==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-APR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/TRANSCRIPTION/INHIBITOR 16-MAY-12 4F7L . COMPND 2 MOLECULE: CYCLIN-DEPENDENT KINASE 8; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR E.V.SCHNEIDER,J.BOETTCHER,R.HUBER,K.MASKOS . 594 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 29841.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 400 67.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 36 6.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 23 3.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 74 12.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 241 40.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 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 3 3 0 2 0 2 2 3 1 0 2 3 0 2 0 0 2 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 3 1 0 1 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 ANTIPARALLEL BRIDGES PER LADDER . 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 D 0 0 83 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -33.4 16.6 83.0 156.8 2 0 A K + 0 0 148 1,-0.2 2,-0.4 413,-0.1 414,-0.3 0.868 360.0 119.1 57.3 40.3 17.4 84.4 160.4 3 1 A M S S- 0 0 7 412,-0.1 -1,-0.2 592,-0.1 412,-0.2 -0.996 79.9 -86.2-133.9 133.3 21.1 83.8 159.7 4 2 A D > - 0 0 11 410,-1.2 4,-1.7 409,-0.9 5,-0.1 -0.061 32.0-154.3 -55.8 129.3 23.5 86.8 159.7 5 3 A Y H > S+ 0 0 85 590,-2.6 4,-2.5 2,-0.2 5,-0.2 0.858 91.6 49.7 -72.5 -40.6 23.7 88.6 156.4 6 4 A D H > S+ 0 0 56 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.960 111.8 49.4 -64.3 -53.1 27.2 90.1 156.7 7 5 A F H > S+ 0 0 14 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.879 113.0 48.9 -45.9 -46.0 28.6 86.7 157.8 8 6 A K H X S+ 0 0 70 -4,-1.7 4,-1.6 1,-0.2 -2,-0.2 0.895 113.5 43.8 -68.4 -43.4 26.9 85.2 154.7 9 7 A V H X S+ 0 0 59 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.813 113.2 52.6 -72.0 -32.8 28.1 87.8 152.1 10 8 A K H X S+ 0 0 123 -4,-2.7 4,-2.9 2,-0.2 5,-0.2 0.979 113.8 41.2 -63.3 -56.9 31.7 87.8 153.6 11 9 A L H X S+ 0 0 27 -4,-2.0 4,-1.7 1,-0.2 -2,-0.2 0.856 115.3 52.8 -60.5 -36.1 32.1 84.0 153.3 12 10 A S H < S+ 0 0 50 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.930 112.4 44.2 -64.8 -48.2 30.3 84.0 150.0 13 11 A S H < S+ 0 0 89 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.953 118.0 43.4 -57.3 -56.4 32.8 86.6 148.6 14 12 A E H < S+ 0 0 147 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.727 90.5 109.5 -67.1 -23.4 35.9 85.0 150.0 15 13 A R < - 0 0 38 -4,-1.7 2,-0.3 -5,-0.2 -3,-0.0 -0.316 67.1-131.3 -63.1 129.4 34.8 81.4 149.0 16 14 A E - 0 0 93 -2,-0.1 2,-0.4 4,-0.0 72,-0.2 -0.628 18.2-151.7 -78.9 136.8 36.8 79.8 146.2 17 15 A R >> - 0 0 131 -2,-0.3 4,-2.3 1,-0.1 3,-1.0 -0.934 16.7-131.5-112.5 135.9 34.7 78.2 143.4 18 16 A V H 3> S+ 0 0 4 -2,-0.4 4,-3.0 1,-0.3 -1,-0.1 0.850 106.5 51.3 -52.7 -42.1 36.0 75.3 141.3 19 17 A E H 34 S+ 0 0 77 2,-0.2 -1,-0.3 1,-0.2 5,-0.1 0.706 111.1 47.3 -74.6 -23.4 35.1 77.0 138.0 20 18 A D H <4 S+ 0 0 78 -3,-1.0 -2,-0.2 1,-0.1 -1,-0.2 0.920 121.0 36.6 -75.5 -50.9 36.9 80.3 138.8 21 19 A L H < S+ 0 0 26 -4,-2.3 22,-1.9 22,-0.1 23,-0.7 0.902 117.9 46.6 -70.5 -45.5 40.0 78.5 140.0 22 20 A F E < -A 42 0A 7 -4,-3.0 2,-0.6 -5,-0.2 20,-0.2 -0.859 61.4-145.9-114.3 136.2 40.3 75.5 137.5 23 21 A E E +A 41 0A 94 18,-1.5 18,-0.8 -2,-0.4 -4,-0.1 -0.869 48.4 131.8 -87.9 119.1 39.9 75.0 133.7 24 22 A Y > + 0 0 25 -2,-0.6 3,-1.5 16,-0.2 15,-0.2 0.500 16.8 124.4-146.5 -14.9 38.3 71.6 133.3 25 23 A E T 3 S+ 0 0 133 1,-0.2 -2,-0.0 2,-0.1 13,-0.0 -0.327 83.3 15.0 -71.6 143.4 35.4 71.4 130.9 26 24 A G T 3 S+ 0 0 63 1,-0.1 2,-0.3 305,-0.0 305,-0.3 0.232 102.5 99.1 80.5 -10.9 35.6 68.9 128.0 27 25 A C < + 0 0 31 -3,-1.5 12,-2.6 303,-0.1 2,-0.3 -0.326 46.2 155.2-106.1 46.6 38.5 67.2 129.8 28 26 A K E +B 38 0B 51 303,-0.3 303,-0.8 -2,-0.3 10,-0.3 -0.603 14.5 174.6 -76.2 132.3 36.5 64.3 131.4 29 27 A V E + 0 0 23 8,-3.4 2,-0.3 1,-0.3 9,-0.2 0.453 60.6 15.2-118.4 -6.2 38.8 61.3 132.1 30 28 A G E -B 37 0B 21 7,-1.3 7,-2.9 301,-0.1 -1,-0.3 -0.910 49.3-166.7-169.3 138.5 36.5 58.8 134.0 31 29 A R + 0 0 181 -2,-0.3 2,-0.2 5,-0.2 3,-0.1 0.053 32.0 131.9 -95.0-148.1 32.9 58.1 134.8 32 30 A G > - 0 0 53 1,-0.1 3,-0.6 -2,-0.1 139,-0.1 -0.538 66.9 -69.8 125.8 175.1 31.8 55.6 137.5 33 31 A T T 3 S+ 0 0 94 1,-0.2 -1,-0.1 -2,-0.2 138,-0.1 0.945 123.4 49.1 -65.9 -49.3 29.5 55.2 140.4 34 32 A Y T 3 S- 0 0 103 136,-0.3 23,-0.7 1,-0.1 2,-0.2 0.300 122.4 -63.2 -83.9 7.3 31.3 57.5 142.8 35 33 A G E < - C 0 56B 6 -3,-0.6 2,-0.4 21,-0.3 21,-0.2 -0.836 53.2 -71.1 147.1 179.7 31.5 60.6 140.4 36 34 A H E - C 0 55B 63 19,-1.9 19,-2.2 -2,-0.2 2,-0.5 -0.952 42.5-150.1-106.9 135.7 32.9 62.0 