==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 23-OCT-09 2WWH . COMPND 2 MOLECULE: THYMIDILATE KINASE, PUTATIVE; . SOURCE 2 ORGANISM_SCIENTIFIC: PLASMODIUM FALCIPARUM; . AUTHOR J.L.WHITTINGHAM,J.CARRERO-LERIDA,J.A.BRANNIGAN, . 631 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 30426.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 470 74.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 68 10.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 12 1.9 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 . 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 . 52 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 86 13.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 219 34.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 1.9 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 3 0 0 0 0 6 6 0 7 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 4 8 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 . 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 3 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 -1 A H 0 0 213 0, 0.0 3,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 59.3 -20.0 -8.6 -33.7 2 1 A M + 0 0 186 1,-0.1 0, 0.0 3,-0.0 0, 0.0 0.496 360.0 79.2 -79.6 5.9 -18.0 -5.3 -32.4 3 2 A T S S+ 0 0 129 2,-0.0 2,-0.6 0, 0.0 -1,-0.1 -0.637 73.4 150.7-104.8 60.0 -19.5 -6.2 -29.0 4 3 A D + 0 0 58 -3,-0.4 0, 0.0 1,-0.1 0, 0.0 -0.875 27.3 177.0-102.0 118.5 -16.7 -8.8 -29.1 5 4 A D + 0 0 117 -2,-0.6 201,-0.3 2,-0.1 2,-0.3 -0.309 33.3 134.3-116.3 44.9 -15.3 -9.8 -25.7 6 5 A K - 0 0 96 85,-0.2 2,-0.6 199,-0.1 199,-0.2 -0.748 59.5-120.6-106.2 145.0 -12.8 -12.4 -26.7 7 6 A K B +A 204 0A 4 197,-2.8 197,-2.1 -2,-0.3 84,-0.2 -0.725 38.1 164.9 -75.7 121.3 -9.3 -13.0 -25.6 8 7 A K + 0 0 62 82,-2.3 83,-0.2 -2,-0.6 -1,-0.2 0.665 53.1 67.8-113.8 -31.3 -7.2 -12.8 -28.8 9 8 A G S S- 0 0 0 81,-1.6 2,-0.4 85,-0.3 86,-0.2 -0.322 82.7-115.2 -81.4 173.5 -3.7 -12.4 -27.5 10 9 A K - 0 0 8 83,-0.2 86,-2.4 -2,-0.1 2,-0.6 -0.914 16.7-143.7-116.0 140.8 -1.8 -15.1 -25.6 11 10 A F E -b 96 0B 0 -2,-0.4 120,-3.1 84,-0.2 121,-1.3 -0.899 20.8-178.6-108.1 114.2 -0.7 -14.8 -21.9 12 11 A I E -bc 97 132B 0 84,-3.3 86,-3.4 -2,-0.6 2,-0.4 -0.957 4.6-168.7-122.0 125.5 2.6 -16.3 -21.1 13 12 A V E -bc 98 133B 0 119,-2.3 121,-3.1 -2,-0.5 2,-0.4 -0.887 10.1-154.3-111.9 139.9 4.1 -16.4 -17.6 14 13 A F E -bc 99 134B 0 84,-2.0 86,-2.2 -2,-0.4 2,-0.3 -0.950 17.3-174.6-101.8 134.6 7.6 -17.3 -16.6 15 14 A E E + c 0 135B 0 119,-3.2 121,-2.8 -2,-0.4 2,-0.2 -0.832 18.8 122.8-120.4 164.0 8.0 -18.6 -13.0 16 15 A G E - c 0 136B 0 -2,-0.3 121,-0.1 119,-0.2 3,-0.1 -0.867 54.0 -67.4 161.6 166.1 11.2 -19.4 -11.2 17 16 A L S > S- 0 0 2 119,-0.6 3,-1.2 -2,-0.2 5,-0.2 0.009 75.5 -62.8 -65.1 179.2 13.6 -19.0 -8.2 18 17 A D T 3 S+ 0 0 21 1,-0.3 -1,-0.2 136,-0.1 125,-0.1 -0.473 120.5 2.4 -73.9 137.3 15.5 -15.8 -7.7 19 18 A R T 3 S+ 0 0 73 -2,-0.1 -1,-0.3 -3,-0.1 127,-0.1 0.796 85.4 137.9 65.3 30.0 17.9 -14.9 -10.4 20 19 A S S < S- 0 0 2 -3,-1.2 -1,-0.1 118,-0.0 -2,-0.1 0.545 79.7 -94.8 -86.5 -7.4 16.9 -17.9 -12.5 21 20 A G S > S+ 0 0 20 -4,-0.1 4,-2.4 -5,-0.1 5,-0.2 0.659 77.4 139.8 104.6 23.6 16.9 -15.9 -15.8 22 21 A K H > S+ 0 0 13 -5,-0.2 4,-2.2 1,-0.2 5,-0.2 0.936 75.1 46.5 -62.0 -48.7 13.2 -15.0 -16.1 23 22 A S H > S+ 0 0 54 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.878 112.8 50.9 -60.4 -41.1 13.9 -11.4 -17.3 24 23 A T H > S+ 0 0 65 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.944 113.5 43.5 -62.8 -52.5 16.5 -12.7 -19.8 25 24 A Q H X S+ 0 0 5 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.789 112.4 53.4 -64.1 -31.0 14.2 -15.3 -21.2 26 25 A S H X S+ 0 0 0 -4,-2.2 4,-2.5 -5,-0.2 -2,-0.2 0.927 107.4 50.8 -71.2 -40.8 11.3 -12.9 -21.3 27 26 A K H X S+ 0 0 120 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.898 112.3 47.1 -61.5 -40.9 13.2 -10.3 -23.3 28 27 A L H X S+ 0 