==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 13-OCT-04 1XR7 . COMPND 2 MOLECULE: GENOME POLYPROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HUMAN RHINOVIRUS 16; . AUTHOR R.A.LOVE,K.A.MAEGLEY,X.YU,R.A.FERRE,L.K.LINGARDO,W.DIEHL, . 920 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 43135.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 603 65.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 1.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 113 12.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.4 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 . 10 1.1 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 . 62 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 119 12.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 265 28.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 1.5 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 8 3 4 0 2 1 2 5 2 2 0 2 0 0 0 0 4 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 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 . 10 4 1 7 2 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 ANTIPARALLEL BRIDGES PER LADDER . 8 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 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 G 0 0 4 0, 0.0 63,-0.9 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 164.4 32.2 12.6 36.6 2 2 A Q E -A 282 0A 97 280,-2.6 280,-2.5 61,-0.2 2,-0.7 -0.895 360.0-126.4-110.7 136.7 32.8 13.6 40.2 3 3 A I E +A 281 0A 57 -2,-0.4 278,-0.2 278,-0.2 3,-0.1 -0.727 30.2 174.9 -79.2 114.1 32.8 11.3 43.2 4 4 A Q E + 0 0 89 276,-2.0 2,-0.4 -2,-0.7 -1,-0.2 0.777 65.3 24.9 -88.3 -35.0 30.3 12.9 45.7 5 5 A I E +A 280 0A 65 275,-1.2 275,-1.8 2,-0.0 2,-0.3 -0.993 57.0 177.3-137.0 139.0 30.3 10.2 48.3 6 6 A S E +A 279 0A 75 -2,-0.4 2,-0.3 273,-0.2 273,-0.2 -0.936 15.8 165.7-144.3 122.9 32.8 7.4 49.4 7 7 A K E -A 278 0A 109 271,-3.0 271,-2.3 -2,-0.3 2,-0.3 -0.959 41.6-104.9-138.3 149.1 32.2 5.1 52.3 8 8 A H E > -A 277 0A 124 -2,-0.3 3,-1.3 269,-0.2 4,-0.3 -0.580 35.5-129.2 -69.3 137.2 33.4 1.8 53.8 9 9 A V G > >S+ 0 0 1 267,-2.0 5,-2.1 -2,-0.3 3,-1.1 0.814 105.4 57.2 -64.9 -33.5 30.9 -0.8 53.0 10 10 A K G > 5S+ 0 0 137 266,-0.3 3,-0.5 1,-0.2 -1,-0.3 0.665 99.4 61.3 -72.8 -18.1 30.7 -2.0 56.6 11 11 A D G < 5S+ 0 0 120 -3,-1.3 -1,-0.2 1,-0.2 -2,-0.2 0.504 109.2 40.5 -85.4 -6.0 29.6 1.5 57.7 12 12 A V G < 5S- 0 0 69 -3,-1.1 -1,-0.2 -4,-0.3 -2,-0.1 -0.072 117.7 -97.4-134.6 35.1 26.5 1.5 55.6 13 13 A G T < 5S+ 0 0 77 -3,-0.5 -3,-0.2 1,-0.2 -4,-0.1 0.737 82.9 122.3 61.7 29.0 25.0 -2.0 55.9 14 14 A L < - 0 0 25 -5,-2.1 -2,-0.2 -6,-0.1 -1,-0.2 -0.888 53.9-128.0-118.6 151.6 26.5 -3.5 52.7 15 15 A P - 0 0 47 0, 0.0 2,-0.2 0, 0.0 107,-0.0 -0.394 33.4 -89.5 -87.4 170.8 28.8 -6.6 52.3 16 16 A S - 0 0 25 -2,-0.1 2,-0.5 260,-0.1 260,-0.2 -0.571 38.7-138.8 -73.8 143.9 32.1 -6.9 50.4 17 17 A I - 0 0 7 258,-2.2 2,-0.6 -2,-0.2 258,-0.2 -0.936 9.2-150.3-110.6 127.8 31.7 -7.8 46.8 18 18 A H - 0 0 167 -2,-0.5 3,-0.0 103,-0.2 -2,-0.0 -0.884 15.8-175.7-105.9 121.6 34.2 -10.3 45.3 19 19 A T - 0 0 32 -2,-0.6 -2,-0.0 1,-0.1 138,-0.0 -0.905 41.9 -78.6-117.4 140.0 35.0 -10.0 41.6 20 20 A P - 0 0 91 0, 0.0 138,-0.2 0, 0.0 -1,-0.1 -0.083 40.8-175.6 -41.4 129.9 37.2 -12.3 39.5 21 21 A T + 0 0 59 2,-0.1 2,-0.3 -3,-0.0 22,-0.3 0.553 59.9 69.8-107.5 -17.6 40.9 -11.6 40.2 22 22 A K S S- 0 0 159 21,-0.1 2,-0.2 20,-0.1 138,-0.1 -0.814 80.5-117.5-108.5 145.9 42.4 -14.0 37.6 23 23 A T - 0 0 53 -2,-0.3 -2,-0.1 1,-0.1 19,-0.0 -0.541 4.3-154.3 -78.6 143.7 42.4 -13.8 33.8 24 24 A K + 0 0 151 -2,-0.2 2,-0.2 2,-0.0 -1,-0.1 0.548 69.2 111.5 -80.2 -13.4 40.7 -16.4 31.6 25 25 A L + 0 0 17 377,-0.1 379,-0.2 380,-0.0 -2,-0.1 -0.441 41.9 165.4 -68.8 132.1 43.2 -15.1 29.0 26 26 A Q E -E 403 0B 138 377,-1.9 377,-2.5 -2,-0.2 379,-0.1 -0.994 44.6 -88.8-146.4 140.9 46.0 -17.6 28.0 27 27 A P E -E 402 0B 66 0, 0.0 375,-0.3 0, 0.0 2,-0.1 -0.284 47.5-143.6 -48.6 134.1 48.5 -17.8 25.1 28 28 A S > - 0 0 14 373,-2.2 3,-1.5 372,-0.0 4,-0.2 -0.339 29.5 -92.4 -94.8 179.3 47.1 -19.6 22.1 