==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 16-MAY-01 1J79 . COMPND 2 MOLECULE: DIHYDROOROTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR J.B.THODEN,G.N.PHILLIPS JR.,T.M.NEAL,F.M.RAUSHEL,H.M.HOLDEN . 682 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26300.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 491 72.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 68 10.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 36 5.3 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 . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 57 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 86 12.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 187 27.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 17 2.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 2 5 2 2 4 3 1 2 3 1 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 2 8 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 0 0 PARALLEL BRIDGES PER LADDER . 3 6 0 0 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 ANTIPARALLEL BRIDGES PER LADDER . 3 3 0 0 0 0 0 2 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 4 A S 0 0 130 0, 0.0 313,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 71.5 14.4 31.3 104.7 2 5 A Q - 0 0 89 311,-0.2 311,-2.8 310,-0.1 2,-0.4 -0.231 360.0-144.1 -57.8 139.8 18.1 31.1 104.4 3 6 A V E -A 312 0A 74 309,-0.2 2,-0.5 310,-0.1 309,-0.2 -0.880 9.7-162.9-113.3 143.6 20.0 34.3 104.0 4 7 A L E -A 311 0A 25 307,-2.6 307,-3.4 -2,-0.4 2,-0.5 -0.947 10.0-172.5-125.9 103.4 23.1 34.8 101.9 5 8 A K E +A 310 0A 131 -2,-0.5 2,-0.3 305,-0.3 305,-0.2 -0.870 12.7 166.9-103.0 127.0 25.0 38.0 102.7 6 9 A I E -A 309 0A 2 303,-2.2 303,-2.4 -2,-0.5 -2,-0.0 -0.921 44.7 -90.6-134.1 160.3 27.9 39.0 100.5 7 10 A R E S-A 308 0A 87 -2,-0.3 301,-0.3 301,-0.2 299,-0.1 -0.470 70.5 -77.0 -64.1 151.0 30.0 41.9 99.9 8 11 A R - 0 0 83 299,-2.9 297,-0.4 1,-0.1 -1,-0.1 -0.287 60.3-133.2 -51.8 126.4 28.4 44.1 97.1 9 12 A P - 0 0 0 0, 0.0 25,-2.8 0, 0.0 26,-0.4 -0.074 12.6-143.6 -77.1 178.6 29.1 42.4 93.8 10 13 A D - 0 0 0 282,-1.7 2,-0.6 23,-0.2 26,-0.2 -0.959 11.8-130.8-140.0 154.7 30.4 43.8 90.5 11 14 A D E -c 36 0B 0 24,-2.3 26,-2.6 -2,-0.3 234,-0.2 -0.922 15.8-170.0-113.2 106.4 29.6 42.9 86.9 12 15 A W E S+ 0 0 1 232,-2.5 233,-0.2 -2,-0.6 2,-0.2 0.305 76.6 36.8 -79.1 11.6 32.8 42.3 84.9 13 16 A H E S+ 0 0 0 231,-0.1 234,-2.9 160,-0.1 235,-0.6 -0.612 74.6 152.0-162.8 99.8 31.0 42.2 81.6 14 17 A L E -cd 38 248B 1 23,-2.6 25,-3.4 233,-0.2 2,-0.5 -0.982 32.6-152.6-140.7 149.3 28.0 44.3 80.7 15 18 A H + 0 0 8 233,-1.7 23,-0.1 -2,-0.3 -2,-0.0 -0.962 17.2 169.8-115.8 116.1 26.2 45.9 77.7 16 19 A L - 0 0 2 -2,-0.5 9,-0.2 23,-0.3 10,-0.2 0.473 24.8-159.3-104.3 -2.6 24.2 49.0 78.7 17 20 A R - 0 0 45 22,-0.1 2,-0.3 8,-0.1 -1,-0.2 -0.212 23.5-100.3 58.6-145.9 23.4 50.2 75.1 18 21 A D S >> S+ 0 0 52 40,-0.0 4,-1.7 41,-0.0 3,-0.9 -0.928 70.1 21.6-159.1-177.2 22.5 53.8 74.9 19 22 A G H 3> S- 0 0 38 -2,-0.3 4,-1.5 1,-0.2 0, 0.0 -0.183 123.6 -9.0 52.3-135.3 19.8 56.4 74.6 20 23 A D H 3> S+ 0 0 88 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.881 137.6 54.7 -63.1 -42.3 16.4 55.3 75.8 21 24 A M H <> S+ 0 0 39 -3,-0.9 4,-2.4 1,-0.2 5,-0.2 0.903 105.2 53.6 -58.3 -42.7 17.4 51.7 76.2 22 25 A L H X S+ 0 0 2 -4,-1.7 4,-2.5 1,-0.2 -1,-0.2 0.917 105.3 55.1 -58.0 -43.8 20.2 52.7 78.4 23 26 A K H < S+ 0 0 130 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.903 111.0 43.9 -59.6 -41.1 17.8 54.6 80.6 24 27 A T H < S+ 0 0 31 -4,-1.8 4,-0.3 1,-0.1 -1,-0.2 0.884 118.9 41.4 -71.3 -41.3 15.6 51.5 81.2 25 28 A V H >X S+ 0 0 3 -4,-2.4 3,-1.3 -9,-0.2 4,-0.8 0.830 95.4 73.4 -81.6 -33.1 18.4 49.0 81.8 26 29 A V H >X S+ 0 0 0 -4,-2.5 4,-2.7 1,-0.3 3,-2.4 0.923 90.6 58.6 -45.5 -56.1 20.9 50.9 83.9 27 30 A P H 3> S+ 0 0 34 0, 0.0 4,-1.4 0, 0.0 -1,-0.3 0.758 97.0 62.4 -48.8 -30.7 18.8 50.7 87.1 28 31 A Y H <4 S+ 0 0 69 -3,-1.3 4,-0.2 -4,-0.3 -2,-0.2 0.800 115.9 31.7 -68.3 -26.6 18.7 46.9 87.0 29 32 A T H XX S+ 0 0 1 -3,-2.4 4,-3.1 -4,-0.8 3,-1.5 0.874 116.3 54.4 -91.6 -51.5 22.5 46.9 87.4 30 33 A S H 3< S+ 0 0 3 -4,-2.7 38,-0.2 1,-0.3 -2,-0.2 0.726 100.3 62.3 -57.3 -25.3 23.1 50.0 89.5 31 34 A E T 3< S+ 0 0 117 -4,-1.4 -1,-0.3 -5,-0.3 -2,-0.1 0.817 122.3 17.8 -69.1 -31.4 20.7 48.8 92.2 32 35 A I T <4 S+ 0 0 19 -3,-1.5 2,-0.3 -4,-0.2 -2,-0.2 0.791 110.4 66.7-108.2 -48.0 22.9 45.8 92.8 33 36 A Y < - 