13 11 0 0 0 0 0 0 0 0 0 0 0 0 0 4 0 0 RESIDUES PER ALPHA HELIX . 0 4 4 8 0 4 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 . 6 4 3 8 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 ANTIPARALLEL BRIDGES PER LADDER . 4 3 1 0 0 4 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 1 A M 0 0 111 0, 0.0 580,-0.2 0, 0.0 581,-0.1 0.000 360.0 360.0 360.0 170.7 -12.5 16.4 49.2 2 2 A R + 0 0 64 578,-0.6 2,-0.1 579,-0.1 548,-0.1 -0.008 360.0 93.3 -71.2 175.8 -10.2 17.0 46.2 3 3 A G - 0 0 25 546,-0.1 2,-0.1 492,-0.0 579,-0.1 -0.263 68.7 -70.5 121.0 154.2 -6.5 16.3 45.7 4 4 A L - 0 0 47 1,-0.1 490,-0.3 -2,-0.1 489,-0.1 -0.436 51.5-106.3 -77.4 155.7 -4.1 13.7 44.2 5 5 A S - 0 0 0 488,-2.1 491,-0.1 -2,-0.1 -1,-0.1 0.094 26.0-117.5 -68.1-176.2 -3.6 10.3 45.9 6 6 A R S S+ 0 0 144 489,-0.1 4,-0.3 2,-0.1 -1,-0.1 0.323 105.5 60.6-110.6 8.4 -0.3 9.7 47.7 7 7 A R S S+ 0 0 45 485,-0.3 4,-0.2 2,-0.2 -1,-0.1 0.687 112.1 38.3-101.6 -24.5 1.0 6.8 45.6 8 8 A V S S+ 0 0 10 484,-0.3 -2,-0.1 2,-0.2 485,-0.1 0.451 115.0 58.0 -97.9 -9.6 1.1 8.8 42.5 9 9 A Q S S+ 0 0 130 1,-0.1 -2,-0.2 -5,-0.0 -1,-0.1 0.698 105.2 49.3 -90.0 -25.1 2.3 11.7 44.6 10 10 A A S S+ 0 0 79 -4,-0.3 -2,-0.2 2,-0.1 -1,-0.1 0.523 83.8 112.8 -93.2 -8.7 5.3 9.8 45.9 11 11 A M - 0 0 25 -4,-0.2 -3,-0.0 1,-0.1 630,-0.0 -0.394 64.0-128.5 -73.1 140.3 6.7 8.5 42.6 12 12 A K - 0 0 110 1,-0.1 3,-0.1 -2,-0.1 -1,-0.1 -0.708 31.1-106.5 -85.1 140.1 10.0 9.8 41.3 13 13 A P - 0 0 95 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.145 38.4 -95.1 -62.6 157.1 10.1 11.1 37.6 14 14 A D > - 0 0 13 1,-0.2 4,-1.8 2,-0.0 5,-0.1 -0.637 24.0-155.7 -79.9 132.9 11.7 9.1 34.8 15 15 A A H > S+ 0 0 12 -2,-0.4 4,-2.3 2,-0.2 5,-0.2 0.895 97.2 47.8 -72.7 -39.8 15.2 10.2 34.2 16 16 A V H > S+ 0 0 3 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.961 111.8 46.7 -65.9 -52.6 15.0 8.9 30.7 17 17 A V H > S+ 0 0 45 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.908 115.2 50.0 -55.4 -40.6 11.6 10.6 29.9 18 18 A A H X S+ 0 0 54 -4,-1.8 4,-1.4 1,-0.2 -1,-0.2 0.887 111.5 44.9 -66.2 -42.5 13.0 13.8 31.4 19 19 A V H X S+ 0 0 29 -4,-2.3 4,-2.8 2,-0.2 -1,-0.2 0.865 111.5 54.0 -70.3 -39.1 16.3 13.8 29.5 20 20 A N H X S+ 0 0 41 -4,-2.6 4,-2.7 2,-0.2 -2,-0.2 0.992 105.8 50.7 -58.9 -59.1 14.6 13.0 26.2 21 21 A A H X S+ 0 0 63 -4,-2.0 4,-2.3 1,-0.2 -1,-0.2 0.852 113.3 48.5 -44.1 -46.6 12.1 15.9 26.4 22 22 A K H X S+ 0 0 106 -4,-1.4 4,-1.6 2,-0.2 5,-0.2 0.987 110.5 48.2 -58.8 -60.5 15.0 18.1 27.0 23 23 A A H >X S+ 0 0 1 -4,-2.8 4,-2.1 1,-0.2 3,-1.0 0.905 111.9 52.8 -45.3 -56.4 17.1 16.9 24.2 24 24 A L H >X S+ 0 0 42 -4,-2.7 4,-1.5 1,-0.3 3,-0.6 0.900 104.6 50.8 -46.5 -65.3 14.2 