==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 20-SEP-06 2IFC . COMPND 2 MOLECULE: CITRATE SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMOPLASMA ACIDOPHILUM; . AUTHOR C.LEHMANN . 1518 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 55094.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1076 70.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 32 2.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 40 2.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.3 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 . 4 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 . 59 3.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 157 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 714 47.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 38 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 0 0 3 1 12 0 12 0 9 6 4 5 0 0 0 0 0 4 0 3 4 1 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 4 4 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 8 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 E 0 0 180 0, 0.0 2,-0.4 0, 0.0 364,-0.1 0.000 360.0 360.0 360.0 177.7 4.7 -61.8 -74.8 2 5 A E - 0 0 151 2,-0.0 772,-0.5 1,-0.0 2,-0.4 -0.575 360.0-149.2 -85.7 128.4 8.5 -62.0 -75.2 3 6 A I B -a 774 0A 46 -2,-0.4 2,-1.5 770,-0.1 772,-0.2 -0.801 12.6-140.1 -93.9 130.5 10.5 -59.4 -77.3 4 7 A S > - 0 0 27 770,-2.7 3,-2.0 -2,-0.4 2,-0.1 -0.713 30.5-149.6 -84.2 81.5 13.6 -60.6 -79.0 5 8 A K G > S- 0 0 128 -2,-1.5 3,-1.8 1,-0.3 771,-0.1 -0.373 75.1 -7.0 -64.9 124.1 15.5 -57.4 -78.2 6 9 A G G 3 S- 0 0 1 769,-0.4 1118,-2.7 1,-0.3 -1,-0.3 0.575 110.1 -90.4 68.5 12.0 18.2 -56.6 -80.9 7 10 A L G X - 0 0 1 -3,-2.0 3,-2.2 1116,-0.2 -1,-0.3 0.809 69.0-174.8 51.2 30.6 17.3 -60.0 -82.4 8 11 A E T < - 0 0 80 -3,-1.8 -1,-0.2 1,-0.3 3,-0.1 -0.321 66.4 -3.8 -62.9 132.0 20.1 -61.2 -80.0 9 12 A D T 3 S+ 0 0 109 1115,-0.4 2,-0.5 1,-0.2 -1,-0.3 0.561 98.5 136.1 57.1 9.8 20.9 -64.9 -80.6 10 13 A V < - 0 0 12 -3,-2.2 1116,-3.1 1114,-0.1 2,-0.7 -0.774 52.5-137.5 -81.1 130.3 17.9 -65.1 -83.2 11 14 A N E +cd 7661126B 7 754,-0.5 756,-3.0 -2,-0.5 1116,-0.2 -0.817 23.5 179.0 -89.8 115.6 19.0 -67.1 -86.3 12 15 A I E - 0 0 2 1114,-2.5 757,-0.4 -2,-0.7 2,-0.3 0.657 64.8 -14.5 -91.0 -19.2 17.7 -65.3 -89.3 13 16 A K E - d 01127B 1 1113,-0.6 1115,-2.0 755,-0.1 2,-0.3 -0.948 66.2-105.4-162.7 172.2 19.2 -67.7 -92.0 14 17 A W E - d 01128B 48 -2,-0.3 2,-0.3 