0 40 -4,-1.9 4,-2.6 2,-0.2 5,-0.2 0.913 111.3 50.2 -67.3 -43.9 14.2 -13.0 -25.8 29 28 A L H X S+ 0 0 0 -4,-2.2 4,-1.6 1,-0.2 -2,-0.2 0.891 110.6 52.7 -62.5 -35.6 10.6 -14.2 -26.1 30 29 A V H X S+ 0 0 19 -4,-2.5 4,-1.8 2,-0.2 3,-0.2 0.969 111.4 42.7 -62.0 -52.4 9.6 -10.6 -26.6 31 30 A E H X S+ 0 0 102 -4,-2.4 4,-1.0 1,-0.2 -2,-0.2 0.906 111.6 55.1 -66.8 -41.0 12.1 -9.9 -29.5 32 31 A Y H < S+ 0 0 62 -4,-2.6 3,-0.4 1,-0.2 -1,-0.2 0.882 109.8 47.7 -51.0 -41.6 11.3 -13.3 -31.2 33 32 A L H ><>S+ 0 0 4 -4,-1.6 5,-2.7 1,-0.2 3,-1.0 0.817 107.9 53.5 -75.4 -32.2 7.6 -12.4 -31.2 34 33 A K H ><5S+ 0 0 130 -4,-1.8 3,-0.7 1,-0.2 -1,-0.2 0.649 105.2 58.2 -68.8 -20.5 8.3 -8.9 -32.6 35 34 A N T 3<5S+ 0 0 119 -4,-1.0 -1,-0.2 -3,-0.4 -2,-0.2 0.226 104.4 49.5 -98.5 12.8 10.2 -10.7 -35.4 36 35 A N T < 5S- 0 0 89 -3,-1.0 -1,-0.2 2,-0.2 -2,-0.2 -0.013 121.2-102.9-137.9 26.1 7.2 -12.7 -36.4 37 36 A N T < 5S+ 0 0 161 -3,-0.7 2,-0.5 1,-0.2 -3,-0.2 0.827 75.0 142.9 56.8 35.9 4.9 -9.8 -36.5 38 37 A V < - 0 0 35 -5,-2.7 2,-0.5 -6,-0.1 -1,-0.2 -0.929 49.7-131.2-107.3 134.4 3.2 -10.6 -33.2 39 38 A E + 0 0 143 -2,-0.5 56,-3.3 54,-0.3 2,-0.3 -0.731 38.2 172.9 -88.9 127.4 2.2 -7.7 -31.0 40 39 A V E -d 95 0B 19 -2,-0.5 2,-0.4 54,-0.3 56,-0.2 -0.951 26.9-152.9-139.1 147.4 3.5 -8.2 -27.4 41 40 A K E -d 96 0B 97 54,-2.3 56,-2.9 -2,-0.3 2,-0.5 -0.996 13.9-143.2-119.2 135.8 3.9 -6.6 -24.0 42 41 A H E +d 97 0B 52 -2,-0.4 2,-0.3 54,-0.2 56,-0.2 -0.823 30.6 164.3 -87.3 123.7 6.4 -7.3 -21.3 43 42 A L E -d 98 0B 16 54,-2.1 56,-2.4 -2,-0.5 2,-0.3 -0.896 11.5-171.3-129.7 163.0 5.1 -7.1 -17.8 44 43 A Y E -d 99 0B 101 -2,-0.3 56,-0.2 54,-0.3 3,-0.1 -0.933 19.2 -94.5-146.4 172.0 6.4 -8.3 -14.5 45 44 A F S S+ 0 0 8 54,-2.3 2,-0.2 -2,-0.3 30,-0.0 -0.989 96.3 33.5-147.1 132.6 5.5 -8.8 -10.9 46 45 A P S S- 0 0 17 0, 0.0 2,-1.0 0, 0.0 -1,-0.3 0.505 74.8-155.2 -80.8 150.4 5.8 -7.3 -8.5 47 46 A N > - 0 0 30 -2,-0.2 3,-0.9 31,-0.1 6,-0.3 -0.846 9.7-170.1 -88.4 101.6 5.5 -4.0 -10.2 48 47 A R T 3 + 0 0 66 -2,-1.0 -1,-0.1 1,-0.2 9,-0.1 0.349 67.8 77.7 -79.6 2.4 7.4 -1.9 -7.7 49 48 A E T 3 S+ 0 0 138 4,-0.1 -1,-0.2 5,-0.0 2,-0.1 0.632 79.6 77.7 -89.5 -15.7 6.4 1.5 -9.3 50 49 A T S <> S- 0 0 32 -3,-0.9 4,-1.9 1,-0.1 5,-0.1 -0.277 96.9 -98.7 -85.6 177.3 2.9 1.7 -7.9 51 50 A G H >> S+ 0 0 51 2,-0.2 4,-1.4 1,-0.2 3,-0.6 0.983 126.7 41.8 -57.9 -59.5 1.9 2.7 -4.4 52 51 A I H >> S+ 0 0 42 1,-0.2 4,-2.1 2,-0.2 3,-1.0 0.949 114.0 54.0 -48.0 -50.7 1.5 -0.9 -3.3 53 52 A G H 3> S+ 0 0 0 -6,-0.3 4,-2.8 1,-0.3 -1,-0.2 0.755 100.4 59.6 -66.3 -27.0 4.6 -1.8 -5.2 54 53 A Q H S+ 0 0 95 -4,-2.0 5,-2.2 1,-0.2 6,-1.0 0.922 110.3 49.8 -58.1 -44.2 10.7 -1.8 0.8 59 58 A Y H ><5S+ 0 0 11 -4,-2.4 3,-1.3 1,-0.2 -2,-0.2 0.924 109.5 49.9 -60.7 -45.8 9.8 -5.2 2.2 60 59 A L H 3<5S+ 0 0 13 -4,-2.6 93,-2.6 1,-0.3 -1,-0.2 0.825 111.2 48.9 -67.7 -32.3 12.0 -7.1 -0.3 61 60 A K T 3<5S- 0 0 98 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.404 112.1-121.4 -85.0 0.9 15.0 -4.9 0.5 62 61 A M T < 5S+ 0 0 101 -3,-1.3 -3,-0.2 -4,-0.3 -2,-0.1 0.775 76.0 130.2 64.5 23.4 14.4 -5.4 4.2 63 62 A E S - 0 0 61 -2,-0.3 4,-2.5 1,-0.1 5,-0.3 -0.184 40.3-109.1 -62.3 152.4 3.6 -9.6 8.8 68 67 A N H > S+ 0 0 62 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.883 117.8 44.6 -45.0 -51.6 3.3 -12.6 6.6 69 68 A E H > S+ 0 0 82 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.864 109.7 55.6 -70.6 -34.6 -0.3 -12.1 5.7 70 69 A T H > S+ 0 0 66 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.964 111.6 42.7 -62.5 -49.6 0.1 -8.3 5.1 71 70 A I H >X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 3,-0.6 0.968 112.6 53.3 -61.9 -51.9 2.9 -8.9 2.5 72 71 A H H 3X S+ 0 0 0 -4,-2.3 4,-2.0 1,-0.3 -1,-0.2 0.904 110.2 47.8 -47.9 -48.1 1.1 -11.8 0.8 73 72 A L H 3X S+ 0 0 77 -4,-2.4 4,-2.1 1,-0.2 -1,-0.3 0.825 107.8 54.7 -72.0 -27.1 -2.0 -9.7 0.4 74 73 A L H X S+ 0 0 2 -4,-2.0 4,-2.3 -5,-0.2 3,-1.3 0.939 