17.2 21.9 25 25 A E H 3X S+ 0 0 74 -4,-2.3 4,-1.8 1,-0.3 -1,-0.3 0.752 110.3 50.6 -46.9 -36.5 13.3 20.8 22.5 26 26 A L H << S+ 0 0 28 -4,-1.6 -1,-0.3 -3,-1.0 -2,-0.2 0.899 104.0 56.5 -70.8 -40.0 16.9 21.9 21.9 27 27 A R H << S+ 0 0 117 -4,-2.1 3,-0.3 -3,-0.6 -2,-0.2 0.818 112.1 48.4 -57.2 -27.0 16.9 20.0 18.6 28 28 A R H < S+ 0 0 161 -4,-1.5 2,-1.1 -5,-0.3 -2,-0.3 0.854 105.3 54.0 -81.7 -40.2 13.9 22.3 18.2 29 29 A Q S < S- 0 0 81 -4,-1.8 2,-0.8 -5,-0.2 -1,-0.2 -0.559 131.7 -77.0 -96.9 74.1 15.5 25.6 19.3 30 30 A G S S+ 0 0 19 -2,-1.1 1067,-0.1 -3,-0.3 1073,-0.0 -0.700 93.1 127.3 73.2-110.0 18.4 25.5 16.9 31 31 A V - 0 0 30 -2,-0.8 2,-0.8 1,-0.2 -1,-0.1 0.854 42.7-161.1 23.8 106.4 20.6 23.0 18.7 32 32 A D + 0 0 76 -3,-0.1 2,-0.5 -4,-0.0 -1,-0.2 -0.930 24.0 169.8-108.0 105.4 22.0 19.9 17.1 33 33 A L - 0 0 8 -2,-0.8 2,-0.3 -10,-0.1 313,-0.2 -0.984 35.6-128.5-121.9 118.9 22.9 17.6 20.0 34 34 A V E -a 346 0A 8 311,-2.0 313,-1.8 -2,-0.5 2,-0.7 -0.531 30.0-149.0 -63.8 124.1 23.9 14.0 19.4 35 35 A A E +a 347 0A 18 -2,-0.3 2,-0.2 311,-0.2 3,-0.2 -0.809 29.8 172.0-110.2 100.5 21.6 12.0 21.7 36 36 A L + 0 0 2 311,-1.4 327,-1.9 -2,-0.7 313,-0.4 -0.142 52.8 106.5 -91.2 38.9 22.8 8.7 23.3 37 37 A T + 0 0 5 -2,-0.2 312,-0.2 311,-0.2 -1,-0.1 0.984 51.7 57.2 -81.8 -79.6 19.8 8.6 25.6 38 38 A A S S- 0 0 17 -3,-0.2 2,-1.9 1,-0.1 327,-0.2 -0.236 70.9-123.0 -66.7 145.6 16.9 6.2 25.0 39 39 A G + 0 0 0 325,-0.1 -1,-0.1 326,-0.0 283,-0.1 -0.377 69.8 113.9 -84.1 62.4 17.1 2.4 24.8 40 40 A E - 0 0 44 -2,-1.9 194,-0.1 281,-0.1 325,-0.1 -0.990 64.9-114.3-138.9 130.2 15.6 2.0 21.3 41 41 A P - 0 0 3 0, 0.0 325,-0.1 0, 0.0 324,-0.1 0.121 9.6-142.2 -47.2 167.1 17.0 0.7 18.0 42 42 A D S S+ 0 0 73 323,-0.5 324,-0.1 324,-0.1 325,-0.0 0.589 76.6 100.5-105.9 -23.9 17.4 3.0 15.0 43 43 A F S S- 0 0 38 322,-0.3 2,-0.4 1,-0.1 193,-0.0 -0.203 77.0-124.5 -58.9 150.6 16.4 0.1 12.8 44 44 A D - 0 0 54 1,-0.1 194,-0.1 194,-0.1 3,-0.1 -0.821 39.1 -84.1-103.0 139.1 12.8 0.1 11.7 45 45 A T - 0 0 3 192,-0.8 5,-0.2 -2,-0.4 192,-0.2 -0.168 62.3 -91.1 -42.7 125.0 10.6 -3.0 12.3 46 46 A P >> - 0 0 15 0, 0.0 4,-1.6 0, 0.0 3,-0.8 0.076 27.4-121.7 -40.4 144.5 11.2 -5.6 9.6 47 47 A E H 3> S+ 0 0 112 1,-0.2 4,-3.2 2,-0.2 5,-0.3 0.878 109.1 62.3 -60.6 -40.9 9.0 -5.6 6.5 48 48 A H H 3> S+ 0 0 31 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.838 108.1 45.9 -57.5 -28.4 7.7 -9.1 6.9 49 49 A V H <> S+ 0 0 0 -3,-0.8 4,-0.7 2,-0.2 -1,-0.2 0.886 113.3 48.1 -80.0 -39.7 6.2 -7.9 10.2 50 50 A K H >X S+ 0 0 5 -4,-1.6 4,-1.3 2,-0.2 3,-0.8 0.868 105.1 58.6 -66.8 -40.0 4.7 -4.7 8.6 51 51 A E H >X S+ 0 0 104 -4,-3.2 4,-2.5 1,-0.3 3,-1.0 0.950 105.4 51.2 -55.2 -47.1 3.2 -6.6 5.7 52 52 A A H 3X S+ 0 0 8 -4,-1.1 4,-1.1 1,-0.3 -1,-0.3 0.680 104.3 55.5 -65.2 -21.1 1.2 -8.7 8.2 53 53 A A H S+ 0 0 1 -4,-1.1 5,-2.5 2,-0.2 3,-0.4 0.954 112.1 43.0 -70.1 -50.1 -4.5 -7.6 9.4 57 57 A L H ><5S+ 0 0 5 -4,-1.7 3,-1.8 1,-0.2 -2,-0.2 0.892 111.0 57.5 -59.8 -42.5 -6.1 -4.2 8.6 58 58 A A H 3<5S+ 0 0 73 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.799 108.5 44.4 -59.1 -33.9 -7.0 -5.6 5.1 59 59 A Q T 3<5S- 0 0 109 -4,-1.3 -1,-0.3 -3,-0.4 -2,-0.2 0.221 118.2-114.3 -96.0 14.4 -9.0 -8.4 6.7 60 60 A G T < 5 + 0 0 21 -3,-1.8 2,-0.8 1,-0.2 -3,-0.2 0.916 53.2 166.2 53.2 49.0 -10.5 -6.0 9.1 61 61 A K < + 0 0 57 -5,-2.5 -1,-0.2 1,-0.2 212,-0.1 -0.245 35.8 116.2 -87.9 47.8 -8.8 -7.6 12.2 62 62 A T + 0 0 0 -2,-0.8 561,-2.2 -5,-0.1 562,-0.3 0.049 39.4 105.6-107.5 26.1 -9.7 -4.5 14.3 63 63 A K S S- 0 0 52 1,-0.2 206,-0.1 559,-0.2 2,-0.1 -0.171 79.7 -70.2 -93.3-174.8 -12.1 -5.8 17.0 64 64 A Y - 0 0 49 205,-0.1 -1,-0.2 -2,-0.1 559,-0.1 -0.403 47.6-154.4 -72.3 162.0 -11.5 -6.4 20.7 65 65 A A - 0 0 14 202,-0.1 204,-0.0 1,-0.1 5,-0.0 -0.880 33.0 -75.8-132.3 160.7 -9.3 -9.3 21.7 66 66 A P > - 0 0 60 0, 0.0 3,-1.9 0, 0.0 4,-0.1 -0.178 42.3-116.1 -54.5 150.6 -9.2 -11.4 25.0 67 67 A P T 3 S+ 0 0 24 0, 0.0 3,-0.1 0, 0.0 197,-0.1 0.815 120.0 50.5 -61.2 -23.0 -7.6 -9.6 27.9 68 68 A A T 3 S- 0 0 13 1,-0.2 28,-1.6 198,-0.1 198,-0.1 0.470 123.2-101.7 -90.8 -4.0 -4.9 -12.4 27.8 69 69 A G < - 0 0 3 -3,-1.9 -1,-0.2 26,-0.2 200,-0.1 0.013 52.8 -42.8 99.3 154.1 -4.4 -11.9 24.0 70 70 A I > - 0 0 7 1,-0.1 4,-2.0 -4,-0.1 5,-0.1 -0.172 54.0-122.0 -53.0 140.0 -5.4 -13.7 20.8 71 71 A P H > S+ 0 0 85 0, 0.0 4,-0.6 0, 0.0 -1,-0.1 0.653 109.0 55.6 -58.6 -18.6 -5.2 -17.5 21.1 72 72 A E H >> S+ 0 0 89 2,-0.2 4,-2.1 3,-0.1 3,-0.9 0.954 107.6 42.0 -81.2 -54.5 -2.8 -17.6 18.2 73 73 A L H 3> S+ 0 0 0 1,-0.3 4,-1.5 2,-0.2 -1,-0.1 0.873 115.1 58.1 -59.3 -34.2 -0.1 -15.2 19.4 74 74 A R H 3X S+ 0 0 44 -4,-2.0 4,-0.7 1,-0.2 -1,-0.3 0.779 105.5 46.5 -66.3 -31.1 -0.6 -17.1 22.6 75 75 A E H << S+ 0 0 84 -3,-0.9 3,-0.4 -4,-0.6 4,-0.4 0.881 110.2 50.4 -81.8 -36.4 0.2 -20.4 21.1 76 76 A A H >X S+ 0 0 6 -4,-2.1 4,-1.0 1,-0.3 3,-0.7 0.781 107.0 59.1 -70.3 -27.0 3.3 -19.3 19.3 77 77 A L H 3X S+ 0 0 0 -4,-1.5 4,-1.8 -5,-0.3 -1,-0.3 0.824 98.3 56.6 -70.7 -32.1 4.4 -17.8 22.6 78 78 A A H 3< S+ 0 0 7 -4,-0.7 11,-0.4 -3,-0.4 -1,-0.2 0.619 111.9 44.0 -75.6 -9.8 4.2 -21.3 24.2 79 79 A E H <>>S+ 0 0 79 -3,-0.7 4,-2.7 -4,-0.4 5,-0.6 0.553 109.2 54.9-104.9 -20.8 6.7 -22.4 21.5 80 80 A K H X>S+ 0 0 7 -4,-1.0 4,-2.0 2,-0.2 5,-1.2 0.959 112.8 41.6 -73.2 -62.7 9.0 -19.4 21.8 81 81 A F H <5S+ 0 0 0 -4,-1.8 6,-2.1 3,-0.2 -3,-0.1 0.750 125.6 