137.2 37 35 A V E -BC 30 54B 32 -7,-2.9 -8,-3.4 -2,-0.4 -7,-1.3 -0.928 10.7-168.1-112.6 128.1 36.6 62.8 137.1 38 36 A Y E -BC 28 53B 20 15,-3.1 15,-3.5 -2,-0.5 2,-0.6 -0.905 24.6-127.4-115.2 142.4 38.2 65.6 135.0 39 37 A K E - C 0 52B 38 -12,-2.6 2,-0.5 -2,-0.4 13,-0.2 -0.812 42.5-172.7 -83.8 115.9 41.8 66.3 134.2 40 38 A A E - C 0 51B 0 11,-2.9 11,-1.4 -2,-0.6 -16,-0.2 -0.947 24.0-174.1-132.2 113.6 42.2 69.9 135.2 41 39 A K E -A 23 0A 117 -18,-0.8 -18,-1.5 -2,-0.5 2,-0.3 -0.437 42.1 -95.8 -81.3 172.4 44.9 72.5 134.9 42 40 A R E -A 22 0A 69 7,-0.3 -20,-0.2 -20,-0.2 3,-0.1 -0.677 15.8-146.6 -91.1 144.7 44.5 75.9 136.6 43 41 A K S S+ 0 0 112 -22,-1.9 2,-1.2 -2,-0.3 -21,-0.1 0.906 86.2 68.6 -68.5 -46.5 43.1 79.0 134.9 44 42 A D S S- 0 0 107 -23,-0.7 2,-1.5 -24,-0.1 -1,-0.2 -0.678 98.0-113.1 -91.6 85.1 45.3 81.4 136.9 45 43 A G S S+ 0 0 70 -2,-1.2 2,-2.9 1,-0.2 -3,-0.1 0.002 86.2 97.1 49.0 -67.5 49.0 81.1 136.0 46 44 A K S S+ 0 0 169 -2,-1.5 2,-0.2 2,-0.1 -1,-0.2 -0.208 77.2 56.5 -72.6 58.4 50.8 79.7 139.1 47 45 A D - 0 0 51 -2,-2.9 -5,-0.2 -5,-0.1 -6,-0.0 -0.822 36.1-179.8-177.3 136.2 50.8 75.9 138.1 48 46 A D + 0 0 149 -2,-0.2 2,-0.2 2,-0.1 -1,-0.1 0.423 64.7 109.4-103.5 -12.4 52.0 73.5 135.5 49 47 A K - 0 0 99 1,-0.0 -7,-0.3 -8,-0.0 2,-0.2 -0.446 62.9-141.7 -70.9 127.8 50.5 70.6 137.5 50 48 A D - 0 0 35 -2,-0.2 51,-1.3 51,-0.2 2,-0.3 -0.497 19.8-155.4 -70.9 155.0 47.5 68.8 136.2 51 49 A Y E -CD 40 100B 23 -11,-1.4 -11,-2.9 49,-0.2 2,-0.7 -0.999 20.0-123.3-135.9 138.4 45.0 67.8 138.9 52 50 A A E -CD 39 99B 18 47,-3.3 47,-2.0 -2,-0.3 2,-0.6 -0.740 32.8-164.4 -72.5 112.9 42.3 65.0 139.0 53 51 A L E -CD 38 98B 0 -15,-3.5 -15,-3.1 -2,-0.7 2,-0.6 -0.933 5.3-165.2-108.8 116.2 39.2 67.1 139.7 54 52 A K E -CD 37 97B 17 43,-3.2 43,-1.9 -2,-0.6 2,-0.8 -0.897 15.9-159.3-115.4 113.7 36.3 64.9 140.9 55 53 A Q E -CD 36 96B 37 -19,-2.2 -19,-1.9 -2,-0.6 41,-0.2 -0.806 30.1-129.9 -84.9 109.3 32.6 65.8 141.1 56 54 A I E -C 35 0B 10 39,-2.1 2,-0.3 -2,-0.8 -21,-0.3 -0.230 28.0-100.2 -53.1 140.0 31.1 63.3 143.6 57 55 A E E S+ 0 0 119 -23,-0.7 -1,-0.1 -24,-0.1 8,-0.1 -0.544 84.0 0.1 -62.9 124.0 27.9 61.6 142.4 58 56 A G E S- 0 0 24 -2,-0.3 37,-0.5 -3,-0.1 2,-0.2 -0.055 87.1 -52.5 96.4 177.5 24.9 63.4 143.9 59 57 A T E S- D 0 94B 82 35,-0.1 35,-0.2 2,-0.1 34,-0.1 -0.552 83.0 -0.8 -92.2 151.3 23.8 66.2 146.2 60 58 A G S S- 0 0 5 33,-1.9 2,-1.4 -2,-0.2 35,-0.2 0.071 102.3 -41.5 76.5-174.9 24.9 67.1 149.8 61 59 A I S S- 0 0 5 409,-0.1 -1,-0.2 4,-0.1 -2,-0.1 -0.684 72.9-174.9 -94.1 79.1 27.3 65.5 152.3 62 60 A S > - 0 0 42 -2,-1.4 4,-3.7 -3,-0.1 5,-0.2 -0.170 41.8-100.8 -69.6 167.8 26.3 61.9 151.6 63 61 A M H > S+ 0 0 61 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.869 128.1 46.3 -58.3 -38.0 27.7 58.9 153.6 64 62 A S H > S+ 0 0 55 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.871 114.2 47.5 -71.3 -37.6 30.1 58.3 150.7 65 63 A A H > S+ 0 0 0 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.953 113.4 48.8 -62.2 -49.5 31.0 62.0 150.5 66 64 A C H X S+ 0 0 0 -4,-3.7 4,-3.3 1,-0.2 -2,-0.2 0.909 113.1 45.8 -62.0 -49.4 31.5 62.2 154.2 67 65 A R H X S+ 0 0 93 -4,-2.2 4,-2.3 2,-0.2 5,-0.3 0.951 111.6 49.5 -55.7 -59.3 33.7 59.1 154.5 68 66 A E H X S+ 0 0 31 -4,-2.0 4,-1.7 1,-0.2 5,-0.2 0.892 117.7 42.5 -51.5 -45.7 36.0 59.9 151.5 69 67 A I H X S+ 0 0 1 -4,-2.3 4,-2.1 -5,-0.2 5,-0.2 0.988 110.0 56.3 -61.7 -61.3 36.5 63.3 153.0 70 68 A A H < S+ 0 0 9 -4,-3.3 415,-0.4 -5,-0.2 4,-0.2 0.846 116.2 34.8 -37.3 -55.4 36.9 62.2 156.6 71 69 A L H >X S+ 0 0 18 -4,-2.3 3,-2.8 1,-0.2 4,-1.4 0.959 115.3 48.1 -73.7 -59.8 39.8 59.8 155.8 72 70 A L H 3< S+ 0 0 30 -4,-1.7 11,-0.5 1,-0.3 -1,-0.2 0.736 100.5 69.1 -60.8 -23.1 41.9 61.4 153.0 73 71 A R T 3< S+ 0 0 46 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.699 111.7 32.7 -60.9 -22.3 41.8 64.6 155.0 74 72 A E T <4 S+ 0 0 4 -3,-2.8 2,-0.3 -4,-0.2 -2,-0.2 0.688 96.4 98.7-102.8 -29.2 44.1 62.8 157.5 75 73 A L < + 0 0 12 -4,-1.4 2,-0.3 6,-0.1 8,-0.3 -0.504 38.6 169.2 -82.4 130.2 46.2 60.4 155.4 76 74 A K + 0 0 151 -2,-0.3 5,-0.1 6,-0.1 6,-0.1 -0.884 21.1 124.6-139.0 103.5 49.7 61.3 154.3 77 75 A H > - 0 0 40 -2,-0.3 3,-1.2 3,-0.3 57,-0.1 -0.962 63.0-118.6-147.2 148.6 52.0 58.7 152.7 78 76 A P T 3 S+ 0 0 64 0, 0.0 4,-0.1 0, 0.0 56,-0.1 0.674 113.0 48.3 -63.3 -14.3 53.8 59.0 149.3 79 77 A N T 3 S+ 0 0 8 87,-0.1 88,-3.8 51,-0.1 2,-0.4 0.272 94.3 80.5-113.4 6.4 51.9 55.9 148.0 80 78 A V B < S-f 167 0C 9 -3,-1.2 -3,-0.3 86,-0.2 88,-0.2 -0.878 94.4 -99.5-100.3 146.2 48.3 56.8 149.0 81 79 A I - 0 0 23 86,-2.5 2,-0.4 -2,-0.4 -2,-0.1 -0.366 41.4-130.8 -61.7 143.3 46.5 59.3 146.7 82 80 A S - 0 0 50 18,-0.1 18,-0.9 -4,-0.1 2,-0.9 -0.874 4.4-142.8-110.4 131.9 46.5 62.9 148.1 