0 0 3 -4,-3.1 -23,-0.2 1,-0.1 37,-0.1 -0.698 55.4-152.0 -91.7 141.8 26.4 46.1 91.6 34 37 A G S S- 0 0 9 -25,-2.8 36,-2.6 -2,-0.3 2,-0.3 0.913 82.8 -0.9 -72.0 -47.7 29.1 48.5 92.8 35 38 A R E - e 0 70B 23 -26,-0.4 -24,-2.3 34,-0.2 2,-0.3 -0.924 64.6-163.6-137.9 164.6 30.9 48.7 89.5 36 39 A A E -ce 11 71B 0 34,-1.4 36,-3.3 -2,-0.3 2,-0.7 -0.989 27.1-120.1-151.0 144.1 30.6 47.1 86.1 37 40 A I E - e 0 72B 0 -26,-2.6 -23,-2.6 -2,-0.3 2,-0.7 -0.745 35.6-147.5 -83.1 114.5 32.8 46.7 83.0 38 41 A V E -ce 14 73B 1 34,-3.0 36,-0.6 -2,-0.7 -23,-0.2 -0.802 10.4-131.0 -92.2 116.9 30.8 48.6 80.3 39 42 A M - 0 0 1 -25,-3.4 -23,-0.3 -2,-0.7 -22,-0.1 -0.286 5.1-142.7 -66.5 148.7 31.2 47.1 76.8 40 43 A P + 0 0 1 0, 0.0 2,-2.4 0, 0.0 6,-2.4 0.308 61.4 118.5 -97.0 5.4 32.1 49.5 74.0 41 44 A N + 0 0 55 4,-0.2 2,-0.1 34,-0.1 -2,-0.1 -0.223 38.1 137.0 -72.3 49.2 30.1 47.9 71.2 42 45 A L - 0 0 31 -2,-2.4 4,-0.0 2,-0.2 -24,-0.0 -0.284 66.8 -76.9 -82.2-179.6 27.9 50.9 70.5 43 46 A A S S+ 0 0 103 1,-0.4 -2,-0.1 2,-0.1 3,-0.0 -0.908 132.3 19.1-120.8 97.0 26.9 52.1 67.0 44 47 A P S S- 0 0 94 0, 0.0 -1,-0.4 0, 0.0 -2,-0.2 0.563 116.8-113.0 -82.9 163.6 29.4 53.5 66.3 45 48 A P - 0 0 15 0, 0.0 2,-1.0 0, 0.0 -4,-0.2 -0.065 23.3-103.7 -58.2 158.7 31.8 51.9 68.7 46 49 A V + 0 0 7 -6,-2.4 30,-3.0 1,-0.2 3,-0.1 -0.755 60.9 143.0 -86.2 101.6 33.6 53.7 71.7 47 50 A T + 0 0 31 -2,-1.0 2,-0.4 28,-0.2 -1,-0.2 0.300 50.0 68.3-124.8 4.6 37.0 54.0 70.3 48 51 A T S > S- 0 0 49 1,-0.1 4,-2.4 -3,-0.1 3,-0.4 -0.976 74.7-129.5-131.4 147.2 38.0 57.4 71.7 49 52 A V H > S+ 0 0 3 -2,-0.4 4,-2.4 1,-0.3 5,-0.1 0.884 114.3 53.2 -51.0 -42.5 38.7 58.8 75.1 50 53 A E H > S+ 0 0 154 2,-0.2 4,-1.7 1,-0.2 -1,-0.3 0.835 107.7 46.7 -64.9 -40.3 36.3 61.5 74.3 51 54 A A H > S+ 0 0 35 -3,-0.4 4,-2.6 2,-0.2 -1,-0.2 0.869 112.2 53.7 -71.4 -34.1 33.4 59.1 73.3 52 55 A A H X S+ 0 0 0 -4,-2.4 4,-3.0 2,-0.2 -2,-0.2 0.921 106.9 50.0 -64.1 -45.8 34.1 57.2 76.5 53 56 A V H X S+ 0 0 65 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.949 113.6 44.9 -61.1 -47.7 33.8 60.3 78.7 54 57 A A H X S+ 0 0 37 -4,-1.7 4,-1.9 2,-0.2 -2,-0.2 0.886 113.9 50.0 -65.1 -38.4 30.5 61.3 77.1 55 58 A Y H X S+ 0 0 2 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.947 107.6 53.2 -65.7 -44.9 29.2 57.7 77.3 56 59 A R H X S+ 0 0 72 -4,-3.0 4,-2.6 1,-0.2 5,-0.2 0.922 108.4 52.7 -55.2 -40.8 30.2 57.4 81.0 57 60 A Q H X S+ 0 0 98 -4,-2.0 4,-2.8 1,-0.2 -1,-0.2 0.919 105.7 51.6 -60.6 -45.4 28.2 60.6 81.6 58 61 A R H X S+ 0 0 84 -4,-1.9 4,-1.3 2,-0.2 -1,-0.2 0.885 110.1 51.1 -58.5 -39.1 25.1 59.4 80.0 59 62 A I H >X S+ 0 0 0 -4,-2.2 3,-1.2 2,-0.2 4,-0.7 0.984 109.8 48.3 -62.7 -55.6 25.3 56.3 82.1 60 63 A L H >< S+ 0 0 82 -4,-2.6 3,-1.6 1,-0.3 -2,-0.2 0.913 106.6 58.1 -51.0 -44.2 25.7 58.3 85.3 61 64 A D H 3< S+ 0 0 108 -4,-2.8 -1,-0.3 1,-0.3 -2,-0.2 0.870 106.2 50.1 -56.4 -35.3 22.7 60.4 84.3 62 65 A A H << S+ 0 0 19 -4,-1.3 -1,-0.3 -3,-1.2 -2,-0.2 0.520 84.5 105.1 -85.9 -2.9 20.6 57.3 84.1 63 66 A V S << S- 0 0 23 -3,-1.6 -40,-0.0 -4,-0.7 -37,-0.0 -0.634 78.9-112.1 -79.4 128.5 21.5 56.0 87.5 64 67 A P > - 0 0 42 0, 0.0 3,-1.2 0, 0.0 -1,-0.1 -0.300 33.7-103.7 -61.2 139.6 18.7 56.4 90.1 65 68 A A T 3 S+ 0 0 106 1,-0.3 -2,-0.1 3,-0.1 -3,-0.0 0.713 115.0 44.0 -23.0 -62.5 19.6 58.8 92.9 66 69 A P T 3 S+ 0 0 109 0, 0.0 -1,-0.3 0, 0.0 -3,-0.0 0.863 88.1 104.6 -61.2 -44.0 20.3 56.4 95.7 67 70 A H < - 0 0 41 -3,-1.2 2,-1.1 1,-0.1 -36,-0.1 -0.207 58.0-152.7 -49.7 123.9 22.4 53.9 93.7 68 71 A D + 0 0 120 -38,-0.2 2,-0.4 -37,-0.1 -1,-0.1 -0.789 39.2 155.1 -97.5 89.6 26.2 54.0 94.3 69 72 A F - 0 0 9 -2,-1.1 -34,-0.2 -9,-0.1 -35,-0.1 -0.967 29.3-166.6-126.1 136.6 27.3 52.8 90.9 70 73 A T E -e 35 0B 66 -36,-2.6 -34,-1.4 -2,-0.4 2,-0.4 -0.958 12.4-148.3-125.3 117.7 30.5 53.2 88.9 71 74 A P E -e 36 0B 3 0, 0.0 2,-0.7 0, 0.0 -34,-0.2 -0.671 8.7-152.0 -80.7 129.3 30.7 52.3 85.3 72 75 A L E -e 37 0B 21 -36,-3.3 -34,-3.0 -2,-0.4 23,-0.1 -0.920 22.3-141.2-104.4 111.5 34.2 51.1 84.2 73 76 A M E -ef 38 95B 2 -2,-0.7 23,-2.9 21,-0.6 24,-1.2 -0.246 14.7-160.6 -77.9 158.4 34.7 52.0 80.6 74 77 A T E - f 0 97B 2 -36,-0.6 2,-0.4 21,-0.2 24,-0.2 -0.944 14.9-127.7-136.1 158.3 36.4 50.1 77.8 75 78 A C E - f 0 98B 0 22,-1.8 24,-3.1 -2,-0.3 2,-0.6 -0.868 21.5-129.3-106.7 136.0 37.8 50.9 74.4 76 79 A Y E - f 0 99B 39 -30,-3.0 2,-0.3 -2,-0.4 24,-0.2 -0.732 29.5-126.9 -81.8 119.1 36.8 48.9 71.3 77 80 A L + 0 