29 29 A V T 3 S+ 0 0 78 1,-0.3 3,-0.2 2,-0.1 411,-0.1 0.622 125.9 53.2 -67.6 -14.2 48.7 -22.0 19.6 30 30 A F T >> S+ 0 0 1 370,-0.5 4,-1.2 1,-0.1 3,-0.7 0.272 76.0 107.9-101.4 10.1 49.4 -19.0 17.3 31 31 A Y T <4 S+ 0 0 74 -3,-1.5 -1,-0.1 1,-0.2 -2,-0.1 0.837 83.9 37.7 -59.6 -40.3 51.2 -16.9 20.0 32 32 A D T 34 S+ 0 0 147 -4,-0.2 -1,-0.2 -3,-0.2 -2,-0.1 0.554 111.6 58.5 -91.6 -8.8 54.7 -17.3 18.5 33 33 A I T <4 S+ 0 0 45 -3,-0.7 -2,-0.2 -4,-0.1 -1,-0.2 0.638 102.7 52.0 -98.7 -16.3 53.8 -17.1 14.8 34 34 A F S < S- 0 0 6 -4,-1.2 2,-0.1 363,-0.1 -1,-0.0 -0.930 85.0-119.0-115.1 145.3 52.1 -13.7 14.8 35 35 A P + 0 0 78 0, 0.0 2,-0.3 0, 0.0 366,-0.1 -0.489 49.6 125.7 -77.7 154.1 53.7 -10.5 16.2 36 36 A G - 0 0 32 -2,-0.1 359,-0.0 1,-0.1 358,-0.0 -0.904 42.4-152.5 171.7 165.8 52.1 -8.5 19.0 37 37 A S + 0 0 55 -2,-0.3 2,-0.2 2,-0.0 128,-0.1 0.278 51.2 123.2-139.0 10.4 52.7 -6.9 22.4 38 38 A K - 0 0 24 126,-0.1 126,-0.2 124,-0.1 124,-0.1 -0.496 36.0-172.9 -76.1 146.2 49.3 -6.8 24.2 39 39 A E E -F 163 0C 52 124,-1.9 124,-2.1 -2,-0.2 122,-0.1 -0.923 36.4 -79.5-132.1 158.1 48.8 -8.5 27.5 40 40 A P E -F 162 0C 9 0, 0.0 122,-0.2 0, 0.0 3,-0.1 -0.336 58.1-102.2 -56.0 135.4 45.8 -9.2 29.8 41 41 A A - 0 0 1 120,-2.5 2,-0.2 118,-0.2 127,-0.1 -0.211 41.4 -95.1 -56.3 147.0 44.8 -6.2 31.8 42 42 A V - 0 0 0 125,-0.2 -1,-0.1 1,-0.1 3,-0.1 -0.490 40.1-176.2 -64.6 132.6 45.9 -6.1 35.5 43 43 A L + 0 0 11 -22,-0.3 2,-0.3 -2,-0.2 -1,-0.1 0.424 58.5 28.9-113.9 -4.1 43.0 -7.4 37.6 44 44 A T S > S- 0 0 25 1,-0.1 3,-1.3 -23,-0.0 -1,-0.1 -0.987 74.5-111.7-156.2 160.9 44.3 -6.9 41.1 45 45 A E T 3 S+ 0 0 105 -2,-0.3 9,-0.1 1,-0.2 5,-0.1 0.729 112.8 61.2 -63.2 -25.3 46.6 -4.8 43.4 46 46 A K T 3 S+ 0 0 173 3,-0.0 -1,-0.2 2,-0.0 0, 0.0 0.367 70.1 125.3 -90.7 3.3 48.9 -7.8 43.8 47 47 A D X - 0 0 28 -3,-1.3 3,-1.4 1,-0.1 -5,-0.1 -0.502 57.8-144.0 -64.3 122.6 49.8 -8.1 40.1 48 48 A P T 3 S+ 0 0 127 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.599 93.9 66.8 -67.4 -12.7 53.6 -8.0 39.8 49 49 A R T 3 S+ 0 0 71 119,-0.1 122,-0.1 2,-0.0 -2,-0.1 0.680 78.5 107.5 -80.4 -20.1 53.5 -6.0 36.5 50 50 A L < + 0 0 26 -3,-1.4 119,-0.2 1,-0.1 120,-0.1 -0.244 40.4 177.9 -60.6 146.2 52.0 -2.9 38.3 51 51 A K + 0 0 173 118,-1.8 2,-0.3 117,-0.2 -1,-0.1 -0.233 64.8 44.5-141.0 41.3 54.2 0.2 38.9 52 52 A V S S- 0 0 74 119,-0.0 2,-0.4 0, 0.0 119,-0.0 -0.958 100.7 -71.7-176.4 156.6 51.6 2.4 40.5 53 53 A D > - 0 0 97 -2,-0.3 4,-1.6 1,-0.2 3,-0.1 -0.574 44.2-154.0 -65.7 120.8 48.9 2.4 43.1 54 54 A F H > S+ 0 0 7 -2,-0.4 4,-1.2 1,-0.2 5,-0.2 0.914 86.3 50.7 -69.6 -46.2 46.1 0.4 41.5 55 55 A D H > S+ 0 0 30 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.800 111.7 48.8 -66.5 -29.5 43.0 1.8 43.3 56 56 A S H 4 S+ 0 0 75 2,-0.2 -1,-0.2 1,-0.2 -2,-0.2 0.911 107.2 53.8 -74.6 -43.7 44.1 5.5 42.5 57 57 A A H < S+ 0 0 15 -4,-1.6 3,-0.2 1,-0.2 -2,-0.2 0.715 110.4 47.9 -66.2 -24.2 44.7 4.9 38.8 58 58 A L H >< S+ 0 0 10 -4,-1.2 3,-1.1 1,-0.2 -1,-0.2 0.842 107.8 54.3 -80.7 -39.3 41.2 3.4 38.3 59 59 A F G >< S+ 0 0 54 -4,-1.2 3,-0.7 1,-0.2 -2,-0.2 0.309 84.5 86.5 -79.5 8.1 39.5 6.2 40.2 60 60 A S G 3 + 0 0 55 -3,-0.2 -1,-0.2 1,-0.2 -2,-0.1 0.619 68.7 79.0 -81.4 -13.6 41.2 8.8 37.9 61 61 A K G < S+ 0 0 37 -3,-1.1 2,-0.7 1,-0.2 -1,-0.2 0.734 90.2 62.7 -56.7 -23.8 38.2 8.3 35.5 62 62 A Y < + 0 0 23 -3,-0.7 -59,-0.2 1,-0.1 -1,-0.2 -0.875 58.6 143.4-111.2 99.4 36.4 10.6 38.0 63 63 A K - 0 0 171 -2,-0.7 -61,-0.2 1,-0.4 -1,-0.1 -0.177 60.8 -77.5-136.2 44.7 38.0 14.1 38.1 64 64 A G - 0 0 33 -63,-0.9 2,-0.4 218,-0.1 -1,-0.4 0.025 43.2 -87.8 94.3 164.8 35.3 16.7 38.5 65 65 A N - 0 0 44 -3,-0.1 2,-0.1 -64,-0.0 285,-0.1 -0.946 35.7-122.3-112.9 136.6 32.6 18.4 36.5 66 66 A T - 0 0 67 -2,-0.4 2,-0.8 283,-0.3 282,-0.0 -0.470 35.2-104.8 -70.0 147.7 33.2 21.6 34.5 67 67 A E + 0 0 169 -2,-0.1 2,-0.3 176,-0.0 -1,-0.1 -0.679 66.3 131.6 -79.2 108.3 31.0 24.5 35.5 68 68 A C - 0 0 23 -2,-0.8 2,-0.3 281,-0.1 281,-0.1 -0.972 34.1-156.3-154.1 168.9 28.4 24.9 32.7 69 69 A S - 0 0 78 -2,-0.3 -2,-0.0 176,-0.0 176,-0.0 -0.924 36.9 -75.8-141.9 