112.6 51.0 -64.7 -43.5 -1.9 -10.2 -4.8 77 76 A A H 3X S+ 0 0 34 -4,-2.1 4,-1.8 1,-0.3 -1,-0.2 0.835 100.9 63.1 -62.6 -33.4 -3.3 -6.7 -4.8 78 77 A N H 3< S+ 0 0 0 -4,-2.2 -1,-0.3 1,-0.2 -2,-0.2 0.715 108.7 42.9 -67.3 -20.6 -0.3 -5.6 -6.9 79 78 A R H X< S+ 0 0 4 -3,-1.3 3,-2.7 -4,-0.6 4,-0.4 0.872 106.4 57.5 -88.9 -45.0 -1.6 -7.9 -9.6 80 79 A W H >< S+ 0 0 109 -4,-2.3 3,-1.6 1,-0.3 4,-0.4 0.877 98.5 63.4 -54.6 -33.3 -5.3 -7.1 -9.3 81 80 A E T 3< S+ 0 0 85 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.1 0.614 107.2 45.0 -67.9 -8.5 -4.3 -3.4 -10.0 82 81 A H T <> S+ 0 0 13 -3,-2.7 4,-2.0 2,-0.1 -1,-0.3 0.291 81.7 95.1-113.8 2.9 -3.1 -4.6 -13.5 83 82 A M H <> S+ 0 0 18 -3,-1.6 4,-2.4 -4,-0.4 5,-0.2 0.832 86.7 52.8 -66.0 -29.4 -6.0 -6.9 -14.5 84 83 A N H > S+ 0 0 130 -4,-0.4 4,-1.7 2,-0.2 -1,-0.2 0.892 109.1 47.1 -68.5 -39.9 -7.5 -4.0 -16.4 85 84 A E H > S+ 0 0 79 1,-0.2 4,-1.6 2,-0.2 -2,-0.2 0.889 116.6 45.4 -68.8 -35.9 -4.3 -3.3 -18.3 86 85 A I H X S+ 0 0 0 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.833 109.6 51.8 -83.7 -35.3 -4.0 -7.0 -19.1 87 86 A K H X S+ 0 0 102 -4,-2.4 4,-2.5 -5,-0.2 -1,-0.2 0.901 111.2 51.4 -63.8 -36.5 -7.5 -7.6 -20.1 88 87 A S H X S+ 0 0 63 -4,-1.7 4,-1.3 2,-0.2 -2,-0.2 0.868 109.6 47.2 -67.8 -41.2 -7.2 -4.6 -22.5 89 88 A L H X>S+ 0 0 25 -4,-1.6 5,-2.2 2,-0.2 4,-0.7 0.920 115.4 44.9 -69.0 -42.3 -4.1 -5.9 -24.1 90 89 A L H ><5S+ 0 0 0 -4,-1.8 -82,-2.3 1,-0.2 -81,-1.6 0.864 108.2 56.6 -73.2 -37.9 -5.4 -9.4 -24.7 91 90 A L H 3<5S+ 0 0 44 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.893 109.7 49.5 -52.2 -38.7 -8.8 -8.1 -25.9 92 91 A K H 3<5S- 0 0 164 -4,-1.3 -1,-0.2 -5,-0.2 -2,-0.2 0.680 122.4-104.5 -79.7 -19.7 -6.9 -6.2 -28.5 93 92 A G T <<5S+ 0 0 24 -4,-0.7 2,-0.4 -3,-0.6 -54,-0.3 0.318 74.5 138.3 104.9 -3.8 -4.7 -9.2 -29.7 94 93 A I < - 0 0 16 -5,-2.2 -1,-0.4 -6,-0.2 -85,-0.3 -0.627 49.5-134.2 -74.2 127.4 -1.6 -8.1 -27.9 95 94 A W E - d 0 40B 17 -56,-3.3 -54,-2.3 -2,-0.4 2,-0.4 -0.511 13.7-143.6 -73.8 151.1 0.2 -11.0 -26.3 96 95 A V E -bd 11 41B 0 -86,-2.4 -84,-3.3 -56,-0.2 2,-0.7 -0.986 11.5-168.3-121.5 125.8 1.5 -10.6 -22.8 97 96 A V E -bd 12 42B 0 -56,-2.9 -54,-2.1 -2,-0.4 2,-0.4 -0.961 19.7-168.0-112.4 107.8 4.7 -12.1 -21.6 98 97 A C E -bd 13 43B 0 -86,-3.4 -84,-2.0 -2,-0.7 2,-0.8 -0.842 20.1-144.3-106.2 134.5 4.7 -11.7 -17.9 99 98 A D E S-bd 14 44B 15 -56,-2.4 -54,-2.3 -2,-0.4 -84,-0.1 -0.838 77.0 -8.8-100.9 105.7 7.6 -12.3 -15.6 100 99 A R + 0 0 30 -86,-2.2 2,-0.2 -2,-0.8 -85,-0.1 0.396 69.9 173.3 78.5 144.6 6.2 -13.8 -12.3 101 100 A Y >> - 0 0 0 -88,-0.1 4,-0.9 -3,-0.1 3,-0.6 -0.585 55.7 -41.8-148.4-144.9 2.5 -14.2 -11.4 102 101 A A H 3> S+ 0 0 0 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.774 125.4 66.3 -67.0 -27.8 0.2 -15.8 -8.8 103 102 A Y H 3> S+ 0 0 0 1,-0.3 4,-2.8 2,-0.2 5,-0.3 0.897 97.1 54.8 -62.3 -40.4 2.4 -18.9 -8.7 104 103 A S H <> S+ 0 0 10 -3,-0.6 4,-3.2 1,-0.2 5,-0.4 0.910 107.5 52.6 -56.2 -41.5 5.2 -16.9 -7.3 105 104 A G H X S+ 0 0 6 -4,-0.9 4,-2.2 2,-0.2 5,-0.3 0.917 112.9 40.2 -61.3 -47.6 2.8 -15.8 -4.5 106 105 A V H X S+ 0 0 0 -4,-2.0 4,-2.2 1,-0.2 5,-0.3 0.922 119.5 46.1 -71.6 -41.1 1.7 -19.3 -3.5 107 106 A A H X S+ 0 0 0 -4,-2.8 4,-1.4 -5,-0.2 5,-0.4 0.936 117.4 40.4 -72.5 -44.7 5.1 -20.7 -3.7 108 107 A Y H X>S+ 0 0 16 -4,-3.2 4,-1.5 -5,-0.3 5,-0.6 0.899 118.2 47.2 -74.8 -38.6 7.1 -17.9 -1.9 109 108 A S H X5S+ 0 0 5 -4,-2.2 4,-1.5 -5,-0.4 6,-1.0 0.947 117.0 40.0 -64.1 -47.8 4.5 -17.4 0.8 110 109 A S H <5S+ 0 0 14 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.745 125.4 38.1 -80.5 -21.3 3.9 -21.1 1.7 111 110 A G H <5S+ 0 0 3 -4,-1.4 3,-0.5 -5,-0.3 -3,-0.2 0.930 126.2 30.4 -90.0 -64.6 7.5 -21.9 1.4 112 111 A A H <5S+ 0 0 19 -4,-1.5 -3,-0.2 -5,-0.4 -2,-0.2 0.795 137.9 26.9 -62.8 -30.8 9.4 -19.0 2.8 113 112 A L S < - 0 0 104 -2,-0.2 4,-2.4 1,-0.1 5,-0.2 -0.609 29.8-132.5 -79.8 126.5 -1.3 -22.4 4.0 117 116 A K