0 2 22,-2.9 24,-0.3 -2,-0.6 2,-0.3 -0.543 36.6 171.4 -71.7 133.3 40.0 47.7 69.6 78 81 A T > - 0 0 6 -2,-0.3 3,-2.1 -31,-0.1 35,-0.3 -0.972 46.3-113.0-140.4 150.8 40.2 48.7 65.9 79 82 A D T 3 S+ 0 0 50 33,-2.8 31,-0.1 -2,-0.3 34,-0.1 0.762 118.5 45.8 -50.9 -31.0 42.9 48.5 63.2 80 83 A S T 3 S+ 0 0 70 29,-1.5 -1,-0.3 32,-0.3 2,-0.2 0.397 79.7 125.2 -97.5 0.1 43.0 52.2 63.1 81 84 A L < - 0 0 19 -3,-2.1 41,-0.1 28,-0.2 -33,-0.1 -0.410 62.3-126.3 -65.5 133.9 43.0 53.0 66.8 82 85 A D >> - 0 0 84 -2,-0.2 3,-3.3 1,-0.2 4,-1.5 -0.681 10.9-142.9 -81.6 112.5 45.9 55.2 67.8 83 86 A P H 3> S+ 0 0 21 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.792 101.6 56.6 -45.5 -31.1 47.8 53.5 70.7 84 87 A N H 3> S+ 0 0 89 2,-0.2 4,-1.9 1,-0.2 5,-0.2 0.728 101.9 55.8 -75.9 -18.4 48.4 56.8 72.3 85 88 A E H <> S+ 0 0 44 -3,-3.3 4,-2.2 2,-0.2 -1,-0.2 0.923 109.5 45.5 -74.8 -38.8 44.7 57.3 72.3 86 89 A L H X S+ 0 0 0 -4,-1.5 4,-1.8 2,-0.2 -2,-0.2 0.891 114.1 49.1 -65.7 -44.2 44.4 54.1 74.2 87 90 A E H X S+ 0 0 60 -4,-2.4 4,-3.8 -5,-0.2 5,-0.2 0.906 109.3 51.6 -65.5 -42.9 47.2 55.0 76.6 88 91 A R H X S+ 0 0 111 -4,-1.9 4,-3.0 2,-0.2 6,-0.3 0.945 110.2 48.1 -56.9 -54.5 45.8 58.5 77.3 89 92 A G H <>S+ 0 0 0 -4,-2.2 5,-3.0 2,-0.2 6,-1.1 0.874 116.0 45.0 -56.3 -41.5 42.4 57.1 78.2 90 93 A F H ><5S+ 0 0 49 -4,-1.8 3,-2.7 4,-0.2 -2,-0.2 0.974 112.8 49.7 -66.8 -54.6 44.0 54.5 80.4 91 94 A N H 3<5S+ 0 0 100 -4,-3.8 -2,-0.2 1,-0.3 -1,-0.2 0.867 111.7 50.0 -53.4 -37.3 46.4 57.0 82.0 92 95 A E T 3<5S- 0 0 103 -4,-3.0 -1,-0.3 -5,-0.2 -2,-0.2 0.310 116.7-114.8 -85.6 11.4 43.4 59.3 82.7 93 96 A G T < 5S+ 0 0 46 -3,-2.7 -3,-0.2 2,-0.2 -20,-0.2 0.655 87.0 116.1 66.0 17.3 41.5 56.5 84.2 94 97 A V S - 0 0 59 9,-1.2 3,-0.8 -2,-0.3 37,-0.0 -0.967 23.2-144.6-122.2 142.9 36.7 39.8 60.3 105 108 A A T 3 S+ 0 0 85 -2,-0.4 -1,-0.1 1,-0.2 9,-0.1 0.854 103.2 57.5 -75.2 -27.1 38.5 40.5 57.1 106 109 A T T 3 S+ 0 0 129 -3,-0.1 2,-0.3 2,-0.1 -1,-0.2 0.449 83.6 124.0 -77.0 -3.0 35.5 42.4 55.8 107 110 A T < - 0 0 38 -3,-0.8 5,-0.1 6,-0.2 7,-0.0 -0.448 67.8-120.1 -71.6 128.4 35.6 44.7 58.8 108 111 A N >> - 0 0 90 -2,-0.3 3,-2.0 1,-0.1 4,-0.8 -0.299 27.3-119.7 -57.2 139.6 35.8 48.4 58.3 109 112 A S T 34 S+ 0 0 62 1,-0.3 -29,-1.5 2,-0.2 -28,-0.2 0.738 111.7 51.1 -59.1 -23.2 39.1 49.7 59.9 110 113 A S T 34 S+ 0 0 51 1,-0.2 -1,-0.3 -31,-0.1 3,-0.1 0.429 113.5 44.8 -94.8 1.9 37.2 52.0 62.2 111 114 A H T <4 S- 0 0 80 -3,-2.0 2,-0.3 1,-0.2 -2,-0.2 0.402 119.7 -17.6-122.6 -2.3 34.9 49.3 63.5 112 115 A G < - 0 0 6 -4,-0.8 -33,-2.8 -5,-0.1 2,-0.4 -0.985 68.1 -75.0-178.0-171.3 37.1 46.4 64.1 113 116 A V - 0 0 2 -2,-0.3 -9,-1.2 -35,-0.3 -6,-0.2 -0.892 16.6-160.6-113.1 137.3 40.3 44.4 63.7 114 117 A T S S- 0 0 52 1,-0.4 2,-0.3 -2,-0.4 -1,-0.1 0.774 79.0 -20.7 -87.5 -25.6 41.3 42.5 60.6 115 118 A S > - 0 0 48 1,-0.1 4,-0.5 -10,-0.0 -1,-0.4 -0.947 62.4-107.8-172.1 160.9 43.8 40.4 62.5 116 119 A V T >4 S+ 0 0 33 -2,-0.3 3,-1.4 1,-0.2 7,-0.2 0.898 115.9 57.8 -68.2 -39.4 45.8 40.4 65.7 117 120 A D G >4 S+ 0 0 103 1,-0.3 3,-1.9 2,-0.2 -1,-0.2 0.893 99.2 62.0 -59.2 -35.1 49.1 41.1 64.0 118 121 A A G 34 S+ 0 0 44 1,-0.3 -1,-0.3 2,-0.1 -2,-0.2 0.771 107.3 43.4 -64.0 -20.4 47.5 44.2 62.6 119 122 A I G S+ 0 0 11 -3,-1.9 4,-3.2 1,-0.2 5,-0.3 0.920 72.9 56.9 -57.2 -43.9 50.4 44.6 67.5 121 124 A P H > S+ 0 0 81 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.888 109.4 45.6 -56.0 -41.7 51.2 48.2 68.2 122 125 A V H > S+ 0 0 7 -3,-0.2 4,-1.5 2,-0.2 -2,-0.2 0.943 112.7 49.7 -67.7 -46.2 48.1 48.6 70.3 123 126 A L H >X S+ 0 0 0 -4,-2.3 4,-2.9 1,-0.2 3,-0.8 0.948 107.8 53.8 -58.8 -46.6 48.6 45.4 72.2 124 127 A E H 3X S+ 0 0 71 -4,-3.2 4,-2.6 1,-0.3 -1,-0.2 0.887 105.7 52.7 -58.9 -37.1 52.1 46.2 73.0 125 128 A R H 3X S+ 0 0 69 -4,-1.6 4,-2.4 -5,-0.3 -1,-0.3 0.851 110.3 49.4 -68.1 -27.1 51.2 49.4 74.5 126 129 A M H S+ 0 0 0 -4,-1.5 5,-2.9 -3,-0.8 4,-1.5 0.903 110.8 48.0 -74.1 -45.4 48.6 47.6 76.7 127 130 A E H <5S+ 0 0 35 -4,-2.9 3,-0.3 3,-0.2 -2,-0.2 0.957 115.1 48.8 -57.9 -46.4 51.1 45.0 77.8 128 131 A K H <5S+ 0 0 139 -4,-2.6 -2,-0.2 -5,-0.3 -1,-0.2 0.900 116.3 37.6 -61.3 -46.1 53.4 47.9 78.5 129 132 A I H <5S- 0 0 42 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.606 114.1-114.4 -83.2 -8.4 51.1 50.1 80.5 130 133 A G T <5 + 0 0 29 -4,-1.5 -3,-0.2 -3,-0.3 -4,-0.1 0.899 56.5 163.4 75.7 45.0 49.6 47.0 82.1 131 134 A M < - 0 0 0 -5,-2.9 38,-0.3 -6,-0.1 -1,-0.2 -0.837 38.1-122.3 -96.6 127.4 46.1 47.4 80.6 132 135 A P - 0 0 4 0, 0.0 -34,-1.8 0, 0.0 2,-0.5 -0.482 18.8-141.3 -72.1 142.9 44.0 44.3 80.7 133 136 A L E -gh 98 170B 0 36,-2.8 38,-2.8 -36,-0.2 2,-0.5 -0.912 8.3-154.6-104.6 124.6 42.7 42.9 77.4 134 137 A L E -gh 99 171B 0 -36,-3.4 -34,-2.6 -2,-0.5 2,-0.5 -0.894 16.3-159.4-101.2 128.8 39.2 41.5 77.4 135 138 A V E -gh 100 172B 0 36,-2.8 38,-1.8 -2,-0.5 2,-1.1 -0.942 25.6-156.8-120.9 130.4 38.7 38.9 74.7 136 139 A H - 0 0 15 -36,-2.3 2,-1.5 -2,-0.5 38,-0.1 -0.866 33.7-148.7 -94.2 98.3 35.6 37.6 73.0 137 140 A G + 0 0 1 -2,-1.1 2,-0.3 36,-0.4 16,-0.3 -0.558 47.4 113.9 -81.8 80.6 37.3 34.3 72.0 138 141 A E - 0 0 11 -2,-1.5 2,-0.5 15,-0.1 -35,-0.2 -0.997 54.7-139.9-144.1 141.6 35.8 33.1 68.7 139 142 A V - 0 0 9 10,-1.1 13,-0.1 -2,-0.3 14,-0.1 -0.889 17.6-157.7 -99.6 127.8 37.2 32.7 65.2 140 143 A T + 0 0 48 -2,-0.5 2,-0.1 -37,-0.4 -1,-0.1 0.246 35.1 144.5 -95.4 15.2 34.5 33.8 62.8 141 144 A H > - 0 0 77 1,-0.1 3,-3.8 2,-0.1 -2,-0.1 -0.317 52.6-131.7 -59.2 127.4 35.5 32.0 59.5 142 145 A A T 3 S+ 0 0 92 1,-0.3 -1,-0.1 -2,-0.1 4,-0.1 0.769 106.5 60.0 -51.5 -29.1 32.4 30.9 57.5 143 146 A D T 3 S+ 0 0 138 2,-0.1 2,-0.5 423,-0.0 -1,-0.3 0.522 87.6 93.4 -82.4 1.6 33.9 27.6 57.2 144 147 A I S < S- 0 0 14 -3,-3.8 5,-0.1 2,-0.0 2,-0.0 -0.822 82.9-116.9 -99.2 132.0 34.0 27.1 60.9 145 148 A D >> - 0 0 11 -2,-0.5 3,-2.6 1,-0.1 4,-0.6 -0.336 25.0-125.4 -58.6 130.4 31.1 25.3 62.6 146 149 A I G >4 S+ 0 0 3 1,-0.3 3,-1.1 2,-0.2 4,-0.3 0.867 110.6 53.8 -46.2 -41.8 29.4 27.8 65.0 147 150 A F G 34 S+ 0 0 16 1,-0.2 4,-0.3 2,-0.1 -1,-0.3 0.669 106.9 52.1 -70.7 -13.5 29.9 25.4 67.9 148 151 A D G <> S+ 0 0 62 -3,-2.6 4,-2.1 1,-0.1 -1,-0.2 0.439 81.3 94.9-100.2 -3.2 33.6 25.0 67.2 149 152 A R H > S+ 0 0 0 -4,-0.3 4,-1.7 -12,-0.2 3,-1.0 0.978 112.9 46.2 -71.0 -53.5 35.6 29.1 70.8 151 154 A A H 3> S+ 0 0 16 -4,-0.3 4,-1.3 1,-0.3 5,-0.2 0.882 111.2 52.9 -56.2 -40.9 37.9 26.1 70.8 152 155 A R H 3X S+ 0 0 82 -4,-2.1 4,-1.7 1,-0.2 -1,-0.3 0.743 103.8 58.6 -67.4 -23.6 39.4 27.0 67.5 153 156 A F H S+ 0 0 8 -3,-1.0 4,-3.0 -4,-0.8 5,-2.1 0.926 99.6 58.3 -71.7 -41.6 40.1 30.5 69.0 154 157 A I H <>S+ 0 0 20 -4,-1.7 5,-2.4 -17,-0.2 -2,-0.2 0.954 114.9 32.8 -47.6 -62.2 42.2 28.9 71.8 155 158 A E H <5S+ 0 0 135 -4,-1.3 -1,-0.2 1,-0.2 -2,-0.2 0.817 126.4 39.9 -67.0 -37.9 44.7 27.2 69.4 156 159 A S H <5S+ 0 0 47 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.802 134.9 3.3 -88.0 -31.8 44.7 29.7 66.7 157 160 A V T X5S+ 0 0 33 -4,-3.0 4,-2.6 -5,-0.2 5,-0.2 0.742 120.1 54.3-119.7 -52.8 44.7 33.0 68.5 158 161 A M H > S+ 0 0 58 0, 0.0 4,-2.8 0, 0.0 -1,-0.2 0.897 112.5 50.8 -46.5 -52.8 50.0 32.4 70.3 161 164 A L H X S+ 0 0 10 -4,-2.6 4,-2.1 1,-0.3 -2,-0.2 0.872 111.5 46.9 -55.9 -42.0 48.9 35.9 71.3 162 165 A R H < S+ 0 0 34 -4,-2.5 -1,-0.3 -3,-0.3 -3,-0.2 0.860 109.6 56.9 -70.8 -29.7 49.7 35.1 74.9 163 166 A Q H < S+ 0 0 135 -4,-2.8 3,-0.4 -5,-0.3 -2,-0.2 0.941 110.2 42.0 -66.1 -43.0 53.0 33.8 73.6 164 167 A R H < S+ 0 0 127 -4,-2.8 2,-0.4 1,-0.2 -2,-0.2 0.826 120.8 42.2 -74.6 -28.2 53.9 37.0 71.9 165 168 A L >< + 0 0 3 -4,-2.1 3,-1.3 -5,-0.2 -1,-0.2 -0.601 68.1 170.3-119.0 73.1 52.7 39.3 74.8 166 169 A T T 3 S+ 0 0 106 -3,-0.4 -1,-0.1 -2,-0.4 -2,-0.1 0.689 77.5 44.3 -57.3 -23.1 54.0 37.5 78.0 167 170 A A T 3 S+ 0 0 35 2,-0.1 -1,-0.3 23,-0.0 2,-0.1 0.658 85.4 115.3 -99.2 -9.7 53.2 40.3 80.4 168 171 A L < - 0 0 7 -3,-1.3 2,-0.4 -6,-0.2 -41,-0.1 -0.382 61.2-136.6 -63.0 132.6 49.7 41.1 79.0 169 172 A K - 0 0 52 -38,-0.3 -36,-2.8 -43,-0.2 2,-0.4 -0.759 29.1-170.7 -87.9 129.9 46.8 40.5 81.5 170 173 A V E -hi 133 191B 0 20,-2.9 22,-2.4 -2,-0.4 2,-0.6 -0.983 21.1-157.6-131.9 136.3 43.9 38.8 79.6 171 174 A V E -hi 134 192B 0 -38,-2.8 -36,-2.8 -2,-0.4 2,-1.3 -0.924 14.3-147.4-110.1 122.7 40.3 38.0 80.5 172 175 A F E -hi 135 193B 1 20,-3.0 22,-1.6 -2,-0.6 3,-0.5 -0.745 31.5-139.2 -85.4 96.5 38.7 35.2 78.4 173 176 A E - 0 0 0 -38,-1.8 -36,-0.4 -2,-1.3 22,-0.1 -0.223 62.1 -12.3 -62.4 153.7 35.2 36.6 78.4 174 177 A H S S- 0 0 1 1,-0.1 21,-0.2 -38,-0.1 -1,-0.2 0.713 76.9-155.4 20.0 76.4 32.1 34.4 78.8 175 178 A I + 0 0 0 19,-2.1 21,-0.3 -3,-0.5 -1,-0.1 -0.419 19.9 176.1 -73.6 144.8 33.7 31.0 78.4 176 179 A T + 0 0 2 -2,-0.1 2,-0.3 19,-0.1 47,-0.3 0.380 49.6 71.8-131.7 5.1 31.3 28.4 77.2 177 180 A T S > S- 0 0 2 1,-0.1 4,-2.2 53,-0.1 5,-0.1 -0.831 72.0-129.8-126.1 160.5 33.4 25.3 