163.0 24.7 25.3 31.9 70 70 A L - 0 0 61 -2,-0.3 2,-0.3 4,-0.1 176,-0.0 -0.271 49.9-173.6 -54.3 144.7 22.0 24.8 29.2 71 71 A N > - 0 0 52 1,-0.0 4,-1.7 0, 0.0 5,-0.1 -0.819 40.3 -94.3-134.2 178.3 22.1 27.4 26.4 72 72 A E H > S+ 0 0 149 -2,-0.3 4,-2.2 1,-0.2 5,-0.2 0.881 120.6 55.0 -63.6 -39.5 20.0 28.3 23.4 73 73 A H H > S+ 0 0 40 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.892 107.5 47.3 -64.1 -43.7 22.1 26.1 21.0 74 74 A I H > S+ 0 0 0 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.901 112.9 53.6 -60.9 -38.9 21.8 23.0 23.1 75 75 A Q H X S+ 0 0 84 -4,-1.7 4,-1.7 2,-0.2 -2,-0.2 0.853 108.7 44.6 -65.4 -39.9 18.1 23.8 23.2 76 76 A V H X S+ 0 0 57 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.820 110.7 56.9 -75.7 -28.2 17.7 24.1 19.4 77 77 A A H X S+ 0 0 0 -4,-2.0 4,-2.3 -5,-0.2 5,-0.2 0.909 107.0 49.4 -63.5 -41.5 19.8 20.9 19.0 78 78 A V H X S+ 0 0 6 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.904 112.8 45.8 -61.7 -46.0 17.2 19.1 21.3 79 79 A A H X S+ 0 0 58 -4,-1.7 4,-1.8 2,-0.2 -2,-0.2 0.880 113.7 49.1 -70.4 -37.2 14.3 20.4 19.2 80 80 A H H X S+ 0 0 35 -4,-2.4 4,-1.8 2,-0.2 -2,-0.2 0.963 114.6 42.8 -67.0 -51.9 15.9 19.5 15.9 81 81 A Y H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.874 112.9 54.8 -61.3 -39.1 16.9 15.9 16.9 82 82 A S H X S+ 0 0 7 -4,-2.1 4,-1.7 -5,-0.2 -1,-0.2 0.910 107.7 48.1 -59.8 -44.3 13.5 15.4 18.5 83 83 A A H X S+ 0 0 67 -4,-1.8 4,-0.8 1,-0.2 -1,-0.2 0.835 110.8 52.7 -69.9 -33.0 11.6 16.4 15.4 84 84 A Q H >< S+ 0 0 46 -4,-1.8 3,-0.5 1,-0.2 4,-0.2 0.913 111.0 45.6 -64.5 -45.3 13.8 14.1 13.4 85 85 A L H >< S+ 0 0 0 -4,-2.2 3,-1.4 1,-0.2 5,-0.4 0.751 101.0 66.9 -72.8 -24.9 13.1 11.1 15.7 86 86 A A H >< S+ 0 0 56 -4,-1.7 3,-1.8 1,-0.3 -1,-0.2 0.831 86.4 72.5 -63.6 -32.1 9.3 11.8 15.7 87 87 A T T << S+ 0 0 111 -4,-0.8 -1,-0.3 -3,-0.5 -2,-0.2 0.757 91.2 58.0 -47.2 -31.1 9.4 10.8 12.0 88 88 A L T < S- 0 0 23 -3,-1.4 -1,-0.3 -4,-0.2 -2,-0.2 0.637 97.0-142.0 -80.2 -18.7 9.9 7.2 13.2 89 89 A D < - 0 0 139 -3,-1.8 2,-0.1 -4,-0.3 -3,-0.1 0.910 23.2-163.4 54.9 51.3 6.6 7.2 15.3 90 90 A I - 0 0 12 -5,-0.4 -1,-0.2 1,-0.1 104,-0.1 -0.422 23.3-114.0 -65.4 136.3 8.1 5.1 18.1 91 91 A D - 0 0 90 102,-0.2 102,-0.2 1,-0.1 -1,-0.1 -0.622 23.2-159.3 -74.1 111.8 5.5 3.6 20.4 92 92 A P + 0 0 48 0, 0.0 168,-0.2 0, 0.0 -1,-0.1 0.521 57.8 104.9 -73.3 -6.0 5.9 5.3 23.8 93 93 A Q S S- 0 0 119 1,-0.1 100,-0.3 166,-0.1 -2,-0.0 -0.391 77.2-104.2 -72.5 152.7 4.2 2.5 25.8 94 94 A P - 0 0 77 0, 0.0 2,-0.3 0, 0.0 96,-0.2 -0.236 33.1-119.1 -68.5 162.9 6.1 -0.0 27.9 95 95 A I - 0 0 16 94,-1.6 97,-0.1 93,-0.2 5,-0.1 -0.748 31.7 -93.1-103.4 155.3 6.8 -3.6 26.7 96 96 A A >> - 0 0 49 -2,-0.3 4,-1.3 1,-0.1 3,-0.9 -0.319 33.2-119.3 -63.3 146.5 5.7 -6.8 28.4 97 97 A M H 3> S+ 0 0 51 1,-0.3 4,-1.4 2,-0.2 5,-0.2 0.769 113.2 63.5 -61.7 -26.5 8.2 -8.4 30.8 98 98 A E H 3> S+ 0 0 88 1,-0.2 4,-2.5 2,-0.2 5,-0.3 0.884 104.3 46.8 -62.4 -41.4 8.3 -11.5 28.6 99 99 A D H <> S+ 0 0 60 -3,-0.9 4,-1.1 1,-0.2 -1,-0.2 0.799 108.7 55.6 -70.4 -32.2 9.7 -9.4 25.8 100 100 A S H < S+ 0 0 0 -4,-1.3 -1,-0.2 2,-0.1 -2,-0.2 0.773 117.6 34.3 -68.8 -29.0 12.3 -7.8 28.2 101 101 A V H < S+ 0 0 1 -4,-1.4 9,-2.3 2,-0.1 -2,-0.2 0.904 132.8 23.9 -92.7 -50.7 13.6 -11.2 29.2 102 102 A F H < S- 0 0 48 -4,-2.5 7,-0.3 1,-0.2 -3,-0.2 0.438 107.0-126.4-102.2 -2.7 13.4 -13.3 26.0 103 103 A G < - 0 0 14 -4,-1.1 2,-0.2 -5,-0.3 -1,-0.2 -0.172 19.9-144.6 93.3 176.5 13.4 -10.5 23.4 104 104 A M B > -G 107 0D 55 3,-1.9 3,-1.8 -4,-0.1 2,-0.3 -0.875 55.3 -32.5-160.1-165.8 11.3 -9.3 20.5 105 105 A D T 3 S+ 0 0 127 1,-0.3 95,-0.1 -2,-0.2 3,-0.1 -0.474 133.1 2.5 -65.4 121.5 11.9 -7.7 17.1 106 106 A G T 3 S+ 0 0 18 -2,-0.3 2,-0.5 93,-0.1 -1,-0.3 0.386 115.5 92.5 83.6 -2.8 15.0 -5.4 17.4 107 107 A L B < -G 104 0D 9 -3,-1.8 -3,-1.9 92,-0.1 3,-0.1 -0.898 69.2-143.1-128.9 102.0 15.6 -6.4 21.1 108 108 A E - 0 0 167 -2,-0.5 -5,-0.2 -5,-0.2 3,-0.1 -0.163 33.3 -91.5 -55.5 151.1 18.0 -9.3 21.7 109 109 A A - 0 0 51 -7,-0.3 -7,-0.2 1,-0.1 -1,-0.1 -0.322 51.3 -91.8 -60.0 147.7 17.3 -11.7 