42.0 -54.2 -22.6 9.5 -19.9 25.5 82 82 A R H >5S+ 0 0 143 -5,-0.2 4,-0.5 4,-0.2 -1,-0.2 0.943 122.2 30.8 -86.2 -62.5 9.7 -23.6 24.7 83 83 A R H <5S+ 0 0 107 -4,-2.7 -3,-0.2 2,-0.1 -2,-0.2 0.942 137.0 26.0 -65.0 -55.3 11.8 -24.0 21.6 84 84 A E T < - 0 0 63 -2,-0.3 3,-2.3 -8,-0.0 -2,-0.0 -0.744 43.4 -95.4-103.8 161.8 1.3 -24.6 27.7 91 91 A P G > S+ 0 0 33 0, 0.0 3,-1.8 0, 0.0 -14,-0.0 0.736 120.7 66.1 -51.2 -28.6 -0.6 -21.5 26.3 92 92 A E G 3 S+ 0 0 86 1,-0.3 -17,-0.0 3,-0.0 161,-0.0 0.727 98.5 55.6 -68.7 -20.6 -2.7 -20.9 29.4 93 93 A E G < S+ 0 0 40 -3,-2.3 155,-1.3 160,-0.1 -1,-0.3 0.015 97.8 85.2 -97.8 24.7 0.5 -20.1 31.1 94 94 A T E < -B 247 0B 0 -3,-1.8 2,-0.3 153,-0.2 153,-0.2 -0.846 55.9-176.0-122.2 157.6 1.3 -17.4 28.5 95 95 A I E -B 246 0B 1 151,-1.6 151,-1.7 -2,-0.3 2,-0.5 -0.940 19.6-143.0-160.9 135.2 0.1 -13.8 28.4 96 96 A V E +B 245 0B 0 -28,-1.6 2,-0.3 -2,-0.3 149,-0.3 -0.853 29.9 178.5-100.0 127.1 0.3 -10.9 26.0 97 97 A T E -B 244 0B 0 147,-2.3 147,-2.8 -2,-0.5 2,-2.4 -0.852 43.5 -89.5-128.3 167.5 0.7 -7.5 27.6 98 98 A V S > S- 0 0 5 -2,-0.3 4,-0.8 145,-0.2 145,-0.3 -0.457 94.7 -46.2 -76.6 74.4 1.1 -3.9 26.6 99 99 A G H > S- 0 0 0 -2,-2.4 4,-1.1 143,-0.2 145,-0.3 -0.319 79.9 -67.7 91.5 179.3 4.9 -3.9 26.4 100 100 A G H > S+ 0 0 11 143,-0.2 4,-1.2 2,-0.2 5,-0.2 0.864 132.3 63.7 -71.5 -34.4 7.4 -5.4 28.8 101 101 A S H >> S+ 0 0 9 1,-0.2 4,-3.0 2,-0.2 3,-0.5 0.884 100.8 48.3 -54.4 -48.0 6.3 -2.6 31.2 102 102 A Q H 3X S+ 0 0 1 -4,-0.8 4,-3.0 1,-0.2 5,-0.4 0.914 106.6 56.1 -63.2 -43.3 2.7 -3.9 31.5 103 103 A A H 3X S+ 0 0 0 -4,-1.1 4,-0.6 1,-0.2 -1,-0.2 0.746 115.3 39.0 -61.6 -24.2 3.9 -7.5 32.2 104 104 A L H - 0 0 36 -2,-0.6 3,-1.8 1,-0.1 22,-0.1 -0.682 53.3 -75.9 -95.9 155.0 0.4 -6.9 49.2 114 114 A P T 3 S+ 0 0 71 0, 0.0 23,-0.2 0, 0.0 -1,-0.1 -0.245 119.3 19.1 -53.0 141.1 1.4 -3.7 51.0 115 115 A G T 3 S+ 0 0 40 21,-2.9 22,-0.2 1,-0.3 2,-0.1 0.491 86.3 140.6 77.8 3.0 4.7 -3.9 52.9 116 116 A D < - 0 0 26 -3,-1.8 22,-2.8 1,-0.1 2,-0.3 -0.499 50.4-123.5 -75.0 149.6 5.9 -7.0 51.0 117 117 A E E -cd 138 165B 24 47,-0.9 49,-2.8 20,-0.2 50,-1.5 -0.768 24.4-172.5 -99.2 143.1 9.6 -6.9 50.2 118 118 A V E -cd 139 167B 0 20,-2.5 22,-2.5 -2,-0.3 2,-0.7 -0.998 17.4-140.0-133.5 126.9 11.1 -7.2 46.7 119 119 A I E -cd 140 168B 0 48,-2.4 50,-2.4 -2,-0.4 2,-0.3 -0.806 20.1-177.0 -92.2 115.8 14.9 -7.5 46.2 120 120 A V E -cd 141 169B 0 20,-1.1 22,-2.3 -2,-0.7 2,-0.6 -0.816 21.5-135.1-106.8 146.5 16.2 -5.5 43.2 121 121 A L E -c 142 0B 11 48,-0.6 22,-0.2 -2,-0.3 20,-0.1 -0.938 38.2 -97.5-105.9 120.1 19.9 -5.8 42.4 122 122 A S E S+c 143 0B 8 20,-2.1 22,-0.9 -2,-0.6 233,-0.1 -0.530 103.1 48.5 -86.2 147.5 21.6 -2.4 41.7 123 123 A P S S+ 0 0 10 0, 0.0 2,-0.3 0, 0.0 54,-0.2 0.521 87.5 167.5 -70.9 139.3 22.3 -0.9 39.2 124 124 A Y - 0 0 24 230,-1.8 2,-0.2 -2,-0.1 232,-0.1 -0.830 43.9 -85.0-123.2 162.2 18.8 -1.5 38.1 125 125 A W > - 0 0 14 50,-0.3 3,-0.7 -2,-0.3 229,-0.0 -0.483 50.4-109.0 -67.8 131.1 16.6 -0.2 35.3 126 126 A V T 3> S+ 0 0 11 1,-0.2 4,-0.5 -2,-0.2 -1,-0.1 0.597 107.4 52.3 -31.1 -32.2 14.8 3.0 36.5 127 127 A S H >> S+ 0 0 0 1,-0.2 4,-2.1 2,-0.1 3,-0.5 0.918 81.4 80.3 -80.3 -50.8 11.3 1.5 36.8 128 128 A Y H <> S+ 0 0 5 -3,-0.7 4,-2.1 1,-0.2 -1,-0.2 0.676 98.7 43.8 -26.7 -48.6 11.5 -1.6 38.9 129 129 A P H 3> S+ 0 0 4 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.949 113.5 51.3 -70.3 -47.9 11.6 0.3 42.3 130 130 A E H S+ 0 0 0 -4,-2.1 5,-1.0 -5,-0.3 -2,-0.2 0.788 116.6 42.7 -56.9 -28.9 7.5 -2.2 43.3 133 133 A R H ><5S+ 0 0 115 -4,-2.4 3,-1.3 2,-0.2 -1,-0.2 0.803 104.0 60.9 -87.1 -35.5 6.5 0.8 45.4 134 134 A F H 3<5S+ 0 0 11 -4,-1.8 -2,-0.2 1,-0.3 -1,-0.2 0.676 105.5 54.2 -66.3 -15.0 3.4 1.9 43.5 135 135 A A T 3<5S- 0 0 5 -4,-1.0 -1,-0.3 -5,-0.1 -2,-0.2 0.529 123.8-102.0 -95.8 -8.9 2.1 -1.6 44.5 136 136 A G T < 5S+ 0 0 30 -3,-1.3 -21,-2.9 1,-0.3 -3,-0.2 0.125 81.4 125.0 109.0 -19.2 2.7 -1.1 48.3 137 137 A G < - 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0 0 0 35,-2.8 35,-0.5 -2,-0.7 -11,-0.2 -0.845 16.5-132.5-112.4 104.7 30.5 5.3 31.7 326 326 A D - 0 0 44 -2,-0.7 -13,-0.4 -13,-0.5 33,-0.3 -0.189 14.1-163.5 -46.9 121.0 32.2 6.6 34.8 327 327 A T > + 0 0 0 31,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.315 49.3 125.1 -94.5 8.1 32.2 10.4 34.6 328 328 A S T 4 S+ 0 0 82 1,-0.2 -1,-0.2 2,-0.2 31,-0.0 0.789 78.6 44.9 -32.3 -45.4 34.9 11.0 37.2 329 329 A P T 4 S+ 0 0 68 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.984 108.7 49.7 -68.9 -62.7 36.8 13.1 34.6 330 330 A I T 4 S- 0 0 10 1,-0.1 -2,-0.2 2,-0.1 3,-0.1 0.801 131.3 -32.3 -49.2 -32.8 34.1 15.3 33.1 331 331 A A < - 0 0 10 -4,-2.0 -1,-0.1 1,-0.1 6,-0.0 -0.962 62.9 -93.5-178.2 166.0 32.9 16.3 36.6 332 332 A P S S+ 0 0 122 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 0.924 101.3 34.7 -57.3 -55.9 32.5 15.1 40.2 333 333 A D S > S- 0 0 56 1,-0.1 4,-0.5 -3,-0.1 -2,-0.1 -0.279 80.8-116.6 -92.8-175.2 28.9 13.9 40.1 334 334 A E H > S+ 0 0 22 3,-0.1 4,-1.4 2,-0.1 5,-0.1 0.761 110.1 57.7 -91.7 -31.6 26.7 12.2 37.4 335 335 A V H > S+ 0 0 64 2,-0.2 4,-1.6 1,-0.2 3,-0.5 0.985 109.9 35.6 -62.0 -68.2 24.4 15.1 37.3 336 336 A R H > S+ 0 0 143 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.846 111.8 62.0 -55.4 -40.3 26.7 18.0 36.5 337 337 A A H X S+ 0 0 0 -4,-0.5 4,-3.0 1,-0.2 -1,-0.2 0.906 106.4 48.1 -53.6 -40.4 28.8 