83 81 A L E -E 99 0B 25 -11,-0.5 16,-0.2 -2,-0.4 3,-0.1 -0.804 17.1-178.6 -90.6 105.6 43.5 65.2 148.6 84 82 A Q E - 0 0 86 14,-1.2 2,-0.3 -2,-0.9 -1,-0.2 0.901 63.5 -18.0 -69.2 -42.7 44.8 68.8 147.8 85 83 A K E -E 98 0B 72 13,-0.6 13,-2.5 2,-0.0 2,-0.4 -0.983 51.4-131.7-163.4 149.5 41.4 70.5 148.5 86 84 A V E -E 97 0B 20 -2,-0.3 2,-0.5 11,-0.2 11,-0.2 -0.893 17.8-159.5-100.9 140.0 37.6 70.2 149.0 87 85 A F E -E 96 0B 6 9,-3.3 9,-3.1 -2,-0.4 2,-0.5 -0.968 1.4-165.1-118.0 114.9 35.2 72.5 147.2 88 86 A L E -E 95 0B 15 -2,-0.5 2,-0.7 7,-0.2 7,-0.2 -0.874 8.0-156.8 -95.4 125.2 31.6 72.9 148.6 89 87 A S > - 0 0 29 5,-1.5 4,-2.1 -2,-0.5 5,-0.4 -0.888 5.6-168.3-110.1 100.3 29.3 74.5 146.0 90 88 A H T 4 S+ 0 0 41 -2,-0.7 -1,-0.1 2,-0.2 384,-0.1 0.766 78.4 62.9 -64.2 -32.3 26.4 76.1 147.9 91 89 A A T 4 S+ 0 0 99 1,-0.2 -1,-0.2 3,-0.1 -2,-0.0 0.984 125.9 9.3 -54.6 -70.0 24.3 76.7 144.8 92 90 A D T 4 S- 0 0 82 2,-0.1 -2,-0.2 -32,-0.0 -1,-0.2 0.470 95.8-128.3 -92.3 -6.2 23.8 73.1 143.6 93 91 A R < + 0 0 50 -4,-2.1 -33,-1.9 1,-0.2 2,-0.3 0.651 55.7 149.1 60.2 22.7 25.2 71.4 146.8 94 92 A K E -D 59 0B 51 -5,-0.4 -5,-1.5 -35,-0.2 2,-0.5 -0.629 41.7-135.8 -80.5 141.8 27.6 69.2 144.7 95 93 A V E - E 0 88B 1 -37,-0.5 -39,-2.1 -2,-0.3 2,-0.4 -0.896 17.7-163.0-104.3 125.9 30.9 68.4 146.4 96 94 A W E -DE 55 87B 11 -9,-3.1 -9,-3.3 -2,-0.5 2,-0.4 -0.882 2.9-166.8-110.1 143.7 34.2 68.6 144.5 97 95 A L E -DE 54 86B 0 -43,-1.9 -43,-3.2 -2,-0.4 2,-0.4 -0.993 9.3-147.2-131.2 134.6 37.6 67.1 145.5 98 96 A L E +DE 53 85B 9 -13,-2.5 -14,-1.2 -2,-0.4 -13,-0.6 -0.796 19.0 174.3-102.1 140.9 41.0 67.8 144.0 99 97 A F E -DE 52 83B 12 -47,-2.0 -47,-3.3 -2,-0.4 -16,-0.2 -0.990 42.1 -95.7-145.8 140.3 43.7 65.1 143.7 100 98 A D E -D 51 0B 28 -18,-0.9 2,-0.8 -2,-0.3 -49,-0.2 -0.307 52.1-104.1 -64.8 140.2 47.1 65.3 142.1 101 99 A Y - 0 0 17 -51,-1.3 2,-0.7 -61,-0.1 56,-0.4 -0.564 31.0-163.4 -81.1 107.0 46.9 63.9 138.6 102 100 A A - 0 0 5 -2,-0.8 54,-0.2 1,-0.2 53,-0.1 -0.775 7.0-156.5 -83.7 113.5 48.3 60.4 138.1 103 101 A E + 0 0 20 -2,-0.7 225,-0.3 55,-0.1 2,-0.2 0.885 67.0 24.8 -59.1 -43.2 48.8 59.9 134.4 104 102 A H E -G 155 0C 12 51,-2.0 51,-3.0 223,-0.1 2,-0.3 -0.600 56.8-164.0-119.7 172.6 48.7 56.1 134.4 105 103 A D E > -G 154 0C 13 49,-0.3 4,-2.1 -2,-0.2 3,-0.2 -0.952 39.5-102.5-147.4 171.8 47.5 52.9 136.3 106 104 A L H > S+ 0 0 0 47,-2.2 4,-1.6 44,-0.9 5,-0.3 0.683 115.8 62.3 -71.5 -18.7 48.2 49.2 136.4 107 105 A W H > S+ 0 0 122 43,-0.8 4,-1.5 46,-0.2 -1,-0.2 0.924 110.9 38.8 -67.9 -44.2 45.1 48.4 134.4 108 106 A H H > S+ 0 0 80 -3,-0.2 4,-1.8 42,-0.2 -2,-0.2 0.853 116.4 50.6 -75.4 -39.1 46.4 50.4 131.4 109 107 A I H X S+ 0 0 2 -4,-2.1 4,-2.1 2,-0.2 5,-0.2 0.976 112.8 43.9 -61.9 -56.5 50.1 49.2 131.8 110 108 A I H X S+ 0 0 4 -4,-1.6 4,-3.1 1,-0.3 5,-0.2 0.934 114.1 51.5 -57.8 -48.9 49.4 45.5 132.0 111 109 A K H X S+ 0 0 102 -4,-1.5 4,-0.8 -5,-0.3 -1,-0.3 0.874 106.7 54.8 -48.9 -44.5 46.9 45.8 129.1 112 110 A F H >< S+ 0 0 88 -4,-1.8 3,-0.5 1,-0.2 -1,-0.2 0.904 112.3 42.4 -63.6 -42.8 49.6 47.6 127.0 113 111 A H H >< S+ 0 0 41 -4,-2.1 3,-2.2 1,-0.2 -2,-0.2 0.896 108.2 60.5 -64.8 -41.4 52.0 44.7 127.5 114 112 A R H 3< S+ 0 0 151 -4,-3.1 -2,-0.2 1,-0.3 -1,-0.2 0.622 94.6 64.8 -64.0 -14.6 49.1 42.2 126.9 115 113 A A T << 0 0 85 -4,-0.8 -1,-0.3 -3,-0.5 -2,-0.2 0.440 360.0 360.0 -81.7 -4.7 48.8 43.8 123.4 116 114 A S < 0 0 151 -3,-2.2 -3,-0.1 -4,-0.1 -2,-0.1 0.247 360.0 360.0-132.9 360.0 52.3 42.5 122.5 117 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 118 122 A Q 0 0 178 0, 0.0 88,-0.1 0, 0.0 87,-0.1 0.000 360.0 360.0 360.0 166.5 57.1 40.8 128.9 119 123 A L - 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0 0 61 -2,-0.3 2,-0.3 -44,-0.0 3,-0.1 -0.450 32.6-178.3 -75.0 152.0 36.6 42.6 155.6 189 212 A T > - 0 0 50 -2,-0.1 4,-1.0 1,-0.1 3,-0.5 -0.944 43.5-105.4-146.0 163.2 40.2 42.2 156.9 190 213 A K H >> S+ 0 0 72 -2,-0.3 4,-1.9 1,-0.2 3,-0.8 0.917 118.9 58.0 -53.5 -44.3 43.8 43.1 156.3 191 214 A A H 3> S+ 0 0 22 1,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.804 97.8 60.0 -63.6 -29.7 44.5 39.6 155.0 192 215 A I H 3> S+ 0 0 6 -3,-0.5 4,-1.1 2,-0.2 -1,-0.3 0.851 105.1 49.6 -64.1 -37.6 41.8 40.1 152.2 193 216 A D H XX S+ 0 0 2 -4,-1.0 4,-2.0 -3,-0.8 3,-0.9 0.965 108.3 52.4 -62.7 -51.4 43.9 43.1 151.0 194 217 A I H 3X S+ 0 0 2 -4,-1.9 4,-2.2 1,-0.3 -2,-0.2 0.841 105.8 55.0 -57.0 -37.8 47.1 40.9 150.9 195 218 A W H 3X S+ 0 0 0 -4,-2.2 4,-1.6 2,-0.2 -1,-0.3 0.854 108.4 49.4 -55.9 -40.7 45.2 38.3 148.8 196 219 A A H - 0 0 18 0, 0.0 3,-1.2 0, 0.0 -9,-0.1 -0.632 27.5-139.2 -72.0 135.4 45.0 37.8 135.6 210 233 A I T 3 S+ 0 0 1 -11,-0.5 2,-0.1 -2,-0.3 -34,-0.1 0.966 100.8 31.6 -62.5 -47.7 45.8 34.7 137.8 211 234 A