24.5 110 110 A L - 0 0 20 -9,-2.3 2,-0.5 -10,-0.1 -1,-0.1 -0.388 42.8-110.6 -58.1 136.7 18.8 -10.9 27.9 111 111 A D - 0 0 87 1,-0.1 -1,-0.1 -3,-0.1 16,-0.0 -0.660 29.7-166.9 -72.6 123.4 22.2 -12.6 28.3 112 112 A L S S+ 0 0 21 -2,-0.5 16,-0.4 1,-0.2 15,-0.2 0.452 77.5 60.7 -96.2 -1.4 21.6 -15.3 31.0 113 113 A N S S+ 0 0 147 14,-0.1 -1,-0.2 13,-0.1 3,-0.1 0.787 85.3 83.7 -95.2 -34.3 25.3 -15.9 31.7 114 114 A T S S- 0 0 75 1,-0.2 13,-0.4 12,-0.1 0, 0.0 -0.130 96.1 -69.3 -67.7 169.1 26.5 -12.5 32.8 115 115 A S - 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0 0 3 -46,-2.1 2,-0.2 -47,-0.1 -17,-0.1 -0.933 39.6-113.2-101.6 126.8 27.6 7.6 31.8 286 286 A P > - 0 0 5 0, 0.0 2,-0.7 0, 0.0 3,-0.5 -0.432 34.4-121.3 -59.0 125.2 28.2 4.2 33.5 287 287 A S T 3 S+ 0 0 27 1,-0.2 -110,-2.2 -2,-0.2 6,-0.0 -0.622 83.0 13.3 -79.7 109.0 30.2 2.1 31.1 288 288 A G T 3 S+ 0 0 40 -2,-0.7 -109,-0.2 -112,-0.2 -1,-0.2 0.860 96.1 82.7 104.9 46.6 28.4 -1.2 30.2 289 289 A C S X S+ 0 0 26 -3,-0.5 3,-2.2 -111,-0.1 4,-0.3 -0.663 73.5 3.1-148.7-152.1 24.7 -1.4 31.3 290 290 A S T 3 S- 0 0 13 1,-0.3 -1,-0.1 -2,-0.2 -105,-0.0 -0.091 123.8 -26.9 -49.5 104.3 21.1 -0.6 30.4 291 291 A G T 3> S+ 0 0 18 -2,-0.1 4,-2.8 3,-0.1 5,-0.3 0.652 89.5 147.1 70.8 17.5 20.8 1.2 27.0 292 292 A T H <> + 0 0 23 -3,-2.2 4,-2.1 1,-0.2 5,-0.2 0.863 66.9 46.2 -53.5 -49.5 24.3 2.6 27.3 293 293 A S H > S+ 0 0 37 -4,-0.3 4,-1.4 1,-0.2 33,-0.7 0.896 116.4 44.3 -68.8 -39.2 25.2 2.5 23.6 294 294 A I H > S+ 0 0 2 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.922 113.7 48.1 -70.4 -45.3 22.0 4.1 22.5 295 295 A F H X S+ 0 0 3 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.912 112.6 50.2 -64.6 -42.0 21.8 6.8 25.1 296 296 A N H X S+ 0 0 4 -4,-2.1 4,-1.9 -5,-0.3 -1,-0.2 0.826 110.6 50.3 -59.3 -37.7 25.4 7.7 24.4 297 297 A S H X S+ 0 0 0 -4,-1.4 4,-1.6 2,-0.2 -2,-0.2 0.896 110.6 48.3 -67.3 -43.8 24.6 7.9 20.7 298 298 A M H X S+ 0 0 0 -4,-2.4 4,-1.3 2,-0.2 -2,-0.2 0.894 112.2 49.8 -64.5 -41.7 21.6 10.2 21.3 299 299 A I H X S+ 0 0 1 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.887 107.1 54.4 -63.2 -42.0 23.8 12.4 23.5 300 300 A N H X S+ 0 0 0 -4,-1.9 4,-2.5 1,-0.2 5,-0.2 0.854 104.0 56.4 -61.2 -34.1 26.5 12.5 20.8 301 301 A N H X S+ 0 0 0 -4,-1.6 4,-1.3 2,-0.2 -1,-0.2 0.867 109.3 45.6 -64.8 -37.1 23.8 13.7 18.4 302 302 A I H X S+ 0 0 1 -4,-1.3 4,-2.4 -3,-0.2 -2,-0.2 0.938 113.7 49.1 -68.9 -47.6 23.0 16.6 20.7 303 303 A I H X S+ 0 0 0 -4,-2.5 4,-2.9 1,-0.2 5,-0.2 0.920 110.0 48.7 -60.0 -50.3 26.7 17.5 21.3 304 304 A I H X S+ 0 0 0 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.886 112.4 50.1 -62.7 -38.9 27.7 17.6 17.6 305 305 A R H X S+ 0 0 2 -4,-1.3 4,-1.9 -5,-0.2 -1,-0.2 0.951 114.5 42.8 -61.8 -50.3 24.7 19.8 16.8 306 306 A T H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.869 112.4 53.5 -69.4 -35.9 25.4 22.3 19.5 307 307 A L H X S+ 0 0 0 -4,-2.9 4,-1.4 2,-0.2 -1,-0.2 0.856 110.7 45.8 -66.6 -39.1 29.2 22.3 18.9 308 308 A V H X S+ 0 0 0 -4,-1.9 4,-1.9 -5,-0.2 -1,-0.2 0.875 113.4 51.5 -67.8 -37.7 28.8 23.1 15.2 309 309 A L H < S+ 0 0 16 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.858 108.5 50.8 -65.3 -37.9 26.2 25.7 16.2 310 310 A D H < S+ 0 0 17 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.839 115.6 41.7 -68.8 -36.3 28.7 27.3 18.7 311 311 A A H < S+ 0 0 30 -4,-1.4 2,-0.4 1,-0.2 -2,-0.2 0.766 125.7 27.9 -82.9 -30.2 31.4 27.6 16.1 312 312 A Y < - 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0 0 20 -2,-0.8 -16,-0.1 28,-0.6 -17,-0.1 -0.669 36.8 -96.2 -86.0 136.0 39.5 -3.9 10.1 392 392 A P > - 0 0 45 0, 0.0 4,-1.2 0, 0.0 3,-0.5 -0.281 23.0-144.0 -58.8 127.3 43.1 -3.1 11.2 393 393 A V H > S+ 0 0 39 1,-0.2 4,-2.0 2,-0.2 3,-0.2 0.851 98.1 59.3 -55.5 -40.5 45.5 -6.0 10.5 394 394 A E H > S+ 0 0 115 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.865 102.2 51.4 -59.9 -41.9 47.4 -5.3 13.8 395 395 A E H > S+ 0 0 49 -3,-0.5 4,-2.0 1,-0.2 -1,-0.2 0.843 109.4 51.1 -66.8 -32.9 44.3 -5.8 16.0 396 396 A I H X S+ 0 0 0 -4,-1.2 4,-2.0 2,-0.2 -2,-0.2 0.877 107.9 