76.7 178 181 A K H > S+ 0 0 94 -2,-0.3 4,-3.0 1,-0.2 5,-0.3 0.834 114.0 63.0 -70.8 -26.6 35.3 22.7 78.6 179 182 A D H > S+ 0 0 70 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.949 108.5 38.2 -57.0 -49.8 38.1 23.6 76.3 180 183 A A H > S+ 0 0 0 2,-0.2 4,-2.8 1,-0.2 5,-0.3 0.861 113.3 56.8 -70.8 -38.2 38.1 27.1 77.6 181 184 A A H X S+ 0 0 1 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.938 110.3 43.0 -61.0 -47.4 37.6 26.0 81.1 182 185 A D H X S+ 0 0 38 -4,-3.0 4,-2.0 2,-0.2 -2,-0.2 0.916 113.6 53.2 -65.5 -42.7 40.6 23.7 81.1 183 186 A Y H < S+ 0 0 36 -4,-2.1 3,-0.3 -5,-0.3 -2,-0.2 0.963 113.9 40.8 -55.4 -55.7 42.7 26.3 79.3 184 187 A V H >< S+ 0 0 0 -4,-2.8 3,-2.0 1,-0.2 -1,-0.2 0.935 111.8 56.0 -61.0 -48.8 42.0 29.0 81.9 185 188 A R H 3< S+ 0 0 119 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.827 112.7 42.1 -52.7 -36.2 42.2 26.6 84.8 186 189 A D T 3< S+ 0 0 121 -4,-2.0 -1,-0.3 -3,-0.3 -2,-0.2 0.260 100.1 102.7 -96.2 8.7 45.7 25.6 83.8 187 190 A G S < S- 0 0 22 -3,-2.0 2,-0.1 -4,-0.2 -3,-0.1 -0.155 72.7 -90.9 -85.7-176.8 46.8 29.1 82.9 188 191 A N > - 0 0 60 1,-0.1 3,-2.7 4,-0.0 -1,-0.1 -0.372 43.8 -91.5 -91.1 171.4 49.0 31.7 84.7 189 192 A E T 3 S+ 0 0 145 1,-0.3 -1,-0.1 -2,-0.1 -2,-0.0 0.562 124.0 64.9 -56.4 -9.5 48.1 34.5 87.1 190 193 A R T 3 S+ 0 0 100 -21,-0.1 -20,-2.9 -24,-0.1 2,-0.4 0.332 91.4 73.6 -98.1 4.8 47.8 36.7 84.0 191 194 A L E < +i 170 0B 0 -3,-2.7 2,-0.2 -22,-0.2 -20,-0.2 -0.976 54.7 155.8-124.5 125.1 44.8 34.8 82.6 192 195 A A E -i 171 0B 0 -22,-2.4 -20,-3.0 -2,-0.4 2,-0.3 -0.758 20.0-150.3-132.9-179.8 41.2 35.0 84.0 193 196 A A E -ij 172 242B 0 48,-1.8 50,-1.8 -22,-0.3 2,-0.3 -0.990 7.7-140.7-152.4 157.6 37.7 34.3 82.6 194 197 A T E - j 0 243B 0 -22,-1.6 -19,-2.1 -2,-0.3 2,-0.4 -0.875 15.2-160.2-117.2 149.6 34.0 35.5 83.1 195 198 A I E - j 0 244B 0 48,-1.1 50,-1.1 -2,-0.3 -19,-0.1 -0.998 10.6-138.9-132.0 133.7 31.0 33.1 83.0 196 199 A T > - 0 0 0 -2,-0.4 4,-0.7 -21,-0.3 50,-0.2 -0.461 22.7-118.0 -85.9 163.6 27.4 34.2 82.4 197 200 A P H >> S+ 0 0 0 0, 0.0 4,-2.7 0, 0.0 3,-0.9 0.909 112.3 57.3 -68.8 -39.5 24.5 32.7 84.2 198 201 A Q H 3> S+ 0 0 0 48,-0.3 4,-2.6 1,-0.3 48,-0.0 0.892 103.5 53.1 -59.5 -38.7 22.9 31.3 81.0 199 202 A H H 34 S+ 0 0 5 1,-0.2 -1,-0.3 2,-0.2 33,-0.2 0.733 114.5 42.4 -71.2 -17.9 26.1 29.3 80.3 200 203 A L H << S+ 0 0 0 -3,-0.9 -2,-0.2 -4,-0.7 -1,-0.2 0.767 119.2 42.9 -92.8 -32.8 25.9 27.8 83.8 201 204 A M H < S+ 0 0 39 -4,-2.7 2,-0.3 -5,-0.2 -2,-0.2 0.831 118.0 26.3 -83.4 -30.1 22.2 27.2 83.8 202 205 A F < - 0 0 36 -4,-2.6 2,-0.2 -5,-0.2 21,-0.2 -0.819 52.9-154.6-132.0 172.5 21.6 25.8 80.4 203 206 A N >> - 0 0 13 -2,-0.3 3,-1.3 19,-0.1 4,-0.6 -0.782 51.9 -82.3-132.0 177.0 23.0 23.9 77.4 204 207 A R H >> S+ 0 0 6 19,-2.8 4,-1.4 1,-0.3 3,-1.0 0.807 122.2 69.5 -54.2 -28.5 22.0 24.0 73.7 205 208 A N H >> S+ 0 0 17 18,-0.3 4,-2.9 1,-0.3 3,-0.5 0.900 94.5 55.1 -56.8 -41.0 19.2 21.5 74.4 206 209 A H H <4 S+ 0 0 76 -3,-1.3 -1,-0.3 1,-0.2 -2,-0.2 0.754 110.3 46.7 -61.9 -26.7 17.3 24.2 76.4 207 210 A M H << S+ 0 0 1 -3,-1.0 6,-2.4 -4,-0.6 -1,-0.2 0.645 126.6 23.7 -88.1 -22.9 17.5 26.5 73.3 208 211 A L H X< S+ 0 0 1 -4,-1.4 3,-0.7 -3,-0.5 2,-0.6 0.551 92.4 94.1-125.3 -11.7 16.4 23.9 70.7 209 212 A V T 3< S+ 0 0 41 -4,-2.9 -1,-0.0 -5,-0.3 274,-0.0 -0.744 100.0 6.7 -90.9 127.4 14.4 21.2 72.2 210 213 A G T 3 S- 0 0 65 -2,-0.6 -1,-0.2 -3,-0.0 2,-0.2 0.515 138.9 -18.3 87.7 3.5 10.7 21.6 72.1 211 214 A G S < S- 0 0 4 -3,-0.7 2,-0.5 392,-0.1 392,-0.2 -0.647 84.2 -78.3 141.9 161.4 11.0 24.8 70.0 212 215 A V B -K 602 0C 4 390,-1.7 390,-2.3 -2,-0.2 -4,-0.2 -0.779 41.5-160.9 -90.2 126.3 13.6 27.4 69.1 213 216 A R > - 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0 0 3 -3,-1.8 2,-0.6 -6,-0.3 -41,-0.1 -0.537 55.3-140.1 -72.8 129.2 9.3 -4.9 57.0 510 172 B K - 0 0 54 -38,-0.4 -36,-3.3 -2,-0.3 2,-0.5 -0.814 26.9-171.9 -94.4 125.1 9.5 -2.1 54.4 511 173 B V E -vw 474 532H 0 20,-2.6 22,-3.0 -2,-0.6 2,-0.6 -0.948 23.3-161.7-127.5 132.4 10.8 1.0 56.0 512 174 B V E -vw 475 533H 0 -38,-3.0 -36,-2.7 -2,-0.5 2,-1.3 -0.921 15.8-149.0-106.8 118.8 11.2 4.6 54.9 513 175 B F E -vw 476 534H 0 20,-4.1 22,-1.5 -2,-0.6 3,-0.5 -0.757 30.0-138.8 -86.4 93.9 13.7 6.5 57.1 514 176 B E - 0 0 0 -38,-1.5 -36,-0.4 -2,-1.3 22,-0.1 -0.142 61.6 -12.0 -58.4 151.6 12.1 9.9 56.8 515 177 B H S S- 0 0 2 1,-0.1 21,-0.2 71,-0.1 -1,-0.2 0.739 77.1-156.3 22.5 70.4 14.0 