F T 3 S+ 0 0 1 -36,-0.4 -1,-0.3 -3,-0.1 16,-0.1 -0.214 83.6 168.4-106.2 41.8 42.2 34.0 138.5 212 235 A H < + 0 0 107 -3,-1.2 2,-0.3 -2,-0.1 -4,-0.0 -0.261 13.2 158.9 -53.1 136.8 40.6 35.3 135.3 213 236 A C - 0 0 22 13,-0.0 2,-0.2 0, 0.0 -39,-0.2 -0.982 41.4-109.7-165.9 145.2 36.9 34.2 135.0 214 237 A R 0 0 215 -2,-0.3 9,-0.1 1,-0.1 8,-0.0 -0.519 360.0 360.0 -76.8 150.8 33.6 34.9 133.3 215 238 A Q 0 0 169 -2,-0.2 -1,-0.1 7,-0.1 7,-0.1 0.707 360.0 360.0-111.6 360.0 30.7 36.4 135.5 216 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 217 245 A N 0 0 148 0, 0.0 -33,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 161.1 24.8 36.5 146.8 218 246 A P + 0 0 61 0, 0.0 2,-0.5 0, 0.0 -34,-0.3 0.763 360.0 88.9 -76.0 -27.8 28.3 36.3 148.2 219 247 A Y - 0 0 20 -36,-0.2 2,-0.5 -35,-0.1 -36,-0.1 -0.637 55.2-178.3 -73.2 121.0 28.9 32.7 147.0 220 248 A H > - 0 0 46 -38,-0.6 4,-1.4 -2,-0.5 -38,-0.1 -0.864 6.4-171.9-127.9 99.0 30.3 32.7 143.4 221 249 A H H >> S+ 0 0 69 -2,-0.5 4,-2.3 1,-0.2 3,-0.7 0.909 79.5 46.4 -57.6 -61.7 30.8 29.1 142.0 222 250 A D H 3> S+ 0 0 104 1,-0.3 4,-1.8 2,-0.2 -1,-0.2 0.896 111.1 54.8 -55.4 -42.5 32.7 29.6 138.7 223 251 A Q H 3> S+ 0 0 12 1,-0.2 4,-1.5 2,-0.2 -1,-0.3 0.854 109.0 48.7 -56.9 -38.9 35.1 32.1 140.3 224 252 A L H > - 0 0 37 1,-0.1 4,-1.6 -2,-0.1 3,-1.4 -0.563 25.7-113.0 -70.5 140.3 43.6 20.2 152.3 236 264 A D T 34 S+ 0 0 84 1,-0.3 6,-0.2 -2,-0.2 -1,-0.1 0.847 121.0 54.2 -33.8 -49.4 41.9 20.3 155.8 237 265 A K T 34 S+ 0 0 174 1,-0.2 3,-0.4 2,-0.1 -1,-0.3 0.821 104.1 53.7 -59.3 -38.5 45.4 20.8 157.2 238 266 A D T <4 S+ 0 0 89 -3,-1.4 2,-0.3 1,-0.3 53,-0.2 0.898 128.8 14.6 -64.6 -43.7 46.1 23.8 155.0 239 267 A W >< + 0 0 6 -4,-1.6 3,-1.1 1,-0.1 -1,-0.3 -0.784 69.9 174.2-137.8 89.5 42.8 25.7 156.1 240 268 A E G > S+ 0 0 143 -3,-0.4 3,-0.8 -2,-0.3 -1,-0.1 0.889 77.6 50.2 -69.3 -41.5 41.3 24.1 159.2 241 269 A D G > S+ 0 0 80 1,-0.2 3,-1.0 2,-0.1 4,-0.4 0.136 72.2 107.3 -89.5 21.7 38.5 26.6 159.8 242 270 A I G X S+ 0 0 15 -3,-1.1 3,-1.9 1,-0.2 -1,-0.2 0.900 75.8 63.7 -58.3 -37.1 37.2 26.5 156.2 243 271 A K G < S+ 0 0 136 -3,-0.8 -1,-0.2 1,-0.3 5,-0.2 0.730 93.2 60.9 -57.5 -27.2 34.3 24.6 157.9 244 272 A K G < S+ 0 0 170 -3,-1.0 -1,-0.3 4,-0.1 -2,-0.2 0.628 80.4 106.0 -76.5 -13.6 33.4 27.7 159.9 245 273 A M S X S- 0 0 28 -3,-1.9 3,-1.6 -4,-0.4 4,-0.3 -0.444 77.3-127.6 -68.0 137.7 32.7 29.7 156.6 246 274 A P T 3 S+ 0 0 76 0, 0.0 3,-0.3 0, 0.0 -62,-0.2 0.771 106.2 44.2 -63.6 -28.9 29.0 30.2 156.1 247 275 A E T 3> S+ 0 0 55 -64,-1.7 4,-1.3 1,-0.2 -63,-0.1 -0.095 82.8 111.2-103.6 34.3 28.9 28.8 152.5 248 276 A H H <> S+ 0 0 16 -3,-1.6 4,-2.4 2,-0.2 5,-0.2 0.921 74.0 47.7 -74.1 -49.3 31.1 25.8 153.4 249 277 A S H > S+ 0 0 96 -4,-0.3 4,-1.6 -3,-0.3 -1,-0.2 0.857 110.4 54.3 -65.2 -31.5 28.5 23.0 153.1 250 278 A T H > S+ 0 0 46 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.878 106.5 52.7 -63.3 -40.4 27.5 24.5 149.7 251 279 A L H X S+ 0 0 0 -4,-1.3 4,-1.6 1,-0.2 -2,-0.2 0.944 109.1 48.4 -56.7 -50.6 31.1 24.3 148.7 252 280 A M H < S+ 0 0 92 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.803 110.6 53.8 -60.6 -29.8 31.1 20.6 149.7 253 281 A K H < S+ 0 0 158 -4,-1.6 -2,-0.2 -5,-0.2 -1,-0.2 0.930 117.6 32.3 -67.2 -45.3 27.9 20.2 147.6 254 282 A D H < S+ 0 0 60 -4,-2.1 2,-0.3 -5,-0.1 -2,-0.2 0.532 113.5 57.5 -96.6 -9.6 29.2 21.6 144.4 255 283 A F < - 0 0 14 -4,-1.6 2,-0.4 -5,-0.2 3,-0.1 -0.926 55.3-155.2-130.6 150.1 32.9 20.6 144.4 256 284 A R >> - 0 0 172 -2,-0.3 3,-2.6 1,-0.1 4,-0.5 -0.979 17.7-142.1-125.8 118.5 35.1 17.5 144.6 257 285 A R G >4 S+ 0 0 97 -2,-0.4 3,-1.0 1,-0.3 -24,-0.3 0.807 100.5 62.1 -41.2 -44.2 38.6 17.7 145.9 258 286 A N G >4 S+ 0 0 110 1,-0.2 3,-1.6 2,-0.2 -1,-0.3 0.717 86.9 72.1 -58.2 -27.5 39.7 15.0 143.3 259 287 A T G <4 S+ 0 0 94 -3,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.909 103.3 40.9 -58.5 -40.9 38.8 17.3 140.4 260 288 A Y G X< S+ 0 0 12 -3,-1.0 3,-0.8 -4,-0.5 -27,-0.4 -0.070 84.6 140.1-100.2 30.7 41.8 19.6 141.1 261 289 A T T < + 0 0 91 -3,-1.6 3,-0.1 1,-0.2 -3,-0.1 -0.481 69.8 14.5 -70.5 145.5 44.2 16.7 141.9 262 290 A N T 3 S+ 0 0 137 -2,-0.1 2,-0.3 1,-0.1 -1,-0.2 0.902 101.7 108.2 50.6 46.1 47.7 17.2 140.5 263 291 A C < + 0 0 35 -3,-0.8 2,-0.3 -32,-0.1 -30,-0.2 -0.891 38.7 146.6-149.1 129.5 47.3 20.9 139.8 264 292 A S > - 0 0 58 -2,-0.3 4,-1.9 -32,-0.1 -32,-0.2 -0.904 59.9 -88.0-153.5 169.6 48.9 23.7 141.8 265 293 A L H > S+ 0 0 5 -34,-0.7 4,-3.1 -2,-0.3 5,-0.2 0.801 122.5 53.6 -60.6 -33.5 50.5 27.2 141.8 266 294 A I H > S+ 0 0 63 2,-0.2 4,-3.1 1,-0.2 -1,-0.2 0.947 109.9 47.0 -65.7 -49.1 53.9 25.8 140.9 267 295 A K H > S+ 0 0 98 2,-0.2 4,-1.1 1,-0.2 -2,-0.2 0.816 115.7 48.1 -61.9 -31.1 52.5 24.0 137.9 268 296 A Y H