52.4 -69.8 -40.5 43.7 -9.2 14.3 397 397 A Y H X S+ 0 0 32 -4,-2.0 4,-0.8 1,-0.2 -2,-0.2 0.907 112.9 44.2 -62.7 -41.4 47.3 -10.3 14.9 398 398 A E H < S+ 0 0 6 -4,-1.9 3,-0.4 1,-0.2 4,-0.2 0.897 111.7 53.1 -71.6 -38.2 47.1 -9.5 18.6 399 399 A S H >< S+ 0 0 37 -4,-2.0 3,-1.4 1,-0.2 -2,-0.2 0.906 105.2 53.3 -63.1 -43.6 43.6 -11.1 19.0 400 400 A I H 3< S+ 0 0 0 -4,-2.0 -370,-0.5 1,-0.3 -1,-0.2 0.745 96.0 69.8 -66.8 -23.3 44.7 -14.5 17.5 401 401 A R T 3< S+ 0 0 19 -4,-0.8 -373,-2.2 -3,-0.4 2,-0.3 0.544 101.3 46.9 -71.8 -9.8 47.6 -14.8 19.9 402 402 A W E < -E 27 0B 25 -3,-1.4 2,-0.3 -375,-0.3 -377,-0.1 -0.963 60.6-169.5-135.3 150.9 45.3 -15.3 23.0 403 403 A T E -E 26 0B 15 -377,-2.5 -377,-1.9 -2,-0.3 6,-0.0 -0.983 23.4-164.1-133.3 150.9 42.2 -17.5 24.0 404 404 A K S S+ 0 0 101 -2,-0.3 -1,-0.1 1,-0.3 -379,-0.0 0.505 97.5 20.5 -98.8 -14.0 39.8 -17.6 26.9 405 405 A K > - 0 0 104 -379,-0.1 3,-1.1 1,-0.1 -1,-0.3 -0.773 62.6-161.0-156.7 107.3 38.7 -21.1 25.7 406 406 A P G > S+ 0 0 88 0, 0.0 3,-1.0 0, 0.0 -1,-0.1 0.746 88.6 67.4 -57.5 -28.7 40.9 -23.4 23.4 407 407 A S G 3 S+ 0 0 103 1,-0.3 3,-0.4 2,-0.1 -2,-0.0 0.789 97.0 53.6 -63.4 -32.1 37.9 -25.6 22.4 408 408 A Q G <> S+ 0 0 99 -3,-1.1 4,-1.8 1,-0.2 -1,-0.3 -0.140 70.6 118.4 -98.0 37.1 36.2 -22.7 20.5 409 409 A M H <> + 0 0 20 -3,-1.0 4,-2.6 1,-0.2 5,-0.3 0.842 69.4 58.6 -71.6 -35.3 39.3 -21.9 18.3 410 410 A Q H > S+ 0 0 56 -3,-0.4 4,-1.6 1,-0.2 -1,-0.2 0.858 109.8 44.0 -61.2 -38.5 37.5 -22.7 15.0 411 411 A E H > S+ 0 0 115 2,-0.2 4,-2.0 3,-0.1 -2,-0.2 0.899 113.0 51.7 -72.9 -43.0 34.9 -20.0 15.8 412 412 A H H X S+ 0 0 49 -4,-1.8 4,-1.6 2,-0.2 -2,-0.2 0.936 113.4 43.1 -58.0 -49.9 37.6 -17.5 16.9 413 413 A V H X S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.873 110.9 55.0 -69.5 -38.5 39.7 -17.9 13.8 414 414 A L H X S+ 0 0 47 -4,-1.6 4,-2.0 -5,-0.3 -1,-0.2 0.898 107.3 51.0 -62.0 -41.2 36.6 -17.9 11.4 415 415 A S H X S+ 0 0 74 -4,-2.0 4,-1.0 2,-0.2 -1,-0.2 0.888 110.6 49.1 -60.0 -43.0 35.6 -14.5 13.0 416 416 A L H X S+ 0 0 10 -4,-1.6 4,-2.5 1,-0.2 3,-0.2 0.873 109.2 52.6 -65.3 -38.4 39.1 -13.2 12.4 417 417 A C H X S+ 0 0 0 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.882 104.5 55.6 -62.3 -41.6 39.0 -14.4 8.7 418 418 A H H < S+ 0 0 53 -4,-2.0 4,-0.3 1,-0.2 -1,-0.2 0.785 115.5 39.4 -65.2 -28.3 35.6 -12.6 8.1 419 419 A L H < S+ 0 0 39 -4,-1.0 -28,-0.6 -3,-0.2 3,-0.5 0.858 115.2 52.7 -79.0 -43.6 37.3 -9.4 9.2 420 420 A M H >< S+ 0 0 0 -4,-2.5 3,-2.2 1,-0.2 -2,-0.2 0.854 94.3 63.9 -69.8 -41.0 40.7 -10.0 7.6 421 421 A W G >< S+ 0 0 1 -4,-2.1 3,-2.3 1,-0.3 -1,-0.2 0.782 88.4 70.9 -62.7 -29.5 39.8 -10.7 3.9 422 422 A H G 3 S+ 0 0 2 -3,-0.5 -1,-0.3 1,-0.3 -2,-0.2 0.676 87.6 66.7 -57.2 -22.4 38.3 -7.2 3.4 423 423 A N G < S- 0 0 8 -3,-2.2 -1,-0.3 1,-0.3 4,-0.2 0.420 121.0 -85.7 -79.7 -3.1 41.9 -6.0 3.5 424 424 A G <> - 0 0 2 -3,-2.3 4,-1.7 -4,-0.1 -1,-0.3 -0.203 34.3 -83.7 117.9 159.7 42.7 -7.8 0.3 425 425 A P H > S+ 0 0 49 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.843 120.7 57.4 -65.1 -36.4 43.7 -11.2 -1.1 426 426 A E H > S+ 0 0 133 2,-0.2 4,-1.6 1,-0.2 5,-0.1 0.931 111.2 40.1 -60.5 -49.8 47.4 -10.6 -0.5 427 427 A I H > S+ 0 0 54 -4,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.845 117.3 52.0 -69.4 -32.3 47.1 -9.9 3.2 428 428 A Y H X S+ 0 0 0 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.880 106.3 51.2 -73.2 -38.9 44.6 -12.7 3.5 429 429 A K H X S+ 0 0 89 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.888 110.1 50.6 -66.6 -38.0 46.8 -15.3 1.8 430 430 A D H X S+ 0 0 66 -4,-1.6 4,-1.9 2,-0.2 -1,-0.2 0.884 109.4 52.3 -61.3 -40.5 49.6 -14.4 4.2 431 431 A F H X S+ 0 0 0 -4,-1.6 4,-1.8 1,-0.2 -2,-0.2 0.914 109.9 48.1 -61.6 -45.1 47.2 -14.8 7.1 432 432 A E H X S+ 0 0 26 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.887 109.8 51.7 -63.2 -43.5 46.2 -18.3 5.9 433 433 A T H < S+ 0 0 101 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.894 109.8 48.4 -65.2 -42.2 49.7 -19.5 5.4 434 434 A K H >< S+ 0 0 65 -4,-1.9 3,-1.2 1,-0.2 4,-0.3 0.894 111.0 51.3 -65.2 -38.8 