H > S+ 0 0 73 -2,-0.4 4,-1.1 1,-0.2 -1,-0.1 0.888 106.2 43.4 -38.1 -54.4 -1.4 -23.3 0.3 118 117 A T H > S+ 0 0 75 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.865 110.8 52.5 -69.6 -38.4 -5.2 -22.6 0.0 119 118 A W H 4 S+ 0 0 95 1,-0.2 -1,-0.2 2,-0.2 -2,-0.2 0.882 111.1 50.2 -63.7 -36.2 -5.2 -19.5 2.1 120 119 A C H < S+ 0 0 0 -4,-2.4 4,-0.3 1,-0.2 -1,-0.2 0.735 111.1 47.9 -70.1 -30.5 -2.5 -18.1 -0.2 121 120 A M H >X S+ 0 0 35 -4,-1.1 3,-1.6 -5,-0.2 4,-0.9 0.859 93.4 78.1 -79.5 -39.2 -4.4 -19.0 -3.4 122 121 A N G >< S+ 0 0 87 -4,-2.3 3,-1.4 1,-0.3 -2,-0.1 0.842 91.6 48.2 -43.4 -53.0 -7.7 -17.5 -2.3 123 122 A P G 34 S+ 0 0 36 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.744 111.1 50.2 -68.6 -20.6 -7.0 -13.8 -3.0 124 123 A D G X4 S+ 0 0 0 -3,-1.6 3,-2.0 -4,-0.3 85,-0.2 0.498 82.8 120.2 -89.4 -8.6 -5.5 -14.4 -6.5 125 124 A Q T << S+ 0 0 122 -3,-1.4 85,-0.3 -4,-0.9 3,-0.1 -0.400 72.0 30.7 -60.4 133.9 -8.6 -16.5 -7.4 126 125 A G T 3 S+ 0 0 26 83,-4.1 -1,-0.3 1,-0.4 84,-0.1 0.375 85.8 133.8 90.6 -1.4 -10.3 -14.8 -10.4 127 126 A L S < S- 0 0 0 -3,-2.0 82,-2.7 82,-0.2 -1,-0.4 -0.423 72.8 -84.6 -66.7 158.5 -7.1 -13.4 -11.9 128 127 A I B -F 208 0C 7 80,-0.2 80,-0.3 -3,-0.1 -1,-0.1 -0.502 46.1-129.2 -69.1 133.6 -6.7 -13.9 -15.6 129 128 A K - 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0 0 24 -2,-0.3 4,-2.6 1,-0.1 5,-0.3 -0.456 39.7-110.2 -76.4 152.6 46.8 -25.3 -38.4 279 67 B N H > S+ 0 0 58 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.883 117.8 44.7 -45.8 -51.2 43.8 -24.5 -36.2 280 68 B E H > S+ 0 0 46 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.831 111.2 54.4 -71.1 -28.4 43.2 -28.2 -35.3 281 69 B T H > S+ 0 0 0 -3,-0.3 4,-1.9 221,-0.2 -2,-0.2 0.967 112.7 41.1 -68.6 -49.9 46.8 -28.9 -34.7 282 70 B I H X S+ 0 0 0 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.851 111.5 57.1 -70.2 -29.2 47.3 -26.1 -32.2 283 71 B H H X S+ 0 0 0 -4,-1.8 4,-1.1 -5,-0.3 -1,-0.2 0.913 107.8 46.7 -67.7 -40.6 44.0 -26.8 -30.5 284 72 B L H X S+ 0 0 0 -4,-1.7 4,-2.1 1,-0.2 -1,-0.2 0.851 107.8 56.4 -74.6 -33.7 44.9 -30.4 -29.8 285 73 B L H X S+ 0 0 0 -4,-1.9 4,-2.8 2,-0.2 -1,-0.2 0.941 104.2 53.6 -56.3 -48.4 48.3 -29.4 -28.4 286 74 B F H X S+ 0 0 25 -4,-2.0 4,-0.5 1,-0.2 -1,-0.2 0.826 113.0 44.7 -55.5 -33.9 46.6 -27.1 -25.9 287 75 B S H X S+ 0 0 0 -4,-1.1 4,-1.6 2,-0.2 3,-0.4 0.822 110.2 51.8 -79.9 -36.6 44.5 -30.0 -24.7 288 76 B A H X S+ 0 0 0 -4,-2.1 4,-3.0 1,-0.2 5,-0.2 0.913 103.3 61.4 -70.3 -39.4 47.3 -32.5 -24.6 289 77 B N H < S+ 0 0 0 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.761 105.0 47.7 -51.5 -33.3 49.2 -30.0 -22.4 290 78 B R H >< S+ 0 0 5 -4,-0.5 3,-1.0 -3,-0.4 -1,-0.2 0.857 111.0 50.1 -78.1 -38.4 46.5 -30.2 -19.9 291 79 B W H >< S+ 0 0 10 -4,-1.6 3,-2.3 1,-0.2 4,-0.4 0.910 99.5 63.3 -70.2 -39.3 46.4 -34.1 -19.9 292 80 B E T 3< S+ 0 0 50 -4,-3.0 -1,-0.2 1,-0.3 4,-0.2 0.611 109.1 47.0 -57.7 -4.5 50.2 -34.3 -19.5 293 81 B H T <> S+ 0 0 10 -3,-1.0 4,-2.5 -5,-0.2 -1,-0.3 0.420 81.2 96.5-114.3 0.7 49.4 -32.6 -16.1 294 82 B M H <> S+ 0 0 19 -3,-2.3 4,-3.1 2,-0.2 5,-0.1 0.820 86.4 46.2 -67.9 -31.6 46.5 -34.7 -14.9 295 83 B N H > S+ 0 0 102 -4,-0.4 4,-4.1 2,-0.2 5,-0.3 0.961 112.1 50.5 -73.4 -52.1 48.5 -37.0 -12.7 296 84 B E H > S+ 0 0 81 -4,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.956 118.3 39.3 -44.1 -65.1 50.5 -34.2 -11.1 297 85 B I H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 5,-0.3 0.929 115.8 50.4 -54.2 -53.6 47.2 -32.4 -10.4 298 86 B K H X S+ 0 0 82 -4,-3.1 4,-2.4 -5,-0.2 -2,-0.2 0.946 112.0 49.7 -51.6 -50.4 45.3 -35.6 -9.4 299 87 B S H X S+ 0 0 63 -4,-4.1 4,-1.8 1,-0.2 -1,-0.2 0.872 110.0 49.9 -52.1 -45.5 48.2 -36.5 -7.0 300 88 B L H X>S+ 0 0 20 -4,-2.3 5,-1.7 -5,-0.3 4,-0.7 0.957 112.8 45.8 -65.4 -45.7 48.2 -33.1 -5.4 301 89 B L H ><5S+ 0 0 0 -4,-2.6 -82,-3.0 1,-0.3 -81,-1.6 0.812 108.2 56.3 -74.0 -29.0 44.5 -33.0 -4.8 302 90 B L H 