X S+ 0 0 13 -4,-1.9 4,-1.0 -38,-0.3 -2,-0.2 0.957 114.9 41.6 -71.5 -54.9 50.6 27.2 136.9 269 297 A M H <>S+ 0 0 1 -4,-3.1 5,-2.1 1,-0.2 3,-0.4 0.849 108.7 60.5 -67.1 -34.1 53.6 29.6 137.2 270 298 A E H ><5S+ 0 0 105 -4,-3.1 3,-1.8 -5,-0.2 -1,-0.2 0.934 101.9 54.8 -52.3 -46.4 55.9 27.1 135.6 271 299 A K H 3<5S+ 0 0 155 -4,-1.1 -1,-0.2 1,-0.3 -2,-0.2 0.801 107.8 49.4 -57.7 -33.0 53.6 27.3 132.5 272 300 A H T 3<5S- 0 0 63 -4,-1.0 -1,-0.3 -3,-0.4 -2,-0.2 0.119 122.2-104.2 -95.9 21.4 54.0 31.1 132.4 273 301 A K T < 5S+ 0 0 186 -3,-1.8 2,-0.5 1,-0.2 -3,-0.2 0.853 76.1 135.4 59.4 39.6 57.8 31.0 132.7 274 302 A V < - 0 0 18 -5,-2.1 -1,-0.2 -8,-0.1 -2,-0.1 -0.991 55.9-126.9-111.5 124.3 58.2 31.9 136.3 275 303 A K > - 0 0 156 -2,-0.5 3,-1.6 1,-0.1 6,-0.4 -0.497 6.6-140.9 -79.6 129.5 60.7 29.6 138.0 276 304 A P T 3 S+ 0 0 35 0, 0.0 -1,-0.1 0, 0.0 -9,-0.0 0.671 99.2 55.5 -68.1 -16.8 59.4 27.9 141.2 277 305 A D T 3 S+ 0 0 132 4,-0.1 2,-0.3 5,-0.0 -2,-0.1 0.072 84.9 113.9 -99.4 24.2 62.8 28.3 143.1 278 306 A S S <> S- 0 0 27 -3,-1.6 4,-2.4 1,-0.1 3,-0.2 -0.665 75.0-127.4 -88.5 149.5 62.8 32.1 142.6 279 307 A K H > S+ 0 0 78 -2,-0.3 4,-2.2 1,-0.2 27,-0.2 0.916 111.5 59.3 -59.0 -42.5 62.5 34.5 145.5 280 308 A A H > S+ 0 0 11 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.851 109.1 41.8 -50.9 -45.6 59.7 36.2 143.5 281 309 A F H > S+ 0 0 1 -6,-0.4 4,-2.5 -3,-0.2 -1,-0.2 0.928 110.5 56.3 -70.0 -46.1 57.6 32.9 143.4 282 310 A H H X S+ 0 0 86 -4,-2.4 4,-0.7 1,-0.2 -2,-0.2 0.818 112.9 42.7 -59.5 -31.6 58.4 32.0 147.0 283 311 A L H >X S+ 0 0 0 -4,-2.2 4,-1.5 2,-0.2 3,-0.8 0.915 109.4 55.2 -72.9 -52.9 57.0 35.4 148.1 284 312 A L H 3X S+ 0 0 0 -4,-2.2 4,-3.7 1,-0.3 3,-0.4 0.892 105.5 55.6 -46.9 -46.7 53.9 35.3 145.7 285 313 A Q H 3< S+ 0 0 71 -4,-2.5 -1,-0.3 1,-0.2 -2,-0.2 0.825 105.0 51.1 -53.2 -42.8 53.0 31.9 147.3 286 314 A K H << S+ 0 0 90 -3,-0.8 10,-1.2 -4,-0.7 3,-0.3 0.742 113.7 44.8 -72.3 -26.5 53.0 33.5 150.8 287 315 A L H < S+ 0 0 0 -4,-1.5 2,-2.1 -3,-0.4 -2,-0.2 0.942 110.3 55.2 -76.9 -54.5 50.7 36.2 149.6 288 316 A L S < S+ 0 0 3 -4,-3.7 2,-0.4 -90,-0.2 -1,-0.2 -0.486 76.6 141.0 -77.8 69.7 48.5 33.7 147.7 289 317 A T - 0 0 33 -2,-2.1 6,-0.2 -3,-0.3 5,-0.1 -0.951 45.9-146.7-109.3 134.8 47.8 31.6 150.8 290 318 A M S S+ 0 0 19 -2,-0.4 -110,-0.3 4,-0.1 -1,-0.1 0.922 81.8 71.5 -76.4 -45.2 44.3 30.3 151.0 291 319 A D S >> S- 0 0 8 -53,-0.2 3,-2.6 1,-0.2 4,-0.6 -0.629 81.5-142.2 -71.3 115.4 43.7 30.3 154.8 292 320 A P G >4 S+ 0 0 25 0, 0.0 3,-0.9 0, 0.0 -1,-0.2 0.818 98.1 54.6 -53.6 -36.6 43.5 34.0 155.6 293 321 A I G 34 S+ 0 0 134 1,-0.2 -2,-0.1 -3,-0.0 -3,-0.1 0.368 103.4 57.9 -79.8 3.9 45.4 33.7 158.9 294 322 A K G <4 S+ 0 0 112 -3,-2.6 -1,-0.2 -5,-0.1 2,-0.2 0.430 83.2 97.8-110.4 -7.3 48.4 31.9 157.1 295 323 A R S << S- 0 0 16 -3,-0.9 -8,-0.2 -4,-0.6 2,-0.1 -0.549 81.1-112.3 -66.0 143.8 49.0 34.8 154.6 296 324 A I - 0 0 27 -10,-1.2 2,-0.1 -2,-0.2 -7,-0.1 -0.433 30.2-109.5 -69.4 156.9 51.9 37.1 155.7 297 325 A T > - 0 0 72 -2,-0.1 4,-1.9 1,-0.1 5,-0.1 -0.350 30.7-105.0 -78.2 166.0 51.2 40.7 156.6 298 326 A S H > S+ 0 0 4 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.896 121.1 53.9 -60.5 -41.9 52.2 43.7 154.4 299 327 A E H > S+ 0 0 108 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.922 108.2 48.6 -57.8 -48.4 55.1 44.5 156.8 300 328 A Q H 4 S+ 0 0 109 1,-0.2 -1,-0.2 2,-0.2 -2,-0.2 0.883 109.1 53.1 -62.7 -41.8 56.5 41.0 156.6 301 329 A A H >< S+ 0 0 0 -4,-1.9 3,-1.9 1,-0.2 -1,-0.2 0.878 103.8 56.2 -61.1 -40.4 56.3 40.9 152.8 302 330 A M H 3< S+ 0 0 21 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.866 105.4 53.5 -59.3 -36.5 58.3 44.2 152.6 303 331 A Q T 3< S+ 0 0 145 -4,-1.4 -1,-0.3 -5,-0.1 -2,-0.2 0.306 82.6 125.4 -79.3 8.6 61.0 42.4 154.6 304 332 A D S X S- 0 0 12 -3,-1.9 3,-2.2 1,-0.1 4,-0.2 -0.486 70.9-124.6 -69.2 138.6 61.1 39.5 152.0 305 333 A P G >> S+ 0 0 66 0, 0.0 3,-1.8 0, 0.0 4,-0.9 0.654 102.4 83.7 -60.1 -17.3 64.6 38.8 150.6 306 334 A Y G >4 S+ 0 0 12 1,-0.3 3,-0.6 -27,-0.2 -26,-0.1 0.858 89.9 52.4 -44.1 -39.5 63.1 39.2 147.1 307 335 A F G <4 S+ 0 0 9 -3,-2.2 -1,-0.3 1,-0.2 -3,-0.0 0.507 107.1 51.5 -83.0 -5.1 63.7 43.0 147.8 308 336 A L G <4 S+ 0 0 141 -3,-1.8 2,-0.2 -4,-0.2 -1,-0.2 0.445 91.3 97.8 -98.3 -8.9 67.4 42.3 148.7 309 337 A E S << S- 0 0 68 -4,-0.9 -3,-0.0 -3,-0.6 0, 0.0 -0.589 92.0 -63.1 -80.3 141.7 67.9 40.3 145.4 310 338 A D S S+ 0 0 146 -2,-0.2 -1,-0.1 1,-0.1 -2,-0.1 -0.477 118.6 45.4 -66.0 132.5 69.5 42.2 142.5 311 339 A P S S- 0 0 60 0, 0.0 -2,-0.2 0, 0.0 -1,-0.1 0.563 82.7-144.7 -89.9 150.3 68.0 44.6 141.3 312 340 A L - 0 0 111 -4,-0.1 -186,-0.1 1,-0.1 -4,-0.1 -0.424 33.6 -95.3 -69.4 147.1 66.8 46.6 144.3 313 341 A P - 0 0 34 