50.8 -18.5 8.9 435 435 A I H >< S+ 0 0 0 -4,-1.8 3,-0.8 1,-0.2 6,-0.3 0.878 109.7 50.6 -64.4 -36.6 47.7 -20.2 10.4 436 436 A R T 3< S+ 0 0 128 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.242 87.4 83.7 -89.6 12.3 48.6 -23.4 8.5 437 437 A S T < S+ 0 0 80 -3,-1.2 2,-0.3 -5,-0.1 -1,-0.2 0.633 90.1 55.1 -85.0 -17.2 52.2 -23.5 9.7 438 438 A V S X> S- 0 0 44 -3,-0.8 4,-1.2 -4,-0.3 3,-0.6 -0.868 89.1-124.8-112.3 151.6 51.1 -25.2 12.9 439 439 A S H 3> S+ 0 0 78 -2,-0.3 4,-1.3 1,-0.2 -1,-0.1 0.749 107.6 62.5 -71.7 -24.5 49.1 -28.4 12.9 440 440 A A H 34 S+ 0 0 39 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.846 107.2 45.6 -66.3 -33.2 46.3 -27.0 15.1 441 441 A G H <4 S+ 0 0 0 -3,-0.6 3,-0.5 -6,-0.3 -2,-0.2 0.758 105.3 60.3 -78.1 -29.1 45.6 -24.5 12.2 442 442 A R H < S+ 0 0 153 -4,-1.2 -2,-0.2 1,-0.2 -1,-0.2 0.826 101.5 56.1 -60.6 -34.9 45.9 -27.3 9.6 443 443 A A S < S+ 0 0 87 -4,-1.3 -1,-0.2 2,-0.1 -2,-0.2 0.713 95.8 85.9 -72.6 -21.4 42.9 -29.0 11.4 444 444 A L S S- 0 0 30 -3,-0.5 2,-0.7 -4,-0.4 -3,-0.0 -0.415 83.5-114.1 -82.4 153.1 40.7 -25.9 11.1 445 445 A Y - 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0 0 1 120,-2.8 2,-0.2 118,-0.2 127,-0.1 -0.163 41.2 -92.9 -50.7 152.4 94.9 -6.2 61.3 503 42 B V - 0 0 1 125,-0.2 -1,-0.1 1,-0.1 3,-0.1 -0.523 38.5-177.3 -75.1 139.3 95.6 -6.2 65.1 504 43 B L + 0 0 11 -22,-0.3 2,-0.3 -2,-0.2 -1,-0.1 0.301 62.2 37.5-118.4 3.4 92.6 -7.4 67.2 505 44 B T S > S- 0 0 30 1,-0.1 3,-1.5 10,-0.0 -1,-0.2 -0.994 73.2-119.7-157.6 151.9 94.1 -6.9 70.7 506 45 B E T 3 S+ 0 0 96 -2,-0.3 9,-0.1 1,-0.3 5,-0.1 0.745 109.6 64.7 -56.9 -31.0 96.3 -4.6 72.9 507 46 B K T 3 + 0 0 175 3,-0.0 -1,-0.3 -3,-0.0 0, 0.0 0.494 69.1 124.2 -76.9 -6.6 98.7 -7.5 73.5 508 47 B D X - 0 0 30 -3,-1.5 3,-1.3 1,-0.2 -5,-0.1 -0.390 57.3-146.1 -60.5 121.4 99.7 -7.8 69.8 509 48 B P T 3 S+ 0 0 128 0, 0.0 -1,-0.2 0, 0.0 -3,-0.0 0.710 95.0 65.9 -62.7 -21.8 103.6 -7.5 69.7 510 49 B R T 3 S+ 0 0 72 2,-0.0 2,-0.1 119,-0.0 122,-0.1 0.724 77.9 106.0 -72.1 -24.4 103.4 -5.7 66.3 511 50 B L < + 0 0 27 -3,-1.3 119,-0.2 1,-0.1 120,-0.1 -0.378 39.0 173.7 -58.0 128.8 101.6 -2.7 68.0 512 51 B K + 0 0 176 118,-2.2 2,-0.3 117,-0.2 -1,-0.1 0.264 65.1 54.7-113.9 5.4 103.9 0.4 68.4 513 52 B V S S- 0 0 76 117,-0.5 2,-0.3 0, 0.0 119,-0.0 -0.895 99.0 -86.1-136.8 157.0 101.1 2.6 69.7 514 53 B D > - 0 0 101 -2,-0.3 4,-1.4 1,-0.1 -2,-0.1 -0.590 41.9-147.2 -65.0 126.9 98.4 2.6 72.5 515 54 B F H > S+ 0 0 4 -2,-0.3 4,-2.0 1,-0.2 5,-0.2 0.927 87.3 49.4 -71.3 -52.2 95.5 0.6 71.0 516 55 B D H > S+ 0 0 40 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.868 112.7 49.0 -56.7 -41.5 92.4 2.2 72.5 517 56 B S H 4 S+ 0 0 63 1,-0.2 4,-0.5 2,-0.2 -1,-0.2 0.853 109.6 52.3 -69.0 -35.3 93.6 5.8 71.7 518 57 B A H < S+ 0 0 10 -4,-1.4 3,-0.3 2,-0.2 -2,-0.2 0.864 113.1 44.7 -65.7 -37.6 94.3 4.8 68.1 519 58 B L H >< S+ 0 0 9 -4,-2.0 3,-0.9 1,-0.2 -2,-0.2 0.866 113.7 48.5 -72.8 -38.4 90.8 3.3 67.7 520 59 B F G >< S+ 0 0 32 -4,-2.1 3,-1.0 1,-0.2 -1,-0.2 0.432 86.1 87.7 -86.9 -0.9 89.1 6.3 69.4 521 60 B S G 3 S+ 0 0 51 -4,-0.5 -1,-0.2 -3,-0.3 -2,-0.1 0.658 72.8 76.6 -68.3 -18.9 91.0 8.8 67.2 522 61 B K G < S+ 0 0 36 -3,-0.9 2,-0.8 1,-0.2 -1,-0.2 0.868 93.3 53.8 -52.1 -42.4 88.1 8.3 64.8 523 62 B Y < + 0 0 12 -3,-1.0 -59,-0.3 -4,-0.1 -1,-0.2 -0.863 64.4 142.4-101.7 104.1 86.0 10.5 67.1 524 63 B K - 0 0 149 -2,-0.8 -61,-0.2 1,-0.4 -1,-0.1 -0.239 60.5 -56.3-142.2 54.4 87.8 13.8 67.7 525 64 B G - 0 0 34 -63,-1.4 2,-0.5 218,-0.1 -1,-0.4 0.105 42.4-102.4 103.3 153.9 85.3 16.7 67.8 526 65 B N - 0 0 45 -3,-0.1 285,-0.1 218,-0.0 2,-0.1 -0.973 32.6-129.4-112.3 122.9 82.6 18.5 65.9 527 66 B T - 0 0 64 -2,-0.5 2,-0.9 283,-0.2 -2,-0.0 -0.406 34.9-105.6 -58.7 143.7 83.4 21.8 64.2 528 67 B E + 0 0 170 -2,-0.1 2,-0.3 176,-0.0 -1,-0.1 -0.697 67.0 129.5 -80.9 111.1 80.8 24.4 65.2 529 68 B C - 0 0 21 -2,-0.9 2,-0.3 281,-0.1 177,-0.1 -0.941 33.5-158.9-146.6 170.4 78.5 25.0 62.2 530 69 B S - 0 0 83 -2,-0.3 -2,-0.0 175,-0.0 176,-0.0 -0.917 38.9 -62.2-144.1 171.7 74.8 25.1 61.5 531 70 B L - 0 0 50 -2,-0.3 