15.8 34.2 338 338 A A H X S+ 0 0 13 -4,-1.4 4,-1.9 -3,-0.5 -1,-0.2 0.881 110.2 49.4 -68.2 -40.1 25.6 15.4 32.2 339 339 A E H X S+ 0 0 110 -4,-1.6 4,-0.9 2,-0.2 -1,-0.2 0.782 113.1 48.7 -68.4 -27.3 25.0 19.2 32.2 340 340 A R H >X S+ 0 0 73 -4,-2.4 4,-1.6 2,-0.2 3,-0.8 0.967 113.9 46.0 -72.9 -57.9 28.6 19.6 31.0 341 341 A L H 3<>S+ 0 0 0 -4,-3.0 5,-1.7 1,-0.3 4,-0.3 0.716 105.4 59.0 -56.5 -28.5 28.1 17.0 28.4 342 342 A L H ><5S+ 0 0 46 -4,-1.9 3,-1.0 3,-0.2 -1,-0.3 0.865 104.0 52.4 -72.3 -33.5 24.8 18.4 27.2 343 343 A E H <<5S+ 0 0 153 -4,-0.9 -2,-0.2 -3,-0.8 -1,-0.2 0.950 101.9 59.4 -62.8 -50.2 26.6 21.7 26.4 344 344 A A T 3<5S- 0 0 22 -4,-1.6 -1,-0.3 2,-0.1 -2,-0.2 0.596 131.0 -98.1 -53.8 -13.3 29.1 19.7 24.4 345 345 A G T < 5S+ 0 0 6 -3,-1.0 -311,-2.0 -4,-0.3 2,-0.4 0.787 87.1 118.5 97.2 35.2 26.2 18.6 22.3 346 346 A V E < -a 34 0A 0 -5,-1.7 2,-0.6 -313,-0.2 -311,-0.2 -0.931 48.6-153.6-140.9 116.4 25.5 15.2 23.8 347 347 A A E +a 35 0A 2 -313,-1.8 -311,-1.4 -2,-0.4 2,-0.3 -0.764 26.3 165.5 -87.9 120.7 22.4 14.0 25.6 348 348 A V - 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0 0 2 -5,-2.5 -1,-0.3 -6,-0.2 -2,-0.2 -0.657 40.9-134.5 -76.9 122.4 13.4 39.3 11.1 1079 1313 C K + 0 0 135 -2,-0.5 13,-0.4 13,-0.4 2,-0.3 -0.504 37.8 150.5 -79.1 146.4 13.3 42.4 13.2 1080 1314 C A - 0 0 19 11,-0.2 2,-0.2 -2,-0.2 11,-0.2 -0.898 43.3-108.3-171.3 146.7 16.1 45.0 13.1 1081 1315 C V - 0 0 38 9,-1.2 9,-0.3 -2,-0.3 -11,-0.0 -0.568 36.3-112.0 -85.7 150.4 16.4 48.7 13.7 1082 1316 C R - 0 0 128 -2,-0.2 2,-0.2 7,-0.1 7,-0.1 -0.752 29.5-145.2 -85.7 114.3 16.9 51.1 10.7 1083 1317 C P - 0 0 0 0, 0.0 -138,-0.2 0, 0.0 -139,-0.2 -0.547 16.2-169.7 -79.9 142.5 20.3 52.7 10.7 1084 1318 C S S S+ 0 0 29 -140,-1.8 -106,-1.3 -2,-0.2 -107,-1.2 0.300 73.4 24.8-110.4 5.2 20.7 56.3 9.4 1085 1319 C G B > S+C 976 0L 0 -141,-0.8 3,-0.5 -109,-0.2 -109,-0.2 -0.954 99.2 19.0-158.7 174.1 24.6 56.0 9.4 1086 1320 C A T 3 S- 0 0 0 -111,-1.9 -109,-0.1 -114,-0.5 -145,-0.1 -0.113 88.2 -81.5 54.1-156.0 27.7 53.8 9.3 1087 1321 C F T 3 S+ 0 0 0 -21,-0.0 43,-1.5 -282,-0.0 44,-0.4 -0.043 87.1 98.0-139.7 45.0 27.2 50.3 7.9 1088 1322 C Y E < -D 1129 0M 0 -3,-0.5 2,-0.4 -148,-0.2 41,-0.2 -0.924 44.9-161.5-129.9 152.5 25.8 48.0 10.5 1089 1323 C V E -D 1128 0M 0 39,-2.2 39,-2.2 -2,-0.3 2,-0.7 -0.997 17.9-138.3-134.3 128.5 22.3 46.7 11.3 1090 1324 C L E -D 1127 0M 3 -2,-0.4 -9,-1.2 -9,-0.3 2,-0.7 -0.840 24.0-163.6 -91.7 114.6 21.5 45.2 14.6 1091 1325 C M - 0 0 0 35,-2.8 35,-0.5 -2,-0.7 -11,-0.2 -0.842 16.5-132.6-112.9 104.4 19.3 42.2 14.0 1092 1326 C D - 0 0 42 -2,-0.7 -13,-0.4 -13,-0.4 33,-0.3 -0.176 14.2-163.4 -46.4 120.2 17.2 40.6 16.7 1093 1327 