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.371 41.5-140.5 -66.1 146.3 63.5 48.3 143.9 314 342 A T - 0 0 62 -192,-0.3 5,-0.0 2,-0.1 0, 0.0 -0.777 15.6-128.0-109.5 150.6 63.7 52.0 142.7 315 343 A S S S+ 0 0 91 -2,-0.3 2,-0.8 1,-0.1 -1,-0.1 0.921 106.1 60.7 -60.7 -47.6 61.7 55.0 143.9 316 344 A D S > S- 0 0 31 1,-0.2 3,-1.5 -152,-0.1 -153,-0.2 -0.788 77.4-158.4 -79.3 110.5 61.0 55.7 140.2 317 345 A V T 3 S+ 0 0 1 -154,-3.5 -191,-0.2 -2,-0.8 -1,-0.2 0.835 89.2 62.7 -55.0 -35.5 59.2 52.5 138.9 318 346 A F T > S- 0 0 11 -156,-0.1 3,-2.7 1,-0.1 -1,-0.2 0.329 102.9-128.4 -82.0 7.1 60.3 53.5 135.4 319 347 A A T < - 0 0 70 -3,-1.5 -2,-0.1 1,-0.3 3,-0.1 0.741 64.2 -65.9 58.8 27.7 64.1 53.2 136.1 320 348 A G T 3 S+ 0 0 61 1,-0.2 -1,-0.3 -158,-0.1 3,-0.1 0.562 105.1 136.0 66.9 12.1 64.7 56.7 134.7 321 349 A C < - 0 0 70 -3,-2.7 -1,-0.2 1,-0.1 2,-0.1 -0.272 66.4 -84.2 -85.7 168.6 63.7 55.3 131.2 322 350 A Q - 0 0 186 -3,-0.1 -1,-0.1 1,-0.1 0, 0.0 -0.476 45.9-121.8 -65.0 143.7 61.4 56.8 128.5 323 351 A I - 0 0 39 -2,-0.1 -1,-0.1 1,-0.1 -165,-0.1 -0.852 26.2-175.1 -96.7 111.5 57.7 56.0 129.3 324 352 A P + 0 0 84 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.526 52.9 102.5 -82.0 -7.0 56.1 54.1 126.3 325 353 A Y S S- 0 0 19 1,-0.1 -216,-0.1 0, 0.0 -2,-0.1 -0.571 74.5-117.4 -82.7 138.5 52.6 54.1 127.8 326 354 A P - 0 0 92 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.349 27.9-100.2 -78.4 157.6 50.2 56.6 126.3 327 355 A K - 0 0 143 1,-0.1 2,-0.2 -2,-0.1 -223,-0.1 -0.296 52.5 -82.8 -68.0 155.7 48.5 59.5 128.2 328 356 A R - 0 0 47 -225,-0.3 -1,-0.1 1,-0.1 2,-0.1 -0.432 47.5-128.3 -67.9 127.8 44.9 59.1 129.4 329 357 A E - 0 0 145 -2,-0.2 -1,-0.1 -3,-0.1 2,-0.1 -0.435 14.5-125.6 -72.7 148.8 42.3 59.8 126.7 330 358 A F 0 0 102 -2,-0.1 -301,-0.2 -292,-0.0 -303,-0.1 -0.230 360.0 360.0 -75.7 179.5 39.4 62.2 127.2 331 359 A L 0 0 131 -303,-0.8 -303,-0.3 -305,-0.3 -301,-0.1 -0.981 360.0 360.0-135.5 360.0 35.8 61.0 126.5 332 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 333 -1 B K > 0 0 153 0, 0.0 3,-1.3 0, 0.0 4,-0.1 0.000 360.0 360.0 360.0 -35.4 39.3 52.1 165.2 334 0 B A T 3 + 0 0 43 1,-0.2 -192,-0.2 2,-0.1 -191,-0.1 -0.290 360.0 2.2 -59.5 145.0 40.4 53.8 162.0 335 1 B M T > S+ 0 0 0 -194,-3.3 3,-1.6 -197,-0.2 -1,-0.2 0.712 86.8 157.5 50.9 27.8 43.3 56.2 162.3 336 2 B A T < + 0 0 45 -3,-1.3 3,-0.1 1,-0.3 -1,-0.1 0.660 68.4 30.7 -65.2 -21.9 43.4 55.2 166.0 337 3 B G T 3 S+ 0 0 68 -197,-0.1 3,-0.3 -4,-0.1 -1,-0.3 0.162 89.8 97.6-119.8 18.8 47.1 56.2 166.7 338 4 B N X + 0 0 9 -3,-1.6 3,-2.1 1,-0.2 4,-0.2 0.235 41.7 120.5 -93.3 14.6 47.6 59.1 164.3 339 5 B F G > S+ 0 0 19 1,-0.3 3,-2.1 2,-0.2 6,-0.5 0.866 72.3 51.5 -50.8 -48.9 47.0 61.9 166.8 340 6 B W G 3 S+ 0 0 123 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.568 119.5 36.8 -70.4 -11.3 50.4 63.6 166.5 341 7 B Q G < S+ 0 0 114 -3,-2.1 -1,-0.3 4,-0.0 -2,-0.2 0.072 99.2 122.5-116.1 18.6 50.0 63.7 162.7 342 8 B S S <> S- 0 0 1 -3,-2.1 4,-2.4 -4,-0.2 5,-0.1 -0.361 71.0-130.5 -81.9 156.5 46.3 64.4 162.9 343 9 B S H >>S+ 0 0 4 2,-0.2 4,-1.7 3,-0.2 5,-0.7 0.829 112.6 60.2 -65.4 -37.7 44.2 67.4 161.6 344 10 B H H >5S+ 0 0 5 141,-0.2 4,-2.2 3,-0.2 3,-0.2 0.977 113.8 33.4 -46.6 -60.1 42.8 67.6 165.1 345 11 B Y H 45S+ 0 0 87 -6,-0.5 4,-0.4 1,-0.2 -2,-0.2 0.865 121.3 46.2 -74.0 -42.1 46.3 68.2 166.6 346 12 B L H <5S+ 0 0 100 -4,-2.4 -1,-0.2 -7,-0.2 -2,-0.2 0.612 133.0 11.9 -80.0 -15.0 47.9 70.2 163.8 347 13 B Q H <5S+ 0 0 80 -4,-1.7 -3,-0.2 -3,-0.2 -2,-0.2 0.549 124.6 49.2-132.4 -17.3 45.0 72.6 163.2 348 14 B W S < - 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0 0 5 -2,-0.3 3,-1.8 1,-0.1 4,-0.5 -0.421 27.3-118.5 -78.8 149.2 30.1 85.0 166.7 412 78 B L T 3 S+ 0 0 9 1,-0.3 -1,-0.1 2,-0.2 -5,-0.0 0.590 113.8 60.8 -60.0 -16.4 26.9 83.6 168.2 413 79 B K T 3 S+ 0 0 60 180,-0.2 -409,-0.9 1,-0.1 -1,-0.3 0.700 85.6 78.1 -78.8 -20.7 24.9 85.9 165.8 414 80 B S S < S- 0 0 4 -3,-1.8 -410,-1.2 1,-0.2 2,-0.3 0.933 113.0 -1.6 -62.9 -57.6 26.4 84.2 162.6 415 81 B I S S- 0 0 0 -4,-0.5 -1,-0.2 -412,-0.2 -412,-0.1 -0.972 89.8 -99.4-125.6 147.5 24.2 81.0 162.7 416 82 B D >> - 0 0 36 -2,-0.3 4,-2.6 -414,-0.3 3,-0.6 -0.440 23.9-141.4 -62.8 128.4 21.6 80.3 165.3 417 83 B P H 3> S+ 0 0 2 0, 0.0 4,-1.8 0, 0.0 -1,-0.1 0.785 102.4 61.4 -64.6 -25.0 23.0 77.8 167.9 418 84 B V H 34 S+ 0 0 13 2,-0.2 -2,-0.1 1,-0.2 46,-0.0 0.842 111.5 39.7 -65.4 -34.1 19.6 76.1 168.1 419 85 B L H <> S+ 0 0 2 -3,-0.6 4,-1.4 2,-0.1 -1,-0.2 0.894 114.9 52.7 -74.2 -43.9 20.1 75.3 164.4 420 86 B M H X S+ 0 0 0 -4,-2.6 4,-1.5 1,-0.2 -2,-0.2 0.738 100.0 63.9 -67.6 -26.3 23.8 74.5 164.8 421 87 B A H >X S+ 0 0 0 -4,-1.8 4,-1.6 2,-0.2 3,-0.6 0.985 107.9 35.6 -64.9 -61.4 23.3 72.0 167.6 422 88 B P H 3> S+ 