13.2 56.3 516 178 B I + 0 0 0 19,-2.4 21,-0.3 -3,-0.5 -1,-0.1 -0.399 20.2 175.8 -69.3 146.8 17.4 11.9 57.1 517 179 B T + 0 0 2 19,-0.1 2,-0.3 -2,-0.1 47,-0.3 0.439 48.2 71.6-130.5 -2.7 19.9 14.6 58.2 518 180 B T S > S- 0 0 3 1,-0.1 4,-2.4 53,-0.1 5,-0.1 -0.851 72.1-126.9-124.1 159.6 23.2 12.8 59.2 519 181 B K H > S+ 0 0 84 -2,-0.3 4,-2.6 2,-0.2 5,-0.3 0.894 113.9 60.5 -62.0 -40.5 26.1 11.0 57.6 520 182 B D H > S+ 0 0 74 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.966 109.5 39.3 -49.0 -62.1 25.3 8.2 60.0 521 183 B A H > S+ 0 0 0 2,-0.2 4,-2.3 1,-0.2 5,-0.3 0.839 112.0 58.3 -58.2 -38.0 21.8 7.8 58.4 522 184 B A H X S+ 0 0 2 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.956 111.4 41.0 -56.2 -54.0 23.2 8.4 54.9 523 185 B D H X S+ 0 0 42 -4,-2.6 4,-1.4 2,-0.2 -2,-0.2 0.855 112.5 54.5 -61.6 -43.9 25.6 5.5 55.2 524 186 B Y H < S+ 0 0 41 -4,-2.3 -1,-0.2 -5,-0.3 -2,-0.2 0.914 113.5 42.0 -60.0 -44.4 23.1 3.2 57.0 525 187 B V H >< S+ 0 0 0 -4,-2.3 3,-2.1 1,-0.2 -2,-0.2 0.943 110.5 56.6 -67.5 -48.2 20.5 3.6 54.2 526 188 B R H 3< S+ 0 0 116 -4,-2.6 -1,-0.2 -5,-0.3 -2,-0.2 0.780 115.3 38.1 -54.0 -27.9 23.1 3.4 51.5 527 189 B D T 3< S+ 0 0 109 -4,-1.4 -1,-0.3 -3,-0.2 -2,-0.2 0.299 97.8 105.2-109.8 10.0 24.1 -0.0 52.9 528 190 B G S < S- 0 0 20 -3,-2.1 2,-0.2 1,-0.2 -3,-0.1 0.018 74.6 -90.9 -75.8-174.1 20.7 -1.2 53.8 529 191 B N > - 0 0 70 1,-0.1 3,-2.4 4,-0.0 -1,-0.2 -0.483 44.3 -90.8 -96.9 172.2 18.6 -3.8 51.9 530 192 B E T 3 S+ 0 0 162 1,-0.3 -1,-0.1 -2,-0.2 -2,-0.0 0.546 123.3 66.7 -62.4 0.1 16.1 -3.2 49.2 531 193 B R T 3 S+ 0 0 89 -24,-0.1 -20,-2.6 -21,-0.1 2,-0.4 0.265 89.7 74.5-102.5 12.5 13.5 -2.9 51.9 532 194 B L E < +w 511 0H 0 -3,-2.4 2,-0.3 -22,-0.2 -20,-0.2 -0.983 55.0 161.7-129.1 129.8 14.9 0.3 53.4 533 195 B A E -w 512 0H 0 -22,-3.0 -20,-4.1 -2,-0.4 2,-0.3 -0.849 17.8-147.7-135.5 174.1 14.6 3.7 51.9 534 196 B A E -wx 513 583H 0 48,-1.4 50,-2.2 -22,-0.3 2,-0.3 -0.988 6.2-143.7-146.4 154.4 14.9 7.4 52.8 535 197 B T E - x 0 584H 0 -22,-1.5 -19,-2.4 -2,-0.3 2,-0.3 -0.781 14.6-162.5-110.5 157.5 13.5 10.9 52.1 536 198 B I E - x 0 585H 0 48,-0.9 50,-1.0 -2,-0.3 -19,-0.1 -0.983 11.0-139.1-145.5 129.4 15.6 14.1 52.1 537 199 B T > - 0 0 0 -2,-0.3 4,-0.6 -21,-0.3 50,-0.2 -0.368 24.0-117.0 -81.5 164.3 14.3 17.6 52.3 538 200 B P H >> S+ 0 0 0 0, 0.0 4,-2.5 0, 0.0 3,-0.9 0.897 112.7 58.3 -70.1 -36.6 15.6 20.5 50.3 539 201 B Q H 3> S+ 0 0 0 48,-0.3 4,-2.8 1,-0.2 48,-0.0 0.922 103.0 51.1 -58.9 -43.4 16.7 22.3 53.6 540 202 B H H 34 S+ 0 0 4 1,-0.2 -1,-0.2 2,-0.2 33,-0.2 0.635 115.4 42.9 -71.1 -13.6 18.9 19.5 54.7 541 203 B L H << S+ 0 0 0 -3,-0.9 -1,-0.2 -4,-0.6 -2,-0.2 0.739 119.0 43.1 -96.7 -32.8 20.6 19.4 51.4 542 204 B M H < S+ 0 0 43 -4,-2.5 2,-0.3 -5,-0.1 -2,-0.2 0.790 118.1 23.0 -83.6 -32.2 20.9 23.2 51.0 543 205 B F < - 0 0 30 -4,-2.8 2,-0.3 -5,-0.2 21,-0.2 -0.796 55.4-151.6-130.6 177.5 22.0 24.3 54.5 544 206 B N >> - 0 0 14 -2,-0.3 3,-1.6 19,-0.1 4,-0.7 -0.832 49.9 -81.4-140.8 170.8 23.6 23.3 57.7 545 207 B R H >> S+ 0 0 9 19,-3.1 4,-1.2 1,-0.3 3,-0.7 0.753 123.6 66.2 -50.2 -30.6 23.3 24.4 61.3 546 208 B N H >> S+ 0 0 17 18,-0.3 4,-2.6 1,-0.3 3,-0.7 0.900 95.0 57.5 -59.6 -40.0 25.5 27.4 60.7 547 209 B H H <4 S+ 0 0 77 -3,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.802 109.9 45.6 -60.8 -26.3 22.9 28.8 58.3 548 210 B M H << S+ 0 0 2 -3,-0.7 6,-2.2 -4,-0.7 -1,-0.2 0.688 125.4 25.5 -89.6 -19.8 20.4 28.8 61.1 549 211 B L H X< S+ 0 0 0 -4,-1.2 3,-0.6 -3,-0.7 2,-0.5 0.542 92.0 95.0-123.2 -11.6 22.6 30.2 63.9 550 212 B V T 3< S+ 0 0 43 -4,-2.6 4,-0.0 -5,-0.2 -408,-0.0 -0.755 100.2 4.6 -88.2 131.3 25.3 32.4 62.5 551 213 B G T 3 S- 0 0 64 -2,-0.5 2,-0.2 2,-0.0 -1,-0.2 0.430 139.0 -16.7 80.0 0.8 24.5 36.1 62.3 552 214 B G S < S- 0 0 3 -3,-0.6 2,-0.6 -290,-0.1 -290,-0.2 -0.712 83.8 -79.8 147.9 160.5 21.2 35.6 64.0 553 215 B V B -L 261 0D 4 -292,-1.8 -292,-2.3 -2,-0.2 -4,-0.2 -0.831 39.8-158.3 -93.2 124.2 18.8 32.9 64.9 554 216 B R > - 0 0 75 -6,-2.2 3,-2.1 -2,-0.6 4,-0.4 -0.796 12.1-175.7-106.5 93.4 16.6 32.0 61.9 555 217 B P G > S+ 0 0 7 0, 0.0 3,-1.5 0, 0.0 50,-0.3 0.812 81.3 68.2 -57.7 -28.8 13.4 30.3 63.0 556 218 B H G 3 S+ 0 0 30 -297,-0.4 51,-0.1 1,-0.3 -296,-0.1 0.713 102.6 46.8 -65.3 -18.5 12.4 29.7 59.4 557 219 B L G < S+ 0 0 21 -3,-2.1 2,-0.6 -9,-0.1 -1,-0.3 0.443 89.2 107.8 -99.5 -1.1 15.3 27.3 59.1 558 220 B Y < + 0 0 3 -3,-1.5 47,-2.5 -4,-0.4 2,-0.3 -0.683 