2,-0.2 4,-0.1 176,-0.0 -0.287 52.9-174.6 -52.5 133.8 72.2 24.8 58.8 532 71 B N > - 0 0 49 -3,-0.0 4,-1.5 1,-0.0 -1,-0.0 -0.692 40.5 -95.0-121.3-177.8 72.6 27.4 56.0 533 72 B E H > S+ 0 0 142 -2,-0.2 4,-1.9 1,-0.2 5,-0.2 0.875 120.6 54.7 -66.4 -40.2 70.5 28.2 52.9 534 73 B H H > S+ 0 0 38 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.870 106.4 50.5 -64.4 -41.1 72.6 26.1 50.5 535 74 B I H > S+ 0 0 1 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.898 111.6 50.5 -61.4 -39.2 72.2 23.0 52.7 536 75 B Q H X S+ 0 0 91 -4,-1.5 4,-1.8 2,-0.2 -2,-0.2 0.814 110.0 47.1 -72.2 -30.7 68.4 23.7 52.6 537 76 B V H X S+ 0 0 53 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.810 111.2 53.5 -78.8 -27.6 68.2 24.1 48.8 538 77 B A H X S+ 0 0 0 -4,-1.9 4,-2.3 -5,-0.2 5,-0.2 0.905 109.7 48.6 -66.2 -42.0 70.3 20.9 48.4 539 78 B V H X S+ 0 0 6 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.901 112.9 46.3 -63.1 -45.2 67.7 19.1 50.7 540 79 B A H X S+ 0 0 57 -4,-1.8 4,-1.8 2,-0.2 -2,-0.2 0.860 114.0 49.4 -68.3 -34.3 64.7 20.4 48.7 541 80 B H H X S+ 0 0 34 -4,-1.9 4,-1.7 2,-0.2 -2,-0.2 0.932 113.9 42.3 -71.3 -47.4 66.4 19.5 45.3 542 81 B Y H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.841 113.0 55.4 -70.0 -33.9 67.3 16.0 46.2 543 82 B S H X S+ 0 0 6 -4,-1.9 4,-1.4 -5,-0.2 -1,-0.2 0.909 107.8 47.4 -62.5 -46.3 63.9 15.4 47.9 544 83 B A H X S+ 0 0 66 -4,-1.8 4,-0.8 1,-0.2 -2,-0.2 0.844 110.9 54.0 -65.5 -34.7 62.1 16.5 44.7 545 84 B Q H >< S+ 0 0 46 -4,-1.7 3,-0.6 1,-0.2 -2,-0.2 0.930 111.1 43.9 -61.7 -47.4 64.4 14.1 42.8 546 85 B L H >< S+ 0 0 0 -4,-2.2 3,-1.3 1,-0.2 5,-0.4 0.710 100.3 68.8 -74.1 -20.8 63.5 11.1 45.0 547 86 B A H >< S+ 0 0 50 -4,-1.4 3,-1.7 1,-0.3 -1,-0.2 0.813 87.0 70.9 -68.2 -29.1 59.8 11.9 45.1 548 87 B T T << S+ 0 0 105 -4,-0.8 -1,-0.3 -3,-0.6 -2,-0.2 0.716 89.4 60.2 -52.2 -28.7 59.9 10.9 41.4 549 88 B L T < S- 0 0 23 -3,-1.3 -1,-0.3 -4,-0.2 -2,-0.2 0.630 99.9-140.9 -77.7 -16.1 60.4 7.2 42.5 550 89 B D < - 0 0 138 -3,-1.7 2,-0.3 -4,-0.3 -3,-0.1 0.943 23.2-161.3 54.1 60.8 57.1 7.3 44.4 551 90 B I - 0 0 18 -5,-0.4 -1,-0.2 1,-0.1 104,-0.1 -0.535 20.5-118.6 -78.9 132.1 58.3 5.4 47.4 552 91 B D - 0 0 90 -2,-0.3 102,-0.2 1,-0.2 -1,-0.1 -0.591 21.7-160.6 -70.4 109.6 55.6 3.8 49.6 553 92 B P + 0 0 46 0, 0.0 168,-0.2 0, 0.0 -1,-0.2 0.569 57.1 107.0 -73.3 -9.5 56.2 5.5 53.0 554 93 B Q S S- 0 0 123 1,-0.1 100,-0.3 166,-0.1 -2,-0.0 -0.340 75.8-107.6 -67.2 149.5 54.3 2.7 54.9 555 94 B P - 0 0 75 0, 0.0 2,-0.3 0, 0.0 96,-0.2 -0.175 30.9-117.9 -68.9 168.1 56.3 0.2 57.0 556 95 B I - 0 0 15 94,-1.7 97,-0.1 93,-0.2 2,-0.1 -0.732 32.8 -91.9-106.1 159.8 56.8 -3.4 56.0 557 96 B A >> - 0 0 45 -2,-0.3 4,-1.5 1,-0.1 3,-1.0 -0.366 33.7-117.9 -68.4 149.1 55.7 -6.6 57.8 558 97 B M H 3> S+ 0 0 50 1,-0.3 4,-1.3 2,-0.2 5,-0.2 0.780 113.9 62.8 -60.9 -26.4 58.1 -8.1 60.2 559 98 B E H 3> S+ 0 0 98 1,-0.2 4,-2.3 2,-0.2 5,-0.3 0.849 103.8 47.7 -66.4 -37.1 58.2 -11.3 58.1 560 99 B D H <> S+ 0 0 61 -3,-1.0 4,-1.5 2,-0.2 -1,-0.2 0.827 107.1 56.6 -71.2 -35.6 59.7 -9.3 55.2 561 100 B S H < S+ 0 0 0 -4,-1.5 -2,-0.2 1,-0.2 -1,-0.2 0.809 116.9 35.5 -63.3 -31.8 62.3 -7.6 57.6 562 101 B V H < S+ 0 0 1 -4,-1.3 9,-2.3 2,-0.1 -2,-0.2 0.885 132.5 23.0 -89.1 -45.7 63.6 -11.1 58.6 563 102 B F H < S- 0 0 48 -4,-2.3 7,-0.3 7,-0.2 -3,-0.2 0.573 106.3-123.8-108.2 -15.2 63.3 -13.2 55.4 564 103 B G < - 0 0 17 -4,-1.5 2,-0.3 -5,-0.3 -1,-0.2 -0.210 20.4-145.0 107.5 171.4 63.3 -10.5 52.7 565 104 B M B > -W 568 0M 54 3,-1.8 3,-1.9 -4,-0.1 2,-0.2 -0.872 56.0 -36.8-155.5-169.6 61.4 -9.1 49.8 566 105 B D T 3 S+ 0 0 127 1,-0.3 95,-0.1 -2,-0.3 -2,-0.0 -0.418 131.7 4.0 -61.4 121.0 62.1 -7.5 46.4 567 106 B G T 3 S+ 0 0 17 -2,-0.2 2,-0.4 93,-0.1 -1,-0.3 0.357 115.8 87.8 86.8 -5.1 65.2 -5.3 46.8 568 107 B L B < -W 565 0M 7 -3,-1.9 -3,-1.8 92,-0.1 3,-0.1 -0.924 69.9-142.5-131.3 106.0 65.8 -6.3 50.4 569 108 B E - 0 0 169 -2,-0.4 -5,-0.2 -5,-0.2 3,-0.1 -0.156 32.6 -89.2 -62.6 159.7 68.0 -9.4 51.1 570 109 B A - 0 0 57 -7,-0.3 -7,-0.2 1,-0.1 -1,-0.1 -0.307 51.6 -90.0 -66.8 152.0 67.2 -11.7 54.0 