0 0 3 0, 0.0 4,-3.1 0, 0.0 -1,-0.2 0.839 112.7 62.0 -64.1 -30.5 21.3 69.3 165.8 423 89 B T H 3X S+ 0 0 0 -4,-1.4 4,-2.2 1,-0.2 -2,-0.2 0.882 103.4 50.2 -58.4 -38.0 23.4 70.0 162.6 424 90 B C H S+ 0 0 1 -4,-2.9 5,-1.8 1,-0.2 6,-1.3 0.820 112.0 43.2 -56.9 -33.4 26.4 60.6 163.2 430 96 B K H ><5S+ 0 0 8 -4,-0.9 3,-1.8 -3,-0.4 -2,-0.2 0.946 114.7 47.4 -73.6 -53.0 27.6 60.4 159.5 431 97 B V H 3<5S+ 0 0 17 -4,-2.9 -2,-0.2 1,-0.3 -3,-0.2 0.864 111.7 51.9 -58.0 -39.7 31.4 60.8 160.3 432 98 B E T 3<5S- 0 0 72 -4,-3.5 -1,-0.3 -5,-0.2 -2,-0.1 0.047 111.4-121.7 -90.2 23.4 31.1 58.2 163.2 433 99 B E T < 5S+ 0 0 124 -3,-1.8 -3,-0.2 1,-0.2 -2,-0.1 0.650 78.8 118.5 53.5 30.5 29.5 55.6 160.8 434 100 B F S - 0 0 48 -2,-0.4 4,-3.5 1,-0.1 5,-0.3 -0.122 15.9-114.4 -69.2 156.8 16.3 60.7 158.9 439 105 B N H > S+ 0 0 100 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.959 118.5 38.5 -45.5 -62.4 14.7 64.0 157.9 440 106 B T H > S+ 0 0 113 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.883 118.4 48.1 -58.6 -46.8 11.6 63.2 160.0 441 107 B R H > S+ 0 0 106 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.865 111.6 49.0 -68.8 -37.2 13.5 61.6 162.9 442 108 B L H X S+ 0 0 2 -4,-3.5 4,-2.0 2,-0.2 -2,-0.2 0.949 114.2 44.6 -66.7 -48.3 16.1 64.4 163.2 443 109 B I H X S+ 0 0 35 -4,-2.1 4,-2.5 -5,-0.3 -2,-0.2 0.830 112.9 50.8 -67.6 -35.3 13.5 67.2 163.2 444 110 B A H X S+ 0 0 55 -4,-2.2 4,-2.5 -5,-0.2 -1,-0.2 0.837 108.3 55.0 -65.7 -34.3 11.2 65.3 165.7 445 111 B A H X S+ 0 0 0 -4,-1.6 4,-1.9 2,-0.2 -2,-0.2 0.921 111.8 41.9 -63.8 -47.7 14.3 64.9 167.9 446 112 B A H X S+ 0 0 2 -4,-2.0 4,-2.1 2,-0.2 5,-0.3 0.964 116.5 49.1 -60.2 -54.2 15.0 68.7 167.9 447 113 B T H X S+ 0 0 30 -4,-2.5 4,-1.5 1,-0.2 15,-0.3 0.860 114.4 44.0 -55.6 -44.5 11.3 69.5 168.4 448 114 B S H X S+ 0 0 40 -4,-2.5 4,-2.6 2,-0.2 5,-0.2 0.887 111.8 49.9 -72.9 -44.0 10.8 67.1 171.2 449 115 B V H X>S+ 0 0 1 -4,-1.9 4,-1.8 2,-0.2 5,-1.4 0.923 114.3 43.1 -67.5 -45.9 13.9 67.8 173.3 450 116 B L H <5S+ 0 0 10 -4,-2.1 8,-0.3 -5,-0.2 4,-0.3 0.912 117.9 48.2 -64.2 -39.8 13.5 71.6 173.3 451 117 B K H <5S+ 0 0 144 -4,-1.5 -2,-0.2 -5,-0.3 -1,-0.2 0.858 127.7 25.0 -63.1 -36.9 9.8 71.0 174.0 452 118 B T H ><5S+ 0 0 96 -4,-2.6 3,-0.6 2,-0.1 -3,-0.2 0.941 131.4 28.6 -93.5 -65.3 10.5 68.5 176.8 453 119 B R T 3<5S+ 0 0 115 -4,-1.8 -3,-0.2 -5,-0.2 3,-0.2 0.780 131.5 31.1 -76.4 -31.0 14.0 69.0 178.3 454 120 B F T >>< + 0 0 10 -5,-1.4 4,-1.6 -4,-0.3 3,-1.3 -0.046 68.4 133.9-124.5 31.7 14.3 72.8 177.8 455 121 B S T <4 S+ 0 0 75 -3,-0.6 -1,-0.1 1,-0.3 -2,-0.1 0.835 72.2 60.8 -47.5 -41.5 10.8 74.2 177.9 456 122 B Y T 34 S+ 0 0 55 1,-0.2 -1,-0.3 -3,-0.2 -2,-0.1 0.796 108.7 40.3 -57.8 -37.7 12.0 77.0 180.2 457 123 B A T <4 S+ 0 0 11 -3,-1.3 -1,-0.2 1,-0.2 -2,-0.2 0.790 121.0 41.6 -82.4 -30.3 14.4 78.5 177.6 458 124 B F < + 0 0 43 -4,-1.6 -1,-0.2 -8,-0.3 4,-0.1 -0.889 50.2 167.5-130.2 98.0 12.2 78.0 174.5 459 125 B P + 0 0 127 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.674 69.2 67.9 -83.7 -18.7 8.4 78.8 174.7 460 126 B K S S- 0 0 186 1,-0.1 0, 0.0 -5,-0.0 0, 0.0 -0.751 97.5 -97.0 -96.6 151.6 8.0 78.7 170.9 461 127 B E - 0 0 131 -2,-0.3 -1,-0.1 1,-0.2 -14,-0.1 -0.228 51.1 -81.2 -64.5 151.1 8.3 75.4 169.0 462 128 B F - 0 0 11 -15,-0.3 -1,-0.2 1,-0.1 -15,-0.1 -0.388 49.7-161.8 -49.5 121.4 11.6 74.4 167.3 463 129 B P + 0 0 69 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 0.698 47.2 99.9 -89.4 -22.1 11.3 76.4 164.0 464 130 B Y - 0 0 18 -21,-0.1 2,-0.2 1,-0.1 -18,-0.1 -0.441 50.3-155.9 -84.7 141.5 13.7 74.9 161.5 465 131 B R >> - 0 0 159 -2,-0.2 3,-1.1 1,-0.0 4,-1.1 -0.499 39.2 -91.9 -99.5 175.3 13.0 72.4 158.7 466 132 B M H 3> S+ 0 0 21 1,-0.3 4,-2.4 2,-0.2 5,-0.2 0.804 120.1 63.6 -67.9 -35.1 15.4 70.0 157.1 467 133 B N H 3> S+ 0 0 99 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.851 101.6 55.2 -52.4 -35.8 16.5 72.3 154.3 468 134 B H H <> S+ 0 0 24 -3,-1.1 4,-2.7 2,-0.2 3,-0.4 0.965 106.5 48.2 -62.4 -52.2 18.0 74.5 157.1 469 135 B I H X S+ 0 0 0 -4,-1.1 4,-2.4 1,-0.3 -2,-0.2 0.936 110.9 51.8 -54.4 -50.4 20.0 71.7 158.6 470 136 B L H X S+ 0 0 43 -4,-2.4 4,-1.1 1,-0.2 -1,-0.3 0.845 112.2 46.3 -56.2 -36.4 21.4 70.8 155.1 471 137 B E H X S+ 0 0 53 -4,-1.7 4,-1.4 -3,-0.4 3,-0.4 0.955 112.4 48.2 -71.4 -51.9 22.4 74.4 154.5 472 138 B C H X S+ 0 0 0 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.795 103.6 64.4 -56.2 -34.8 24.1 75.0 157.9 473 139 B E H X S+ 0 0 0 -4,-2.4 4,-2.5 -5,-0.3 -1,-0.2 0.929 100.9 49.2 -56.4 -51.5 26.0 71.7 157.4 474 140 B F H X S+ 0 0 1 -4,-1.1 4,-2.2 -3,-0.4 5,-0.2 0.932 111.5 49.1 -53.5 -49.5 27.9 73.1 154.4 475 141 B Y H X S+ 0 0 7 -4,-1.4 4,-1.6 1,-0.2 -1,-0.2 0.830 113.3 48.7 -60.3 -33.9 28.8 76.2 156.4 476 142 B L