43.2 127.3 -83.8 121.2 14.3 25.6 62.4 559 221 B C - 0 0 2 -2,-0.6 4,-0.4 45,-0.3 -348,-0.1 -0.929 49.2 -59.4-158.0 174.4 12.8 22.2 61.8 560 222 B L S S+ 0 0 53 -2,-0.3 2,-0.2 2,-0.1 -45,-0.0 -0.935 111.2 35.9-121.3 144.9 13.2 18.5 62.9 561 223 B P S S- 0 0 1 0, 0.0 3,-0.1 0, 0.0 -2,-0.1 0.614 110.7-108.2 -68.4 155.9 15.2 16.6 62.8 562 224 B I - 0 0 0 -75,-0.2 -2,-0.1 -2,-0.2 -17,-0.1 -0.085 30.5 -98.4 -53.6 141.8 17.6 19.6 63.5 563 225 B L - 0 0 2 -4,-0.4 2,-0.1 -6,-0.3 -19,-0.1 -0.382 51.4-154.5 -57.4 139.4 19.9 20.9 60.9 564 226 B K - 0 0 7 -47,-0.3 -19,-3.1 -21,-0.2 -18,-0.3 -0.360 24.9 -56.7-108.3-174.7 23.3 19.4 61.5 565 227 B R >> - 0 0 79 -21,-0.2 3,-2.1 -20,-0.1 4,-1.4 -0.279 53.5-106.8 -64.7 145.8 26.9 20.1 60.9 566 228 B N H 3> S+ 0 0 72 1,-0.3 4,-2.1 2,-0.2 5,-0.1 0.738 117.9 67.8 -46.9 -29.3 28.2 20.7 57.4 567 229 B I H 3> S+ 0 0 81 1,-0.2 4,-1.3 2,-0.2 -1,-0.3 0.881 103.5 44.9 -59.1 -40.0 29.8 17.3 57.5 568 230 B H H <> S+ 0 0 32 -3,-2.1 4,-1.7 2,-0.2 -2,-0.2 0.868 109.8 53.0 -71.6 -42.5 26.4 15.8 57.6 569 231 B Q H X S+ 0 0 13 -4,-1.4 4,-2.3 1,-0.2 -2,-0.2 0.818 107.2 54.3 -64.1 -32.5 25.0 18.0 54.9 570 232 B Q H X S+ 0 0 73 -4,-2.1 4,-1.8 -5,-0.3 -1,-0.2 0.879 105.7 51.9 -69.3 -36.3 27.9 17.0 52.7 571 233 B A H X S+ 0 0 16 -4,-1.3 4,-2.4 2,-0.2 -2,-0.2 0.861 110.0 50.0 -64.9 -40.2 27.0 13.3 53.2 572 234 B L H X S+ 0 0 2 -4,-1.7 4,-2.3 2,-0.2 5,-0.2 0.953 109.8 47.9 -66.7 -50.8 23.5 14.0 52.1 573 235 B R H X S+ 0 0 23 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.886 112.3 51.2 -59.3 -36.8 24.3 15.8 49.0 574 236 B E H X S+ 0 0 115 -4,-1.8 4,-1.2 -5,-0.2 -1,-0.2 0.954 107.0 54.1 -63.4 -47.2 26.8 13.0 48.1 575 237 B L H <>S+ 0 0 10 -4,-2.4 5,-0.7 1,-0.2 3,-0.5 0.909 113.4 40.5 -50.6 -54.0 24.1 10.4 48.7 576 238 B V H ><5S+ 0 0 5 -4,-2.3 3,-2.0 1,-0.2 -1,-0.2 0.971 112.4 53.9 -63.5 -51.0 21.6 12.0 46.3 577 239 B A H 3<5S+ 0 0 17 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.701 97.6 71.8 -57.9 -18.0 24.2 12.9 43.7 578 240 B S T 3<5S- 0 0 70 -4,-1.2 -1,-0.3 -3,-0.5 -2,-0.2 0.647 105.5-118.6 -73.9 -21.6 25.3 9.3 43.7 579 241 B G T < 5 + 0 0 22 -3,-2.0 -3,-0.1 -4,-0.4 4,-0.1 0.359 48.8 170.0 98.4 -14.5 22.4 7.9 41.9 580 242 B F > < - 0 0 19 -5,-0.7 3,-0.6 1,-0.2 -1,-0.3 -0.059 26.1-150.8 -37.6 121.5 21.5 5.7 44.9 581 243 B Q T 3 S+ 0 0 91 1,-0.2 -1,-0.2 -3,-0.1 -5,-0.0 0.433 82.8 72.0 -84.3 1.3 18.1 4.5 43.9 582 244 B R T 3 S+ 0 0 36 -49,-0.1 -48,-1.4 57,-0.0 2,-0.3 -0.070 83.8 76.7-109.1 33.4 16.8 4.1 47.4 583 245 B V E < +x 534 0H 2 -3,-0.6 2,-0.3 -50,-0.2 -48,-0.2 -0.997 57.8 167.5-139.5 135.5 16.5 7.8 48.2 584 246 B F E -x 535 0H 0 -50,-2.2 -48,-0.9 -2,-0.3 2,-0.2 -0.961 38.1 -66.5-151.0 168.5 13.7 10.1 47.0 585 247 B L E +x 536 0H 0 47,-2.2 -229,-2.8 -2,-0.3 2,-0.3 -0.322 47.4 152.6 -60.9 120.1 11.9 13.5 47.3 586 248 B G - 0 0 0 -50,-1.0 -228,-0.1 -231,-0.2 -231,-0.1 -0.873 23.0-165.8-146.5 104.3 10.0 14.2 50.5 587 249 B T - 0 0 0 -2,-0.3 -48,-0.3 -50,-0.2 -229,-0.2 0.837 14.8-149.8 -64.7 -35.7 9.7 17.9 51.2 588 250 B D - 0 0 12 -231,-3.4 18,-0.4 1,-0.2 -230,-0.2 0.790 24.6-174.9 65.4 24.5 8.6 17.7 54.8 589 251 B S B +r 358 0H 1 -232,-0.6 -230,-1.8 18,-0.1 18,-0.3 -0.395 5.8 176.4 -52.8 124.9 6.9 21.0 53.9 590 252 B A - 0 0 6 16,-2.2 17,-0.2 -3,-0.1 -1,-0.1 -0.667 13.1-156.5-145.1 79.5 5.5 21.9 57.4 591 253 B P + 0 0 1 0, 0.0 2,-0.3 0, 0.0 15,-0.1 -0.280 16.1 173.6 -65.8 138.8 3.8 25.2 57.5 592 254 B H - 0 0 41 79,-0.2 79,-0.5 13,-0.1 15,-0.1 -0.987 39.3-100.6-142.5 139.0 3.3 27.4 60.6 593 255 B A B >> -Z 670 0J 13 -2,-0.3 3,-2.4 77,-0.1 4,-1.2 -0.253 41.3-106.2 -60.9 149.0 1.9 30.9 60.7 594 256 B R H >> S+ 0 0 98 75,-3.0 4,-3.2 1,-0.3 3,-0.5 0.839 117.1 48.8 -42.0 -49.7 4.5 33.6 61.0 595 257 B H H 34 S+ 0 0 98 1,-0.2 -1,-0.3 2,-0.2 -2,-0.1 0.549 106.3 56.0 -76.5 -7.0 4.0 34.4 64.7 596 258 B R H <4 S+ 0 0 180 -3,-2.4 7,-1.8 3,-0.1 -1,-0.2 0.660 115.7 39.5 -93.3 -20.5 4.1 30.8 65.7 597 259 B K H << S+ 0 0 5 -4,-1.2 2,-1.1 -3,-0.5 -2,-0.2 0.816 115.7 51.0 -88.8 -44.4 7.5 30.6 64.1 598 260 B E S < S+ 0 0 16 -4,-3.2 2,-0.2 -5,-0.2 -1,-0.2 -0.665 94.2 94.4 -97.1 72.5 8.7 34.0 65.2 599 261 B S S > S- 0 0 27 -2,-1.1 3,-0.6 -3,-0.2 -341,-0.1 -0.786 93.7 -74.9-144.6-169.1 8.0 33.9 68.9 600 262 B S T 3 S+ 0 0 67 1,-0.3 -385,-0.3 -2,-0.2 2,-0.1 0.667 130.1 23.9 -69.9 -12.8 9.5 33.1 72.2 601 263 B C T 3 S- 0 0 49 -388,-0.1 -1,-0.3 -5,-0.1 -388,-0.2 -0.575 