3<5S+ 0 0 47 -4,-2.4 -1,-0.3 -5,-0.3 -2,-0.2 0.919 106.0 52.9 -57.6 -43.6 44.6 -36.6 -3.5 303 91 B K H 3<5S- 0 0 161 -4,-1.8 -2,-0.2 -3,-0.3 -1,-0.2 0.582 122.9-104.8 -73.5 -13.1 47.1 -35.4 -0.9 304 92 B G T <<5S+ 0 0 29 -4,-0.7 2,-0.4 -3,-0.5 -54,-0.3 0.357 77.0 137.2 103.5 -1.6 45.0 -32.5 0.3 305 93 B I < - 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0 0 30 -5,-2.8 2,-0.4 -6,-0.1 -1,-0.2 -0.802 50.6-131.4 -93.5 133.3 49.5 -41.9 -61.9 461 38 C E + 0 0 144 -2,-0.4 56,-3.3 54,-0.3 2,-0.4 -0.744 39.9 175.8 -75.5 129.4 51.4 -39.1 -60.0 462 39 C V E -p 517 0H 20 -2,-0.4 2,-0.4 54,-0.2 56,-0.2 -0.995 27.8-151.8-146.7 139.6 51.5 -40.3 -56.3 463 40 C K E -p 518 0H 103 54,-3.1 56,-2.7 -2,-0.4 2,-0.6 -0.907 17.1-139.6-109.7 135.7 53.0 -39.3 -53.0 464 41 C H E +p 519 0H 60 -2,-0.4 2,-0.3 54,-0.2 56,-0.2 -0.857 29.7 170.9 -92.6 115.7 53.9 -41.8 -50.2 465 42 C L E -p 520 0H 13 54,-3.0 56,-2.9 -2,-0.6 2,-0.3 -0.806 10.5-169.0-121.0 167.2 53.0 -40.7 -46.7 466 43 C Y E -p 521 0H 98 -2,-0.3 56,-0.2 54,-0.3 57,-0.1 -0.988 19.1-103.7-152.0 151.3 53.0 -42.5 -43.3 467 44 C F S S+ 0 0 8 54,-2.4 2,-0.1 -2,-0.3 56,-0.0 -0.995 96.8 35.8-133.0 140.8 51.7 -42.0 -39.8 468 45 C P S S- 0 0 15 0, 0.0 2,-1.3 0, 0.0 -1,-0.2 0.549 77.5-154.1 -72.5 146.6 53.0 -41.2 -37.4 469 46 C N > - 0 0 19 1,-0.1 3,-1.4 -2,-0.1 6,-0.4 -0.739 11.4-171.1 -83.8 89.6 55.3 -38.9 -39.2 470 47 C R T 3 + 0 0 79 -2,-1.3 -1,-0.1 1,-0.3 9,-0.1 0.564 67.9 79.9 -59.2 -12.3 58.2 -39.0 -36.6 471 48 C E T 3 S+ 0 0 145 4,-0.2 -1,-0.3 5,-0.1 2,-0.2 0.564 78.9 80.3 -80.0 -12.0 60.1 -36.2 -38.2 472 49 C T S <> S- 0 0 26 -3,-1.4 4,-3.8 1,-0.1 5,-0.3 -0.520 95.3 -98.3 -96.8 166.0 58.1 -33.2 -36.8 473 50 C G H > S+ 0 0 38 1,-0.2 4,-0.5 2,-0.2 -207,-0.1 0.821 130.1 35.9 -45.0 -41.3 58.1 -31.4 -33.5 474 51 C I H >> S+ 0 0 2 2,-0.2 4,-2.1 1,-0.1 3,-0.8 0.901 114.1 54.6 -80.4 -47.4 55.1 -33.6 -32.6 475 52 C G H 3> S+ 0 0 0 -6,-0.4 4,-3.3 1,-0.3 -2,-0.2 0.879 102.2 60.2 -54.5 -40.4 56.3 -36.8 -34.4 476 53 C Q H 3X S+ 0 0 106 -4,-3.8 4,-2.3 2,-0.2 -1,-0.3 0.871 105.9 47.4 -52.0 -41.3 59.5 -36.6 -32.4 477 54 C I H S+ 0 0 112 -4,-2.3 5,-2.5 1,-0.3 6,-1.1 0.913 111.1 52.3 -50.3 -48.8 60.2 -41.1 -28.2 481 58 C Y H ><5S+ 0 0 8 -4,-2.8 3,-0.7 1,-0.2 -1,-0.3 0.906 109.8 47.9 -51.3 -44.7 57.0 -42.4 -26.7 482 59 C L H 3<5S+ 0 0 15 -4,-2.3 93,-3.2 -3,-0.5 -1,-0.2 0.744 111.2 50.1 -76.7 -27.4 57.0 -45.6 -29.0 483 60 C K H 3<5S- 0 0 88 -4,-2.0 -1,-0.3 -3,-0.3 -2,-0.2 0.560 114.3-115.0 -83.6 -9.9 60.6 -46.4 -28.2 484 61 C M T <<5S+ 0 0 114 -4,-0.9 -3,-0.2 -3,-0.7 -2,-0.1 0.854 81.3 126.5 70.5 37.1 60.1 -46.1 -24.4 485 62 C E S - 0 0 27 -2,-0.3 4,-1.6 1,-0.1 5,-0.2 -0.214 43.1-110.7 -64.0 162.3 49.6 -40.4 -20.2 490 67 C N H > S+ 0 0 64 2,-0.2 4,-2.3 1,-0.2 3,-0.3 0.967 118.3 46.5 -60.1 -51.3 47.3 -42.3 -22.6 491 68 C E H > S+ 0 0 47 1,-0.2 4,-2.1 2,-0.2 5,-0.3 0.903 107.4 56.9 -62.8 -42.4 45.3 -39.1 -23.5 492 69 C T H > S+ 0 0 0 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.930 112.9 41.6 -47.8 -46.8 48.4 -37.0 -24.0 493 70 C I H X S+ 0 0 1 -4,-1.6 4,-2.2 -3,-0.3 -2,-0.2 0.913 109.4 55.9 -77.8 -40.9 49.7 -39.4 -26.6 494 71 C H H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.907 107.9 48.1 -58.9 -46.3 46.5 -40.1 -28.4 495 72 C L H X S+ 0 0 0 -4,-2.1 4,-3.2 1,-0.2 -1,-0.2 0.873 108.4 56.5 -64.5 -32.7 45.9 -36.4 -29.1 496 73 C L H X S+ 0 0 0 -4,-1.4 4,-2.5 -5,-0.3 -2,-0.2 0.913 104.7 51.3 -62.8 -38.8 49.5 -36.1 -30.4 497 74 C F H X S+ 0 0 30 -4,-2.2 4,-0.9 1,-0.2 -2,-0.2 0.944 114.9 43.9 -63.0 -45.0 48.8 -38.9 -32.9 498 75 C S H >X S+ 0 0 0 -4,-2.1 4,-2.0 2,-0.2 3,-0.9 0.922 110.6 53.0 -60.2 -46.9 45.7 -36.9 -34.0 499 76 C A H 3X S+ 0 0 0 -4,-3.2 4,-2.3 1,-0.3 5,-0.2 0.942 103.4 60.2 -56.3 -43.9 47.6 -33.5 -34.0 500 77 C N H 3< S+ 0 0 0 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.743 105.9 45.9 -58.1 -32.7 50.2 -35.1 -36.2 501 78 C R H XX S+ 0 0 3 -3,-0.9 