C T > + 0 0 0 31,-1.9 4,-2.0 1,-0.2 -1,-0.2 0.321 49.3 125.2 -93.9 8.2 17.8 36.8 16.5 1094 1328 C S T 4 S+ 0 0 83 1,-0.2 -1,-0.2 2,-0.2 -16,-0.0 0.789 78.5 44.6 -32.2 -46.1 14.8 35.9 18.7 1095 1329 C P T 4 S+ 0 0 70 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.982 108.8 49.9 -68.5 -62.6 13.5 33.7 15.8 1096 1330 C I T 4 S- 0 0 6 1,-0.1 -2,-0.2 2,-0.1 3,-0.1 0.795 131.4 -31.9 -49.2 -32.8 16.7 31.8 14.7 1097 1331 C A < - 0 0 4 -4,-2.0 -1,-0.1 1,-0.1 -1067,-0.1 -0.959 62.8 -94.0-177.7 166.2 17.4 30.8 18.3 1098 1332 C P S S+ 0 0 85 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 0.921 101.4 35.0 -57.3 -55.6 17.0 32.0 22.0 1099 1333 C D S > S- 0 0 54 1,-0.1 4,-0.6 -3,-0.1 -2,-0.1 -0.300 81.0-116.5 -92.8-175.9 20.5 33.6 22.5 1100 1334 C E H > S+ 0 0 21 3,-0.1 4,-1.4 2,-0.1 5,-0.1 0.763 110.8 57.9 -91.4 -30.9 22.8 35.7 20.3 1101 1335 C V H > S+ 0 0 61 2,-0.2 4,-1.5 1,-0.2 3,-0.4 0.982 109.7 36.1 -62.1 -66.0 25.4 33.0 20.5 1102 1336 C R H > S+ 0 0 76 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.845 112.0 61.6 -54.1 -43.8 23.6 29.9 19.3 1103 1337 C A H X S+ 0 0 0 -4,-0.6 4,-3.0 1,-0.2 -1,-0.2 0.909 106.4 47.0 -52.5 -41.5 21.8 31.9 16.7 1104 1338 C A H X S+ 0 0 12 -4,-1.4 4,-1.8 -3,-0.4 -1,-0.2 0.863 111.2 50.0 -68.5 -38.1 25.2 32.7 15.3 1105 1339 C E H X S+ 0 0 89 -4,-1.5 4,-0.6 2,-0.2 -1,-0.2 0.704 113.1 47.7 -71.4 -23.7 26.2 29.0 15.4 1106 1340 C R H >X S+ 0 0 53 -4,-2.1 4,-1.5 -5,-0.2 3,-0.8 0.939 114.2 46.4 -77.1 -57.6 23.0 28.2 13.6 1107 1341 C L H 3<>S+ 0 0 0 -4,-3.0 5,-1.7 1,-0.3 4,-0.3 0.714 104.9 59.3 -56.4 -28.8 23.6 31.0 11.1 1108 1342 C L H ><5S+ 0 0 47 -4,-1.8 3,-1.0 3,-0.2 -1,-0.3 0.870 104.2 52.7 -71.7 -33.4 27.2 30.0 10.5 1109 1343 C E H <<5S+ 0 0 122 -3,-0.8 -2,-0.2 -4,-0.6 -1,-0.2 0.942 101.6 58.8 -63.1 -49.1 26.0 26.5 9.4 1110 1344 C A T 3<5S- 0 0 8 -4,-1.5 -1,-0.3 2,-0.1 -2,-0.2 0.617 131.1 -98.0 -55.4 -13.2 23.6 28.2 6.9 1111 1345 C G T < 5S+ 0 0 7 -3,-1.0 -311,-1.9 -4,-0.3 2,-0.4 0.792 86.8 118.9 97.2 35.1 26.7 29.7 5.4 1112 1346 C V E < -v 800 0J 0 -5,-1.7 2,-0.6 -313,-0.2 -311,-0.2 -0.930 48.4-153.7-140.3 116.2 26.7 33.1 7.1 1113 1347 C A E +v 801 0J 1 -313,-1.7 -311,-1.4 -2,-0.4 2,-0.3 -0.759 26.5 165.3 -87.8 120.6 29.3 34.6 9.4 1114 1348 C V - 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0 0 6 -2,-0.6 -311,-0.2 -10,-0.2 14,-0.2 -0.899 37.8-115.2-130.1 159.7 74.7 65.8 18.7 1498 1849 D V E -P 1510 0Q 0 12,-1.9 12,-3.4 -313,-0.4 2,-0.1 -0.881 31.2-126.3-101.6 120.0 72.6 64.0 21.2 1499 1850 D P E > -P 1509 0Q 24 0, 0.0 3,-0.7 0, 0.0 10,-0.2 -0.418 10.8-136.4 -63.9 137.8 73.7 64.5 24.9 1500 1851 D G T 3 >S+ 0 0 0 8,-1.4 5,-2.8 5,-0.3 4,-0.3 0.159 77.0 