1113,-0.2 1115,-0.2 -0.773 40.1-167.9-102.8 156.0 21.7 -70.6 -92.4 15 18 A T E - d 01129B 0 1113,-2.5 1115,-2.9 -2,-0.3 1116,-0.6 -0.993 34.8-169.1-148.2 147.3 25.0 -69.8 -94.2 16 19 A R S S+ 0 0 101 -2,-0.3 14,-0.1 1114,-0.2 3,-0.1 0.320 81.1 77.1 -97.8 -7.2 27.9 -71.5 -95.7 17 20 A L S S+ 0 0 19 1,-0.2 13,-2.0 12,-0.1 2,-0.4 0.882 96.8 6.8 -84.3 -42.2 29.8 -68.3 -96.1 18 21 A T E -E 29 0C 0 11,-0.2 2,-0.4 12,-0.1 -1,-0.2 -1.000 50.6-163.6-150.1 136.1 31.3 -67.2 -92.8 19 22 A T E -E 28 0C 31 9,-2.2 9,-2.2 -2,-0.4 2,-0.4 -0.967 6.5-163.6-122.7 143.2 31.6 -68.5 -89.2 20 23 A I E -E 27 0C 11 -2,-0.4 2,-0.7 7,-0.2 7,-0.2 -0.997 7.3-162.7-124.9 124.2 32.5 -66.6 -86.1 21 24 A D E >> -E 26 0C 52 5,-2.9 4,-1.7 -2,-0.4 5,-1.5 -0.937 7.1-170.2-104.0 106.0 33.7 -68.1 -82.8 22 25 A G T 45S+ 0 0 11 -2,-0.7 241,-2.6 3,-0.2 242,-0.2 0.690 82.1 44.9 -68.4 -26.4 33.1 -65.3 -80.3 23 26 A N T 45S+ 0 0 132 239,-0.2 -1,-0.2 240,-0.1 -2,-0.0 0.880 121.2 34.2 -86.1 -42.2 35.0 -67.1 -77.5 24 27 A K T 45S- 0 0 158 2,-0.1 -2,-0.2 240,-0.1 -1,-0.1 0.742 104.3-124.9 -82.9 -21.2 38.1 -68.3 -79.4 25 28 A G T <5 + 0 0 6 -4,-1.7 2,-0.4 1,-0.2 -3,-0.2 0.943 54.5 151.3 73.4 51.1 38.2 -65.3 -81.7 26 29 A I E < -E 21 0C 38 -5,-1.5 -5,-2.9 240,-0.1 2,-0.4 -0.949 25.9-173.7-123.7 136.1 38.2 -67.1 -85.0 27 30 A L E -E 20 0C 0 -2,-0.4 7,-2.3 -7,-0.2 2,-0.4 -0.998 11.1-177.8-127.0 115.4 36.7 -65.7 -88.2 28 31 A R E -EF 19 33C 49 -9,-2.2 -9,-2.2 -2,-0.4 2,-0.7 -0.972 19.9-151.2-121.6 143.6 36.6 -68.1 -91.2 29 32 A Y E > S-EF 18 32C 0 3,-2.9 3,-2.1 -2,-0.4 -11,-0.2 -0.952 86.0 -27.5-109.6 107.9 35.5 -67.5 -94.8 30 33 A G T 3 S- 0 0 7 -13,-2.0 -1,-0.2 -2,-0.7 -12,-0.1 0.854 131.2 -43.0 55.3 40.7 34.1 -70.8 -96.3 31 34 A G T 3 S+ 0 0 0 1,-0.2 1104,-2.5 1101,-0.2 2,-0.5 0.224 116.8 111.8 89.5 -14.5 36.4 -72.8 -93.9 32 35 A Y E < -F 29 0C 18 -3,-2.1 -3,-2.9 1102,-0.2 -1,-0.2 -0.849 64.7-131.8 -96.5 125.2 39.6 -70.6 -94.3 33 36 A S E > -F 28 0C 12 -2,-0.5 4,-2.7 1102,-0.4 -5,-0.2 -0.333 15.4-127.0 -69.7 144.5 40.7 -68.6 -91.3 34 37 A V H > S+ 0 0 0 -7,-2.3 4,-2.5 1,-0.2 5,-0.3 0.882 111.5 58.4 -61.4 -29.0 41.5 -64.9 -92.0 35 38 A E H > S+ 0 0 69 -8,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.928 109.4 43.8 -59.9 -44.0 44.9 -65.4 -90.4 36 39 A D H > S+ 0 0 24 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.906 111.8 54.3 -69.3 -44.9 45.7 -68.2 -93.0 37 40 A I H <>S+ 0 0 0 -4,-2.7 5,-1.9 2,-0.2 -2,-0.2 0.948 115.6 37.2 -52.9 -54.7 44.3 -66.1 -95.8 38 41 A I H ><5S+ 0 0 35 -4,-2.5 3,-1.7 1,-0.2 -2,-0.2 0.921 114.8 53.3 -69.2 -47.8 46.5 -63.1 -95.1 39 42 A A H 3<5S+ 0 0 89 -4,-2.6 -1,-0.2 -5,-0.3 -2,-0.2 0.836 109.0 52.4 -50.2 -34.2 49.6 -65.1 -94.1 40 43 A S T 3<5S- 0 0 52 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.427 113.5-119.6 -85.0 -3.7 49.3 -67.0 -97.5 41 44 A G T < 5 - 0 0 54 -3,-1.7 -3,-0.2 -4,-0.2 -2,-0.1 0.810 41.9-172.9 67.1 37.2 49.2 -63.7 -99.4 42 45 A A < - 0 0 3 -5,-1.9 2,-0.3 -6,-0.2 -1,-0.1 -0.215 23.6-120.4 -60.5 144.7 45.7 -64.3 -101.0 43 46 A Q >> - 0 0 57 1,-0.1 4,-1.3 136,-0.0 3,-1.1 -0.698 18.7-125.5 -79.9 140.6 44.5 -61.8 -103.6 44 47 A D H 3> S+ 0 0 4 -2,-0.3 4,-2.6 1,-0.3 3,-0.5 0.904 111.6 61.5 -57.6 -31.8 41.3 -60.1 -102.6 45 48 A E H 3> S+ 0 0 6 1,-0.3 4,-2.3 2,-0.2 -1,-0.3 0.839 98.4 57.4 -65.5 -31.6 39.8 -61.3 -106.0 46 49 A E H <> S+ 0 0 2 -3,-1.1 4,-2.1 2,-0.2 -1,-0.3 0.869 108.6 45.5 -59.7 -40.7 40.4 -64.9 -104.8 47 50 A I H X S+ 0 0 0 -4,-1.3 4,-2.4 -3,-0.5 -2,-0.2 0.920 109.0 54.1 -74.9 -41.1 38.2 -64.2 -101.7 48 51 A Q H X S+ 0 0 1 -4,-2.6 4,-1.6 2,-0.2 5,-0.2 0.950 111.2 48.1 -48.8 -53.1 35.5 -62.4 -103.7 49 52 A Y H X S+ 0 0 21 -4,-2.3 4,-3.2 1,-0.2 5,-0.5 0.910 107.3 55.6 -56.5 -45.5 35.4 -65.6 -105.8 50 53 A L H X S+ 0 0 6 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.890 109.8 47.3 -52.6 -47.7 35.3 -67.8 -102.7 51 54 A F H < S+ 0 0 8 -4,-2.4 -1,-0.2 2,-0.2 -2,-0.2 0.842 117.5 38.5 -61.1 -40.6 32.2 -65.9 -101.6 52 55 A L H < S+ 0 0 9 -4,-1.6 -2,-0.2 -3,-0.2 -1,-0.2 0.801 131.3 26.7 -87.0 -27.2 30.3 -66.0 -104.8 53 56 A Y H < S- 0 0 86 -4,-3.2 -3,-0.2 2,-0.2 -2,-0.2 0.645 97.1-121.0-110.7 -24.2 31.3 -69.6 -105.8 54 57 A G S < S+ 0 0 35 -4,-2.2 2,-0.3 -5,-0.5 -4,-0.2 0.267 84.0 60.3 99.2 -8.8 32.1 -71.5 -102.6 55 58 A N S S- 0 0 87 -6,-0.3 -2,-0.2 -8,-0.0 -1,-0.2 -0.971 92.0 -90.1-140.8 160.8 35.7 -72.5 -103.4 56 59 A L - 0 0 15 -2,-0.3 -9,-0.1 1,-0.1 2,-0.1 -0.454 55.2-113.2 -65.7 141.1 39.0 -70.8 -104.2 57 60 A P - 0 0 0 0, 0.0 2,-0.1 0, 0.0 1086,-0.1 -0.363 16.9-120.7 -77.5 154.8 39.4 -70.3 -108.0 58 61 A T > - 0 0 32 1086,-0.1 4,-3.1 1,-0.1 5,-0.3 -0.421 40.3 -97.7 -73.6 167.2 41.8 -72.0 -110.3 59 62 A E H > S+ 0 0 105 1081,-0.4 4,-2.4 1084,-0.3 5,-0.2 0.937 128.0 46.4 -51.7 -45.5 44.1 -69.7 -112.3 60 63 A Q H > S+ 0 0 133 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.908 112.0 