3,-1.2 -4,-0.9 4,-1.0 0.870 110.0 53.6 -77.5 -39.4 47.6 -35.8 -38.9 502 79 C W H 3< S+ 0 0 14 -4,-2.0 4,-0.5 1,-0.3 3,-0.3 0.839 101.2 59.4 -63.4 -34.4 46.0 -32.4 -38.7 503 80 C E T 3< S+ 0 0 55 -4,-2.3 -1,-0.3 -5,-0.2 4,-0.2 0.664 109.4 46.6 -69.6 -9.0 49.4 -30.8 -39.2 504 81 C H T X> S+ 0 0 17 -3,-1.2 4,-2.0 -5,-0.2 3,-0.9 0.661 85.3 89.0-103.0 -20.0 49.5 -32.7 -42.6 505 82 C M H 3X S+ 0 0 16 -4,-1.0 4,-2.1 -3,-0.3 5,-0.2 0.786 84.2 56.5 -51.3 -36.9 46.0 -31.9 -43.9 506 83 C N H 3> S+ 0 0 111 -4,-0.5 4,-1.9 2,-0.2 -1,-0.3 0.904 111.3 44.8 -62.5 -40.8 47.1 -28.7 -45.7 507 84 C E H <> S+ 0 0 77 -3,-0.9 4,-2.3 2,-0.2 -2,-0.2 0.966 115.4 44.5 -65.6 -56.3 49.7 -30.8 -47.6 508 85 C I H X S+ 0 0 0 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.749 112.1 53.8 -63.0 -26.8 47.3 -33.7 -48.5 509 86 C K H X S+ 0 0 100 -4,-2.1 4,-2.9 -5,-0.3 -1,-0.2 0.941 109.7 47.4 -73.9 -47.2 44.6 -31.4 -49.5 510 87 C S H X S+ 0 0 65 -4,-1.9 4,-1.7 -5,-0.2 -2,-0.2 0.871 114.3 47.9 -51.9 -44.6 46.9 -29.5 -51.9 511 88 C L H X>S+ 0 0 20 -4,-2.3 5,-2.3 2,-0.2 4,-0.6 0.975 115.3 42.4 -65.5 -54.1 48.1 -32.8 -53.3 512 89 C L H ><5S+ 0 0 0 -4,-2.2 -82,-2.0 1,-0.2 -81,-1.3 0.834 110.9 58.0 -63.4 -34.0 44.6 -34.3 -53.8 513 90 C L H 3<5S+ 0 0 46 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.919 108.8 45.3 -56.1 -45.5 43.4 -30.9 -55.1 514 91 C K H 3<5S- 0 0 166 -4,-1.7 -1,-0.2 -3,-0.2 -2,-0.2 0.529 122.5-102.6 -77.1 -12.4 46.0 -31.0 -57.9 515 92 C G T <<5S+ 0 0 25 -3,-0.7 2,-0.4 -4,-0.6 -54,-0.3 0.513 73.5 140.7 96.8 4.3 45.4 -34.7 -58.8 516 93 C I < - 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0 0 103 -2,-0.2 4,-1.9 1,-0.1 5,-0.1 -0.464 33.7-131.5 -62.0 132.5 36.5 -44.9 -24.9 539 116 C K H >> S+ 0 0 82 2,-0.2 4,-1.8 1,-0.2 3,-0.5 0.939 103.7 46.3 -53.6 -58.7 35.9 -45.4 -28.7 540 117 C T H >> S+ 0 0 85 1,-0.3 4,-2.3 2,-0.2 3,-1.0 0.954 111.2 52.8 -49.8 -58.1 34.0 -42.3 -29.3 541 118 C W H 34 S+ 0 0 16 1,-0.3 -1,-0.3 2,-0.2 -2,-0.2 0.820 109.0 51.9 -48.7 -35.6 36.4 -40.2 -27.3 542 119 C C H << S+ 0 0 0 -4,-1.9 4,-0.3 -3,-0.5 -1,-0.3 0.878 112.0 44.5 -69.2 -38.7 39.2 -41.7 -29.5 543 120 C M H XX S+ 0 0 38 -4,-1.8 3,-2.2 -3,-1.0 4,-1.1 0.881 94.9 78.8 -71.7 -43.9 37.5 -40.8 -32.8 544 121 C N G >< S+ 0 0 25 -4,-2.3 3,-0.7 1,-0.3 -1,-0.2 0.762 90.6 49.6 -40.3 -48.6 36.4 -37.2 -31.9 545 122 C P G 34 S+ 0 0 1 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.791 112.2 49.6 -71.8 -20.7 39.7 -35.5 -32.4 546 123 C D G X4 S+ 0 0 0 -3,-2.2 3,-2.1 -4,-0.3 2,-0.2 0.591 82.7 117.7 -87.7 -12.3 40.1 -37.1 -35.8 547 124 C Q T << S+ 0 0 79 -4,-1.1 85,-0.2 -3,-0.7 3,-0.1 -0.381 74.4 30.3 -56.0 116.2 36.6 -36.1 -36.8 548 125 C G T 3 S+ 0 0 25 83,-1.9 -1,-0.2 1,-0.4 84,-0.1 0.334 84.0 129.2 117.4 -6.0 36.9 -33.8 -39.7 549 126 C L S < S- 0 0 0 -3,-2.1 82,-2.9 1,-0.1 -1,-0.4 -0.364 73.0 -82.2 -68.3 156.6 40.1 -35.1 -41.4 550 127 C I B -R 630 0I 7 80,-0.2 80,-0.3 -3,-0.1 -1,-0.1 -0.423 46.5-126.7 -62.0 133.8 40.0 -36.0 -45.1 551 128 C K - 0 0 34 78,-3.0 78,-0.3 -2,-0.1 -118,-0.1 -0.690 18.1-131.7 -80.1 130.4 38.4 -39.4 -45.8 552 129 C P - 0 0 4 0, 0.0 -118,-0.2 0, 0.0 3,-0.2 -0.157 11.5-129.2 -70.2 177.3 40.4 -41.8 -47.9 553 130 C D S S+ 0 0 38 -120,-3.6 2,-0.4 1,-0.5 -119,-0.2 0.871 87.9 8.7 -96.7 -47.7 38.7 -43.7 -50.9 554 131 C V E -o 434 0H 12 -121,-1.0 -119,-1.6 2,-0.0 2,-0.5 -0.996 64.2-152.5-134.8 139.4 39.7 -47.1 -50.0 555 132 C V E -oq 435 598H 0 42,-3.3 44,-2.3 -2,-0.4 2,-0.9 -0.952 9.8-152.4-105.3 124.1 41.4 -48.6 -46.9 556 133 C F E -oq 436 599H 0 -121,-3.3 -119,-2.0 -2,-0.5 2,-0.7 -0.843 8.4-164.4 -97.7 105.0 43.5 -51.7 -47.2 557 134 C Y E -oq 437 600H 8 42,-1.4 44,-3.3 -2,-0.9 2,-1.8 -0.783 10.7-150.1 -85.0 113.6 43.5 -53.7 -44.0 558 135 C L E - q 0 601H 1 -121,-2.9 -119,-0.4 -2,-0.7 2,-0.2 -0.561 22.4-156.2 -85.8 75.5 46.4 -56.2 -44.1 559 136 C N E + q 0 602H 29 -2,-1.8 44,-1.9 42,-1.1 45,-0.3 -0.346 26.1 