106.0 -84.1 23.1 74.3 61.2 26.7 1501 1852 D T T > 5S+ 0 0 45 1,-0.2 3,-0.6 3,-0.2 -1,-0.2 0.905 84.5 41.3 -66.4 -41.8 72.5 62.4 29.9 1502 1853 D D T < 5S+ 0 0 42 -3,-0.7 -1,-0.2 1,-0.2 -2,-0.1 0.646 107.8 58.5 -82.3 -16.4 69.5 60.3 29.2 1503 1854 D F T 3 5S- 0 0 0 -4,-0.2 -230,-1.8 2,-0.1 -1,-0.2 0.452 115.8-112.5 -88.8 -2.5 71.3 57.2 28.0 1504 1855 D A T < 5S+ 0 0 20 -3,-0.6 2,-0.4 -4,-0.3 -3,-0.2 0.791 84.5 127.6 73.2 29.3 73.0 57.1 31.4 1505 1856 D A < - 0 0 5 -5,-2.8 3,-0.5 -232,-0.1 -5,-0.3 -0.632 40.8-178.1-115.3 64.9 76.2 58.0 29.4 1506 1857 D F + 0 0 130 -2,-0.4 2,-0.6 1,-0.2 3,-0.1 -0.308 64.2 24.3 -64.1 152.8 77.3 61.0 31.4 1507 1858 D G S S+ 0 0 21 1,-0.3 -31,-2.0 -32,-0.1 -1,-0.2 -0.211 112.9 85.3 83.0 -42.8 80.3 63.0 30.3 1508 1859 D H E -O 1475 0Q 39 -2,-0.6 -8,-1.4 -3,-0.5 2,-0.3 -0.205 63.9-147.8 -85.7 179.3 79.8 61.6 26.8 1509 1860 D V E -OP14741499Q 0 -35,-0.6 -35,-2.8 -10,-0.2 2,-0.6 -0.960 20.5-125.5-143.7 144.4 77.8 62.7 23.8 1510 1861 D R E -OP14731498Q 0 -12,-3.4 -12,-1.9 -2,-0.3 2,-0.4 -0.887 28.4-179.3-102.5 118.3 76.2 60.3 21.2 1511 1862 D L E -O 1472 0Q 1 -39,-2.1 -39,-2.2 -2,-0.6 2,-0.4 -0.908 16.8-139.5-118.1 145.9 77.0 60.9 17.5 1512 1863 D S E -O 1471 0Q 4 -327,-1.6 3,-0.3 -2,-0.4 -41,-0.2 -0.877 13.3-171.5-105.9 131.1 75.8 58.9 14.5 1513 1864 D Y + 0 0 0 -43,-1.5 -65,-0.1 -2,-0.4 -42,-0.1 0.006 65.7 99.6-106.6 26.3 77.9 57.9 11.5 1514 1865 D A S S+ 0 0 0 -44,-0.4 -323,-0.5 -327,-0.2 -322,-0.3 0.488 71.4 85.1 -87.1 -4.9 75.0 56.6 9.5 1515 1866 D T S S- 0 0 34 -3,-0.3 -324,-0.1 1,-0.2 -67,-0.1 -0.030 95.9 -50.5 -84.0-171.5 75.0 59.9 7.7 1516 1867 D S > - 0 0 37 1,-0.1 4,-1.0 -325,-0.0 -1,-0.2 -0.080 38.5-134.0 -57.0 161.6 77.0 61.1 4.7 1517 1868 D E H > S+ 0 0 77 2,-0.2 4,-1.9 1,-0.1 3,-0.3 0.881 109.9 57.9 -83.7 -44.9 80.7 60.7 4.5 1518 1869 D E H > S+ 0 0 135 1,-0.2 4,-1.6 2,-0.2 -1,-0.1 0.851 109.4 49.7 -51.3 -35.4 81.1 64.3 3.3 1519 1870 D N H > S+ 0 0 40 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.818 98.1 58.4 -77.8 -37.8 79.2 65.2 6.5 1520 1871 D L H X S+ 0 0 2 -4,-1.0 4,-3.0 -3,-0.3 -1,-0.2 0.943 114.4 46.5 -58.6 -38.7 81.2 63.3 9.2 1521 1872 D R H X S+ 0 0 144 -4,-1.9 4,-1.0 2,-0.2 -2,-0.2 0.898 107.1 51.8 -68.2 -46.3 84.0 65.4 7.7 1522 1873 D K H X S+ 0 0 67 -4,-1.6 4,-0.7 1,-0.2 -1,-0.2 0.762 116.5 44.8 -61.6 -26.4 82.1 68.8 7.7 1523 1874 D A H >X S+ 0 0 1 -4,-2.0 4,-1.9 2,-0.2 3,-1.1 0.933 107.1 57.5 -78.9 -54.0 81.4 68.0 11.4 1524 1875 D L H 3X S+ 0 0 19 -4,-3.0 4,-0.7 1,-0.3 -2,-0.2 0.592 104.6 54.1 -51.6 -18.1 85.0 66.9 12.1 1525 1876 D E H 3X S+ 0 0 122 -4,-1.0 4,-1.3 2,-0.2 -1,-0.3 0.828 106.7 48.4 -86.0 -38.0 86.2 70.3 11.0 1526 1877 D R H