571 110 B L - 0 0 14 -9,-2.3 2,-0.5 1,-0.1 -1,-0.1 -0.405 43.7-112.3 -61.0 134.9 68.7 -11.0 57.4 572 111 B D - 0 0 83 1,-0.1 -1,-0.1 -2,-0.1 16,-0.1 -0.639 27.1-165.4 -71.6 123.0 72.1 -12.7 57.9 573 112 B L S S+ 0 0 23 -2,-0.5 16,-0.4 1,-0.2 15,-0.3 0.525 80.8 59.1 -92.1 -7.2 71.6 -15.4 60.5 574 113 B N S S+ 0 0 134 14,-0.1 -1,-0.2 13,-0.1 3,-0.1 0.734 87.7 88.7 -90.5 -27.3 75.4 -16.0 61.2 575 114 B T S S- 0 0 69 1,-0.1 13,-0.5 -3,-0.1 0, 0.0 -0.192 93.7 -75.1 -67.0 162.1 76.2 -12.5 62.3 576 115 B S - 0 0 41 1,-0.1 -1,-0.1 11,-0.1 11,-0.1 -0.254 24.3-144.8 -58.0 142.1 75.8 -11.3 65.9 577 116 B A - 0 0 4 9,-0.3 65,-2.6 1,-0.2 66,-0.3 0.508 43.7-144.2 -80.4 -8.7 72.4 -10.6 67.4 578 117 B G > + 0 0 0 63,-0.3 4,-1.6 2,-0.1 3,-0.3 -0.159 45.3 17.6 75.3-170.6 74.0 -7.8 69.4 579 118 B Y T 4 S+ 0 0 49 35,-0.5 34,-0.1 60,-0.3 63,-0.1 -0.522 122.9 12.5 -74.1 141.9 73.2 -6.7 73.0 580 119 B P T >> S+ 0 0 8 0, 0.0 3,-1.7 0, 0.0 4,-1.1 -0.995 124.9 57.8 -88.2 -2.1 71.7 -8.1 75.1 581 120 B Y T 34>S+ 0 0 0 -3,-0.3 5,-2.3 -4,-0.3 4,-0.4 0.745 97.0 62.5 -62.2 -27.0 71.9 -11.5 73.2 582 121 B V T 3<5S+ 0 0 51 -4,-1.6 -1,-0.3 1,-0.2 -103,-0.2 0.646 108.7 43.2 -76.1 -15.5 75.7 -11.6 73.0 583 122 B T T <45S+ 0 0 55 -3,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.666 111.2 55.0 -94.6 -23.7 76.0 -11.7 76.8 584 123 B L T <5S- 0 0 81 -4,-1.1 -2,-0.2 2,-0.2 -3,-0.1 0.392 112.3-112.1 -90.2 0.2 73.1 -14.2 77.2 585 124 B G T 5S+ 0 0 72 -4,-0.4 2,-0.4 1,-0.3 -3,-0.2 0.773 73.6 138.6 68.0 27.1 74.6 -16.9 74.9 586 125 B I < - 0 0 50 -5,-2.3 -9,-0.3 -6,-0.1 -1,-0.3 -0.897 30.2-175.0-106.4 131.0 71.8 -16.2 72.4 587 126 B K >> - 0 0 118 -2,-0.4 3,-1.2 -3,-0.1 4,-0.7 -0.663 42.0 -94.5-116.7 175.8 72.4 -16.1 68.7 588 127 B K H 3> S+ 0 0 14 -13,-0.5 4,-2.0 -15,-0.3 3,-0.5 0.785 119.5 59.5 -63.6 -30.5 70.1 -15.3 65.7 589 128 B K H 34 S+ 0 0 109 -16,-0.4 -1,-0.3 1,-0.2 5,-0.1 0.683 98.8 59.3 -75.5 -18.9 69.2 -18.9 65.0 590 129 B D H <4 S+ 0 0 72 -3,-1.2 -1,-0.2 1,-0.1 -2,-0.2 0.771 114.5 36.1 -73.1 -29.7 67.7 -19.3 68.5 591 130 B L H < S+ 0 0 14 -4,-0.7 11,-1.0 -3,-0.5 2,-0.5 0.756 122.3 44.2 -91.0 -30.7 65.3 -16.4 67.7 592 131 B I < - 0 0 3 -4,-2.0 2,-0.8 9,-0.1 -1,-0.2 -0.974 64.6-156.2-127.2 123.3 64.6 -17.3 64.0 593 132 B N B >> -X 598 0N 71 5,-2.2 4,-1.4 -2,-0.5 5,-0.9 -0.883 6.9-170.6-100.2 106.7 64.0 -20.7 62.6 594 133 B N T 45S+ 0 0 78 -2,-0.8 -1,-0.2 1,-0.2 5,-0.0 0.814 81.7 53.9 -67.1 -33.3 65.0 -20.6 58.9 595 134 B K T 45S+ 0 0 188 1,-0.2 -1,-0.2 3,-0.1 -2,-0.0 0.915 122.7 25.8 -70.4 -44.8 63.5 -24.0 58.0 596 135 B T T 45S- 0 0 97 2,-0.1 -2,-0.2 0, 0.0 -1,-0.2 0.533 100.0-127.6 -95.0 -10.1 60.0 -23.4 59.4 597 136 B K T <5 + 0 0 113 -4,-1.4 2,-0.5 1,-0.2 -3,-0.2 0.786 52.7 158.6 60.9 33.6 60.0 -19.6 59.0 598 137 B D B < +X 593 0N 78 -5,-0.9 -5,-2.2 1,-0.1 -1,-0.2 -0.769 20.0 166.0 -93.0 124.5 59.0 -19.2 62.6 599 138 B I > + 0 0 10 -2,-0.5 4,-1.7 -7,-0.2 -1,-0.1 -0.110 41.4 112.7-124.6 33.3 59.8 -15.9 64.4 600 139 B S H > S+ 0 0 57 2,-0.2 4,-1.6 1,-0.2 5,-0.1 0.855 79.8 51.3 -75.2 -35.1 57.6 -16.2 67.5 601 140 B K H > S+ 0 0 135 -10,-0.4 4,-1.8 2,-0.2 -1,-0.2 0.844 108.7 52.7 -65.9 -37.1 60.7 -16.4 69.7 602 141 B L H > S+ 0 0 0 -11,-1.0 4,-1.7 2,-0.2 -2,-0.2 0.921 106.4 52.8 -62.6 -45.3 62.0 -13.2 68.0 603 142 B K H X S+ 0 0 92 -4,-1.7 4,-1.4 1,-0.2 -2,-0.2 0.863 108.4 50.2 -61.3 -39.5 58.7 -11.4 68.7 604 143 B L H X S+ 0 0 122 -4,-1.6 4,-1.9 1,-0.2 -1,-0.2 0.924 110.4 48.7 -63.5 -46.6 58.9 -12.2 72.5 605 144 B A H X S+ 0 0 12 -4,-1.8 4,-1.9 1,-0.2 5,-0.4 0.764 106.4 58.6 -67.4 -27.3 62.5 -11.0 72.8 606 145 B L H X S+ 0 0 30 -4,-1.7 4,-1.4 2,-0.2 -1,-0.2 0.886 110.0 43.0 -63.6 -43.9 61.4 -7.7 71.0 607 146 B D H < S+ 0 0 141 -4,-1.4 -2,-0.2 -3,-0.2 -1,-0.2 0.849 114.9 50.1 -71.6 -36.8 58.8 -7.0 73.7 608 147 B K H < S+ 0 0 157 -4,-1.9 -2,-0.2 1,-0.1 -3,-0.2 0.905 124.7 22.6 -72.7 -45.1 61.1 -8.0 76.6 609 148 B Y H < S- 0 0 85 -4,-1.9 -3,-0.2 1,-0.2 -2,-0.2 0.677 93.9-163.3-100.6 -21.4 64.3 -5.9 75.7 610 149 B G < - 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