89.4-154.3-153.2 81.2 9.2 29.4 71.4 602 264 B G B < -K 212 0C 1 -390,-2.3 -390,-1.7 -3,-0.6 -5,-0.3 -0.288 15.4-117.2 -65.4 139.3 9.2 28.9 67.6 603 265 B C - 0 0 43 -7,-1.8 2,-0.3 -392,-0.2 -45,-0.1 -0.416 28.5-113.5 -73.8 149.3 7.6 25.9 66.0 604 266 B A + 0 0 29 -2,-0.1 -45,-0.3 -13,-0.1 2,-0.1 -0.648 67.1 83.8 -85.4 135.9 9.6 23.4 64.0 605 267 B G - 0 0 6 -47,-2.5 2,-0.5 -2,-0.3 -47,-0.2 -0.260 56.4-131.0 139.4 134.4 9.0 23.2 60.3 606 268 B C - 0 0 2 -18,-0.4 -16,-2.2 -49,-0.1 2,-1.6 -0.913 16.6-140.7-107.5 127.9 9.9 24.8 57.0 607 269 B F + 0 0 8 -2,-0.5 66,-2.4 64,-0.4 4,-0.1 -0.669 46.3 148.6 -87.0 83.0 7.1 25.7 54.5 608 270 B N >> + 0 0 0 -2,-1.6 4,-2.3 64,-0.2 3,-0.9 0.420 28.5 107.0-102.2 3.8 9.0 24.6 51.5 609 271 B A T 34 S+ 0 0 7 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.870 81.0 50.4 -49.7 -40.9 6.3 23.4 49.1 610 272 B P T 34 S+ 0 0 51 0, 0.0 -1,-0.2 0, 0.0 4,-0.2 0.819 124.6 24.9 -68.8 -30.7 6.6 26.5 46.8 611 273 B T T <> S+ 0 0 15 -3,-0.9 4,-2.0 -4,-0.1 5,-0.2 0.432 92.2 97.6-115.9 -3.8 10.3 26.3 46.4 612 274 B A H X S+ 0 0 0 -4,-2.3 4,-3.3 1,-0.2 5,-0.3 0.948 81.7 49.6 -52.1 -59.9 11.3 22.7 46.9 613 275 B L H > S+ 0 0 6 -4,-0.4 4,-2.0 1,-0.2 -1,-0.2 0.889 115.0 43.1 -48.3 -50.0 11.5 21.4 43.4 614 276 B G H > S+ 0 0 9 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.851 113.2 54.0 -65.6 -35.9 13.7 24.2 42.1 615 277 B S H X S+ 0 0 2 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.901 108.9 48.2 -65.4 -41.1 15.8 24.0 45.2 616 278 B Y H X S+ 0 0 0 -4,-3.3 4,-2.5 -5,-0.2 -1,-0.2 0.928 108.5 54.8 -64.9 -40.7 16.3 20.4 44.6 617 279 B A H X S+ 0 0 0 -4,-2.0 4,-3.0 -5,-0.3 -2,-0.2 0.916 107.6 50.0 -54.8 -47.8 17.2 21.2 41.0 618 280 B T H X S+ 0 0 15 -4,-2.4 4,-3.4 2,-0.2 5,-0.3 0.942 109.1 51.4 -57.0 -51.3 19.9 23.6 42.1 619 281 B V H X S+ 0 0 2 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.965 112.2 45.4 -51.8 -57.5 21.4 21.1 44.5 620 282 B F H <>S+ 0 0 2 -4,-2.5 5,-2.4 2,-0.2 6,-0.3 0.933 113.7 49.8 -53.4 -50.0 21.6 18.4 41.7 621 283 B E H ><5S+ 0 0 35 -4,-3.0 3,-3.8 1,-0.2 -2,-0.2 0.982 110.7 49.7 -51.5 -60.0 23.0 20.9 39.2 622 284 B E H 3<5S+ 0 0 79 -4,-3.4 -1,-0.2 1,-0.3 -2,-0.2 0.878 110.2 50.8 -44.8 -46.1 25.6 22.0 41.7 623 285 B M T 3<5S- 0 0 37 -4,-2.7 -1,-0.3 -5,-0.3 -2,-0.2 0.416 113.9-119.5 -76.3 2.5 26.5 18.4 42.4 624 286 B N T < 5S+ 0 0 146 -3,-3.8 -3,-0.2 -4,-0.2 -2,-0.1 0.957 82.3 116.0 58.1 49.4 26.9 17.9 38.7 625 287 B A >>< + 0 0 2 -5,-2.4 3,-3.5 -6,-0.1 4,-0.5 0.200 11.6 131.9-139.0 23.8 24.1 15.2 38.9 626 288 B L H >> S+ 0 0 46 1,-0.3 3,-0.8 -6,-0.3 4,-0.6 0.734 71.1 71.4 -47.8 -25.6 21.1 16.4 36.8 627 289 B Q H 34 S+ 0 0 141 1,-0.3 -1,-0.3 2,-0.1 4,-0.2 0.642 102.2 41.0 -68.8 -13.6 21.1 12.9 35.3 628 290 B H H <> S+ 0 0 57 -3,-3.5 4,-1.6 2,-0.1 -1,-0.3 0.440 93.1 91.0-110.6 -2.0 19.9 11.5 38.6 629 291 B F H S+ 0 0 68 -4,-0.6 4,-3.5 1,-0.2 5,-0.5 0.906 109.6 52.4 -55.1 -42.8 14.3 12.9 37.6 631 293 B A H >>S+ 0 0 32 1,-0.2 5,-3.0 3,-0.2 4,-2.1 0.916 108.5 50.5 -60.2 -43.5 14.6 9.6 39.4 632 294 B F H <5S+ 0 0 3 -4,-1.6 -47,-2.2 1,-0.2 5,-0.3 0.903 120.8 35.4 -59.4 -43.5 14.9 11.2 42.7 633 295 B C H <5S+ 0 0 0 -4,-2.1 -279,-1.9 -49,-0.2 -2,-0.2 0.813 138.1 9.2 -81.0 -33.4 11.8 13.3 42.0 634 296 B S H <5S+ 0 0 0 -4,-3.5 12,-0.4 -281,-0.2 -3,-0.2 0.429 125.7 37.1-131.7 -5.4 9.7 10.9 40.0 635 297 B V T X S+ 0 0 0 -6,-0.5 4,-3.0 -5,-0.3 5,-0.2 0.986 111.5 46.3 -58.1 -59.0 9.5 6.8 45.3 638 300 B P H 4>S+ 0 0 0 0, 0.0 5,-3.4 0, 0.0 4,-0.5 0.902 112.7 53.2 -53.0 -37.9 7.0 5.1 43.1 639 301 B Q H ><5S+ 0 0 128 -4,-2.3 3,-0.9 3,-0.2 -2,-0.2 0.927 110.2 44.6 -65.2 -43.3 9.3 2.2 42.8 640 302 B F H 3<5S+ 0 0 28 -4,-2.4 -1,-0.2 1,-0.3 -3,-0.2 0.936 117.7 45.6 -65.9 -42.5 9.8 1.8 46.5 641 303 B Y T 3<5S- 0 0 27 -4,-3.0 -1,-0.3 -5,-0.2 -2,-0.2 0.472 111.1-121.9 -78.3 -1.9 6.2 2.1 47.1 642 304 B G T < 5 + 0 0 64 -3,-0.9 -3,-0.2 -4,-0.5 -2,-0.1 0.882 69.0 133.0 62.7 35.1 5.3 -0.2 44.2 643 305 B L < - 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0 0 5 -27,-0.2 2,-0.3 -67,-0.2 -27,-0.2 -0.862 66.1-172.9-107.8 138.3 15.4 27.2 38.7 682 344 B S E -P 653 0G 22 -29,-3.0 -29,-3.4 -2,-0.4 2,-0.7 -0.973 27.0-118.6-133.0 145.9 11.7 27.9 38.1 683 345 B V E P 652 0G 56 -2,-0.3 -31,-0.2 -31,-0.2 -69,-0.0 -0.740 360.0 360.0 -83.5 117.6 8.7 25.7 37.2 684 346 B K 0 0 142 -33,-2.0 -33,-0.2 -2,-0.7 -1,-0.1 0.136 360.0 360.0 -98.5 360.0 7.3 26.8 33.9