H X S+ 0 0 0 -4,-2.1 4,-1.7 2,-0.2 -1,-0.2 0.849 111.3 48.2 -71.6 -38.3 29.9 73.9 159.3 477 143 B L H <>S+ 0 0 0 -4,-2.5 5,-2.5 2,-0.2 6,-0.2 0.813 112.9 48.1 -74.1 -33.8 32.0 71.7 157.0 478 144 B E H ><5S+ 0 0 57 -4,-2.2 3,-1.4 -5,-0.2 -2,-0.2 0.895 110.1 52.4 -70.4 -43.0 33.7 74.6 155.3 479 145 B L H 3<5S+ 0 0 15 -4,-1.6 -2,-0.2 1,-0.3 -1,-0.2 0.891 108.0 50.6 -63.4 -40.6 34.4 76.3 158.7 480 146 B M T ><5S- 0 0 0 -4,-1.7 3,-1.2 -5,-0.1 -1,-0.3 0.478 109.9-123.6 -71.5 -2.2 36.1 73.1 160.0 481 147 B D T < 5 - 0 0 81 -3,-1.4 -3,-0.2 1,-0.2 -2,-0.1 0.888 68.3 -63.7 55.9 39.6 38.3 72.9 156.8 482 148 B C T 3 - 0 0 20 -2,-0.3 3,-0.8 39,-0.0 41,-0.1 -0.890 30.4-115.2-125.4 161.2 38.5 62.0 172.6 489 155 B P T 3> S+ 0 0 2 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.594 95.1 85.1 -70.7 -11.8 39.8 61.2 176.1 490 156 B Y H 3> S+ 0 0 6 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.854 89.1 50.3 -66.5 -35.6 37.8 58.0 176.6 491 157 B R H <> S+ 0 0 115 -3,-0.8 4,-2.4 2,-0.2 5,-0.2 0.978 115.3 39.8 -65.5 -57.7 40.3 55.8 174.8 492 158 B P H > S+ 0 0 20 0, 0.0 4,-2.8 0, 0.0 -2,-0.2 0.911 113.4 57.1 -59.8 -39.5 43.4 57.0 176.7 493 159 B L H X S+ 0 0 0 -4,-2.9 4,-2.3 2,-0.2 5,-0.2 0.962 109.2 45.8 -48.8 -57.6 41.4 57.0 179.9 494 160 B L H X S+ 0 0 55 -4,-2.2 4,-2.3 1,-0.2 5,-0.3 0.941 111.7 50.3 -52.7 -57.4 40.6 53.3 179.5 495 161 B Q H X S+ 0 0 124 -4,-2.4 4,-1.8 1,-0.2 -1,-0.2 0.876 111.6 50.3 -50.0 -43.9 44.1 52.3 178.6 496 162 B Y H X S+ 0 0 51 -4,-2.8 4,-1.7 -5,-0.2 3,-0.5 0.977 110.5 45.8 -61.9 -55.9 45.4 54.1 181.6 497 163 B V H X>S+ 0 0 0 -4,-2.3 4,-1.4 1,-0.3 5,-1.2 0.786 110.8 54.2 -63.9 -28.9 43.0 52.6 184.2 498 164 B Q H <5S+ 0 0 97 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.896 107.3 51.3 -66.0 -40.3 43.6 49.1 182.8 499 165 B D H <5S+ 0 0 116 -4,-1.8 -2,-0.2 -3,-0.5 -1,-0.2 0.824 109.6 50.9 -64.0 -33.8 47.4 49.8 183.3 500 166 B M H <5S- 0 0 30 -4,-1.7 -1,-0.2 -5,-0.1 -2,-0.2 0.802 104.0-133.5 -68.4 -34.7 46.6 50.7 186.9 501 167 B G T <5S+ 0 0 60 -4,-1.4 -3,-0.2 -5,-0.2 3,-0.1 0.694 81.3 99.0 79.7 21.9 44.6 47.5 187.6 502 168 B Q >< + 0 0 75 -5,-1.2 4,-1.2 1,-0.1 5,-0.2 -0.524 34.3 139.8-131.0 61.8 41.7 49.4 189.2 503 169 B E H > + 0 0 73 2,-0.2 4,-1.8 1,-0.2 -5,-0.1 0.880 69.8 52.0 -69.6 -41.1 39.3 49.6 186.3 504 170 B D H 4 S+ 0 0 151 1,-0.2 -1,-0.2 2,-0.2 -2,-0.1 0.860 112.3 42.9 -68.0 -39.1 36.1 48.8 188.4 505 171 B M H 4 S+ 0 0 102 1,-0.1 4,-0.3 2,-0.1 -1,-0.2 0.889 126.7 25.8 -72.8 -39.7 36.7 51.5 191.1 506 172 B L H X S+ 0 0 0 -4,-1.2 4,-3.5 2,-0.1 5,-0.3 0.722 102.1 73.1-104.7 -29.6 37.7 54.4 188.9 507 173 B L H X S+ 0 0 31 -4,-1.8 4,-2.4 -5,-0.2 5,-0.2 0.903 95.5 51.2 -64.2 -46.2 36.3 54.0 185.3 508 174 B P H > S+ 0 0 90 0, 0.0 4,-0.9 0, 0.0 -1,-0.2 0.932 120.3 36.3 -56.2 -44.5 32.7 54.8 186.1 509 175 B L H > S+ 0 0 44 -4,-0.3 4,-2.2 2,-0.2 3,-0.3 0.925 116.8 50.1 -74.9 -48.6 33.7 58.1 187.8 510 176 B A H X S+ 0 0 0 -4,-3.5 4,-2.4 1,-0.2 -3,-0.2 0.923 108.5 54.4 -56.9 -45.6 36.6 59.1 185.6 511 177 B W H X S+ 0 0 81 -4,-2.4 4,-1.7 -5,-0.3 -1,-0.2 0.836 108.7 49.7 -54.1 -38.4 34.4 58.6 182.5 512 178 B R H X S+ 0 0 107 -4,-0.9 4,-2.6 -3,-0.3 -1,-0.2 0.926 107.1 52.3 -70.1 -47.7 31.8 61.0 184.0 513 179 B I H X S+ 0 0 4 -4,-2.2 4,-1.1 1,-0.2 -2,-0.2 0.934 108.1 53.3 -53.7 -44.7 34.4 63.7 184.8 514 180 B V H >X S+ 0 0 0 -4,-2.4 3,-0.8 1,-0.2 4,-0.6 0.909 107.1 50.5 -58.6 -44.1 35.6 63.5 181.2 515 181 B N H >< S+ 0 0 38 -4,-1.7 3,-1.3 1,-0.2 -1,-0.2 0.924 109.1 53.4 -54.9 -46.8 31.9 64.0 179.9 516 182 B D H >< S+ 0 0 18 -4,-2.6 3,-1.4 1,-0.2 -1,-0.2 0.692 93.6 70.1 -63.0 -21.0 31.8 67.0 182.3 517 183 B T H X< S+ 0 0 2 -4,-1.1 3,-2.1 -3,-0.8 5,-0.4 0.785 83.6 71.7 -70.6 -23.4 35.0 68.5 180.7 518 184 B Y T << S+ 0 0 9 -3,-1.3 -1,-0.3 -4,-0.6 -2,-0.2 0.603 80.5 73.5 -67.8 -8.9 33.0 69.2 177.6 519 185 B R T < S+ 0 0 13 -3,-1.4 -1,-0.3 -4,-0.2 2,-0.2 0.544 102.3 51.8 -71.5 -5.1 31.3 71.9 179.6 520 186 B T S < S- 0 0 12 -3,-2.1 3,-0.4 -145,-0.1 4,-0.1 -0.596 96.3-100.0-126.0 179.7 34.7 73.8 179.1 521 187 B D S >> S+ 0 0 30 1,-0.2 3,-2.2 -2,-0.2 4,-0.6 0.516 87.0 107.9 -76.1 -7.3 37.3 74.9 176.5 522 188 B L H >> + 0 0 4 -5,-0.4 4,-1.6 1,-0.3 3,-1.6 0.796 69.5 57.7 -47.2 -44.0 39.6 72.0 177.4 523 189 B C H 34 S+ 0 0 13 -3,-0.4 -1,-0.3 -6,-0.3 -2,-0.1 0.735 108.6 48.3 -64.0 -22.5 38.9 70.0 174.1 524 190 B L H <4 S+ 0 0 2 -3,-2.2 -174,-2.5 -4,-0.1 -1,-0.3 0.614 119.4 38.0 -83.0 -15.1 40.2 73.0 172.1 525 191 B L H << S+ 0 0 30 -3,-1.6 -2,-0.2 -4,-0.6 -3,-0.1 0.524 111.1 41.1-119.5 -9.4 43.3 73.4 174.3 526 192 B Y S < S- 0 0 29 -4,-1.6 -1,-0.2 38,-0.0 5,-0.1 -1.000 80.3-101.2-144.7 142.7 44.8 70.0 175.3 527 193 B P >> - 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