155.9 -59.4 120.3 44.7 -58.8 -41.8 560 137 C V - 0 0 1 -2,-0.2 -121,-0.1 42,-0.1 -118,-0.1 -0.956 51.0 -92.0-132.2 154.4 47.0 -61.3 -40.0 561 138 C P >> - 0 0 48 0, 0.0 3,-1.4 0, 0.0 4,-0.5 -0.348 42.9-109.3 -63.2 154.3 46.2 -63.1 -36.8 562 139 C P T 34 S+ 0 0 20 0, 0.0 3,-0.2 0, 0.0 20,-0.1 0.790 117.3 39.8 -58.1 -32.8 47.4 -61.2 -33.7 563 140 C N T >4 S+ 0 0 91 1,-0.2 3,-0.9 2,-0.1 16,-0.1 0.486 95.4 89.4 -92.2 -7.7 50.3 -63.7 -32.9 564 141 C Y T <4 S+ 0 0 82 -3,-1.4 3,-0.5 1,-0.2 -1,-0.2 0.863 82.4 49.1 -56.9 -46.0 51.3 -64.1 -36.6 565 142 C A T >< S+ 0 0 4 -4,-0.5 3,-2.0 -3,-0.2 -1,-0.2 0.455 75.8 105.5 -84.5 -2.2 53.8 -61.3 -37.0 566 143 C Q T < S+ 0 0 101 -3,-0.9 -1,-0.2 1,-0.3 -2,-0.1 0.489 74.0 57.7 -65.8 -5.2 56.0 -61.9 -33.9 567 144 C N T 3 S+ 0 0 121 -3,-0.5 -1,-0.3 3,-0.0 -2,-0.1 0.534 77.7 117.9 -98.5 -9.8 59.0 -63.3 -35.8 568 145 C R S X S- 0 0 82 -3,-2.0 3,-1.5 1,-0.1 -126,-0.0 -0.247 82.2 -86.4 -72.2 152.9 59.6 -60.3 -38.1 569 146 C S T 3 S+ 0 0 114 1,-0.3 -1,-0.1 -128,-0.1 -3,-0.0 0.585 113.5 12.4 -37.2 -51.3 62.9 -58.4 -37.8 570 147 C D T > S+ 0 0 67 2,-0.0 3,-2.4 -129,-0.0 -1,-0.3 0.458 81.3 147.6-111.9 0.6 62.5 -55.8 -35.0 571 148 C Y T < + 0 0 42 -3,-1.5 7,-0.0 1,-0.3 -5,-0.0 -0.001 67.4 31.4 -43.8 134.7 59.3 -56.9 -33.3 572 149 C G T 3 S+ 0 0 43 2,-0.2 -1,-0.3 6,-0.0 -2,-0.0 0.106 89.2 99.2 98.8 -16.9 59.4 -56.1 -29.6 573 150 C E S < S+ 0 0 122 -3,-2.4 2,-0.3 0, 0.0 -2,-0.1 0.715 79.8 58.2 -68.6 -22.5 61.6 -53.1 -29.9 574 151 C E S > S- 0 0 32 -4,-0.2 3,-1.7 3,-0.1 -2,-0.2 -0.833 95.1 -98.0-125.6 158.8 58.5 -50.7 -29.7 575 152 C I T 3 S+ 0 0 57 -93,-3.2 -92,-0.1 -2,-0.3 -93,-0.1 0.666 112.3 34.3 -50.8 -43.0 55.8 -50.1 -27.2 576 153 C Y T 3 S+ 0 0 16 1,-0.2 2,-3.2 -94,-0.1 -1,-0.3 0.570 82.1 110.7 -92.4 -8.0 52.7 -52.2 -28.4 577 154 C E < + 0 0 10 -3,-1.7 2,-0.4 4,-0.1 -1,-0.2 -0.253 47.0 117.2 -67.2 53.4 54.7 -55.1 -29.9 578 155 C K > - 0 0 119 -2,-3.2 4,-3.0 1,-0.1 3,-0.5 -0.994 69.9-130.0-119.8 131.6 53.5 -57.5 -27.2 579 156 C V H > S+ 0 0 52 -2,-0.4 4,-1.6 1,-0.2 -1,-0.1 0.884 109.3 48.8 -44.4 -52.5 51.3 -60.6 -28.2 580 157 C E H > S+ 0 0 102 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.874 113.3 48.6 -59.9 -37.6 48.7 -59.8 -25.5 581 158 C T H > S+ 0 0 30 -3,-0.5 4,-1.4 1,-0.2 3,-0.3 0.903 106.7 55.0 -69.2 -46.7 48.5 -56.2 -26.7 582 159 C Q H X S+ 0 0 2 -4,-3.0 4,-2.8 -6,-0.2 -1,-0.2 0.868 103.6 57.2 -51.0 -40.0 48.2 -57.1 -30.3 583 160 C K H X S+ 0 0 117 -4,-1.6 4,-1.6 1,-0.2 -1,-0.2 0.889 105.9 48.3 -61.5 -42.7 45.1 -59.3 -29.5 584 161 C K H X S+ 0 0 106 -4,-1.1 4,-1.1 -3,-0.3 -1,-0.2 0.810 112.6 49.6 -71.4 -28.2 43.2 -56.4 -28.0 585 162 C I H >X S+ 0 0 0 -4,-1.4 4,-2.2 2,-0.2 3,-0.6 0.949 105.9 55.2 -75.6 -50.0 44.1 -54.3 -31.0 586 163 C Y H 3X S+ 0 0 46 -4,-2.8 4,-0.7 1,-0.2 -2,-0.2 0.821 107.8 51.0 -44.8 -41.9 42.9 -56.9 -33.5 587 164 C E H 3< S+ 0 0 110 -4,-1.6 -1,-0.2 1,-0.2 4,-0.2 0.839 111.1 47.0 -70.0 -34.3 39.5 -57.0 -31.7 588 165 C T H X< S+ 0 0 20 -4,-1.1 3,-1.0 -3,-0.6 -2,-0.2 0.750 101.0 63.9 -83.7 -24.6 39.1 -53.2 -31.9 589 166 C Y H >< S+ 0 0 1 -4,-2.2 3,-1.8 1,-0.2 4,-0.4 0.791 90.0 71.1 -62.2 -27.0 40.1 -53.0 -35.6 590 167 C K G >< S+ 0 0 94 -4,-0.7 3,-1.4 1,-0.3 4,-0.4 0.757 75.3 80.6 -61.9 -25.0 37.0 -55.1 -36.3 591 168 C H G < S+ 0 0 83 -3,-1.0 -1,-0.3 1,-0.3 -2,-0.1 0.536 102.9 36.0 -58.2 -5.4 35.0 -52.0 -35.4 592 169 C F G X S+ 0 0 5 -3,-1.8 3,-1.1 3,-0.0 -1,-0.3 0.473 88.6 112.5-120.4 -6.4 35.8 -51.0 -39.0 593 170 C A T < S+ 0 0 17 -3,-1.4 7,-0.2 -4,-0.4 -2,-0.1 0.620 78.0 31.8 -53.2 -36.3 35.5 -54.5 -40.6 594 171 C H T 3 S+ 0 0 185 -4,-0.4 -1,-0.2 5,-0.1 2,-0.2 -0.078 85.3 123.9-131.2 58.3 32.5 -54.3 -42.8 595 172 C E S X S- 0 0 95 -3,-1.1 3,-1.5 1,-0.0 -3,-0.0 -0.580 70.9 -99.6-107.1 151.2 32.2 -50.8 -44.1 596 173 C D T 3 S+ 0 0 167 1,-0.3 -1,-0.0 -2,-0.2 0, 0.0 0.851 120.6 33.0 -32.9 -63.2 32.0 -49.3 -47.6 597 174 C Y T 3 S+ 0 0 18 -43,-0.1 -42,-3.3 -45,-0.1 2,-0.5 0.398 97.1 104.1 -86.7 -2.5 35.6 -48.1 -47.9 598 175 C W E < -q 555 0H 15 -3,-1.5 2,-0.5 -44,-0.2 -42,-0.1 -0.731 46.1-175.5 -93.4 121.8 37.1 -51.0 -45.8 599 176 C I E -q 556 0H 37 -44,-2.3 -42,-1.4 -2,-0.5 2,-0.3 -0.873 14.4-148.2-126.6 103.4 38.9 -53.8 -47.7 600 177 C N E -q 557 0H 87 -2,-0.5 2,-0.5 -7,-0.2 -42,-0.2 -0.492 15.2-167.5 -72.9 123.2 40.1 -56.9 -45.7 601 178 C I E -q 558 0H 10 -44,-3.3 2,-1.4 -2,-0.3 -42,-1.1 -0.962 24.4-130.8-117.9 124.1 43.3 -58.4 -47.2 602 179 C D E > +q 559 0H 64 -2,-0.5 3,-0.7 1,-0.2 -42,-0.1 -0.580 32.0 177.0 -69.2 91.9 44.6 -61.8 -46.1 603 180 C A T 3 + 0 0 1 -44,-1.9 -1,-0.2 -2,-1.4 -43,-0.1 0.156 55.1 94.3 -90.3 18.2 48.2 -60.7 -45.6 604 181 C T T 3 S+ 0 0 44 -45,-0.3 -1,-0.2 2,-0.0 3,-0.1 0.589 73.9 90.6 -79.0 -10.1 49.4 -64.0 -44.3 605 182 C R S < S- 0 0 81 -3,-0.7 2,-0.2 1,-0.2 -2,-0.0 0.085 94.5 -69.5 -80.7-176.3 50.5 -64.8 -47.9 606 183 C K >> - 0 0 149 1,-0.1 4,-1.7 4,-0.0 3,-0.8 -0.545 53.7-111.6 -69.9 145.0 53.7 -64.3 -49.9 607 184 C I H 3> S+ 0 0 81 1,-0.2 4,-2.9 2,-0.2 3,-0.4 0.904 114.0 53.0 -44.0 -56.8 54.2 -60.5 -50.6 608 185 C E H 3> S+ 0 0 115 1,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.744 106.5 52.4 -58.6 -31.8 53.6 -60.7 -54.4 609 186 C D H <> S+ 0 0 68 -3,-0.8 4,-2.0 2,-0.2 -1,-0.3 0.893 111.7 47.1 -69.6 -42.6 50.2 -62.5 -54.0 610 187 C I H X S+ 0 0 9 -4,-1.7 4,-2.2 -3,-0.4 -2,-0.2 0.977 109.7 52.9 -59.1 -57.0 49.1 -59.8 -51.6 611 188 C H H X S+ 0 0 33 -4,-2.9 4,-2.6 1,-0.2 3,-0.4 0.914 107.5 53.9 -40.4 -54.5 50.3 -57.1 -54.0 612 189 C N H X S+ 0 0 96 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.921 105.9 49.6 -48.7 -55.0 48.2 -58.8 -56.7 613 190 C D H X S+ 0 0 56 -4,-2.0 4,-1.3 1,-0.2 -1,-0.2 0.839 111.7 51.4 -59.1 -34.2 45.0 -58.7 -54.7 614 191 C I H >X S+ 0 0 0 -4,-2.2 4,-1.6 -3,-0.4 3,-1.0 0.996 107.8 49.2 -63.3 -62.1 45.6 -55.0 -54.0 615 192 C V H 3X S+ 0 0 24 -4,-2.6 4,-2.9 1,-0.3 5,-0.3 0.833 105.6 60.1 -46.5 -40.4 46.2 -54.0 -57.6 616 193 C K H 3X S+ 0 0 143 -4,-2.2 4,-0.9 1,-0.3 -1,-0.3 0.916 110.1 40.3 -57.1 -45.4 43.0 -55.8 -58.6 617 194 C E H << S+ 0 0 64 -4,-1.3 -1,-0.3 -3,-1.0 -2,-0.2 0.731 113.4 56.6 -75.6 -20.1 40.9 -53.6 -56.3 618 195 C V H >< S+ 0 0 7 -4,-1.6 3,-1.7 1,-0.2 -2,-0.2 0.872 100.6 55.0 -78.6 -40.3 43.0 -50.5 -57.4 619 196 C T H 3< S+ 0 0 89 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.818 96.3 71.1 -60.3 -31.0 42.3 -51.0 -61.1 620 197 C K T 3< S+ 0 0 166 -4,-0.9 -1,-0.3 -5,-0.3 -2,-0.2 0.660 76.9 114.1 -59.0 -15.9 38.6 -50.9 -60.0 621 198 C I < - 0 0 40 -3,-1.7 2,-0.5 -4,-0.2 -3,-0.0 -0.253 64.5-134.4 -66.8 145.3 38.8 -47.1 -59.2 622 199 C K - 0 0 156 1,-0.1 -1,-0.1 2,-0.1 -2,-0.1 -0.875 14.3-152.4 -97.7 125.9 36.9 -44.3 -61.1 623 200 C V + 0 0 97 -2,-0.5 -1,-0.1 -191,-0.0 -2,-0.1 0.446 49.6 124.5 -76.4 -9.8 39.4 -41.5 -61.8 624 201 C E - 0 0 117 1,-0.1 -2,-0.1 -193,-0.0 -195,-0.1 -0.213 66.8 -99.0 -73.4 144.1 36.9 -38.6 -62.0 625 202 C P + 0 0 80 0, 0.0 2,-0.3 0, 0.0 -195,-0.2 -0.045 51.6 165.6 -50.8 157.9 37.0 -35.3 -59.8 626 203 C E B -M 429 0G 49 -197,-1.5 -197,-3.9 0, 0.0 2,-0.1 -0.976 37.6 -71.7-164.0 173.1 34.7 -35.2 -56.8 627 204 C E - 0 0 116 -2,-0.3 2,-0.2 -199,-0.2 -199,-0.1 -0.407 53.0-105.5 -69.3 147.6 33.8 -33.5 -53.5 628 205 C F - 0 0 23 -201,-0.3 2,-0.3 -2,-0.1 -1,-0.1 -0.537 35.4-152.6 -68.3 141.2 36.0 -33.9 -50.5 629 206 C N - 0 0 71 -78,-0.3 -78,-3.0 -2,-0.2 2,-0.4 -0.868 7.4-150.2-114.0 156.7 34.7 -36.2 -47.8 630 207 C F B > -R 550 0I 99 -2,-0.3 3,-1.2 -80,-0.3 -80,-0.2 -0.921 23.3 -73.1-129.0 147.2 35.5 -36.1 -44.1 631 208 C L T 3 S+ 0 0 7 -82,-2.9 -83,-1.9 -2,-0.4 -80,-0.0 -0.551 106.8 22.3 -61.9 138.4 35.8 -38.4 -41.1 632 209 C W T 3 0 0 54 -85,-0.2 -1,-0.3 -2,-0.2 -85,-0.1 -0.962 360.0 360.0-111.6 17.3 33.7 -39.6 -39.8 633 210 C S < 0 0 105 -3,-1.2 -2,-0.2 -82,-0.0 -86,-0.0 0.633 360.0 360.0 -54.2 360.0 30.9 -39.7 -42.4