49.9 -66.6 -42.4 41.7 -70.0 -115.3 61 64 A E H > S+ 0 0 76 2,-0.2 4,-3.0 1,-0.2 -1,-0.2 0.911 111.8 48.8 -61.2 -44.5 38.6 -69.3 -113.2 62 65 A L H X S+ 0 0 5 -4,-3.1 4,-3.0 2,-0.2 5,-0.2 0.894 108.4 52.8 -65.6 -42.6 40.3 -66.2 -111.6 63 66 A R H X S+ 0 0 130 -4,-2.4 4,-1.4 -5,-0.3 -1,-0.2 0.945 114.4 42.6 -56.0 -50.1 41.4 -64.8 -115.0 64 67 A K H X S+ 0 0 123 -4,-2.2 4,-1.7 2,-0.2 3,-0.3 0.946 113.3 52.9 -59.6 -49.3 37.7 -65.1 -116.1 65 68 A Y H X S+ 0 0 5 -4,-3.0 4,-2.3 1,-0.2 3,-0.4 0.916 106.1 52.7 -53.1 -53.0 36.4 -63.8 -112.8 66 69 A K H X S+ 0 0 46 -4,-3.0 4,-2.6 1,-0.2 -1,-0.2 0.850 105.8 55.2 -55.5 -38.4 38.7 -60.6 -112.9 67 70 A E H X S+ 0 0 126 -4,-1.4 4,-0.9 -3,-0.3 -1,-0.2 0.918 108.2 48.4 -60.8 -41.1 37.4 -59.8 -116.5 68 71 A T H >< S+ 0 0 12 -4,-1.7 3,-1.0 -3,-0.4 4,-0.5 0.932 110.6 49.9 -65.3 -44.3 33.8 -59.9 -115.2 69 72 A V H >< S+ 0 0 1 -4,-2.3 3,-2.3 1,-0.3 4,-0.2 0.929 105.2 59.0 -62.4 -43.0 34.6 -57.6 -112.2 70 73 A Q H >< S+ 0 0 51 -4,-2.6 3,-1.5 1,-0.3 4,-0.3 0.712 89.0 71.5 -63.5 -20.2 36.4 -55.2 -114.6 71 74 A K G X< S+ 0 0 131 -3,-1.0 3,-1.0 -4,-0.9 -1,-0.3 0.797 91.9 61.2 -55.8 -28.6 33.1 -54.7 -116.6 72 75 A G G < S+ 0 0 0 -3,-2.3 -1,-0.2 -4,-0.5 58,-0.2 0.535 79.5 83.6 -80.7 -6.2 31.9 -52.8 -113.5 73 76 A Y G < S+ 0 0 6 -3,-1.5 2,-0.6 -4,-0.2 -1,-0.2 0.699 83.0 69.9 -72.4 -17.3 34.7 -50.2 -113.9 74 77 A K < + 0 0 137 -3,-1.0 53,-0.1 -4,-0.3 -1,-0.1 -0.892 66.1 168.0 -98.6 117.3 32.5 -48.5 -116.4 75 78 A I - 0 0 13 -2,-0.6 5,-0.1 55,-0.1 -3,-0.0 -0.949 38.7 -93.4-124.4 153.9 29.4 -46.8 -114.7 76 79 A P >> - 0 0 58 0, 0.0 4,-1.5 0, 0.0 3,-1.0 -0.263 29.4-116.1 -68.3 154.4 27.0 -44.4 -116.3 77 80 A D H 3> S+ 0 0 139 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.837 114.2 58.6 -48.5 -40.4 27.3 -40.6 -116.0 78 81 A F H 3> S+ 0 0 41 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.801 103.0 53.4 -69.4 -28.2 24.1 -40.3 -114.0 79 82 A V H <> S+ 0 0 0 -3,-1.0 4,-0.8 2,-0.2 -1,-0.2 0.932 110.8 45.5 -66.4 -42.4 25.5 -42.6 -111.4 80 83 A I H >X S+ 0 0 19 -4,-1.5 4,-2.8 1,-0.2 3,-1.1 0.924 112.9 52.2 -66.2 -38.4 28.6 -40.4 -111.0 81 84 A N H 3X S+ 0 0 60 -4,-2.8 4,-2.6 1,-0.3 -1,-0.2 0.852 96.5 66.0 -70.6 -27.2 26.2 -37.4 -111.0 82 85 A A H 3< S+ 0 0 4 -4,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.830 113.7 34.4 -58.4 -28.3 24.2 -39.0 -108.2 83 86 A I H X< S+ 0 0 0 -3,-1.1 3,-2.0 -4,-0.8 -2,-0.2 0.916 117.4 50.6 -87.3 -54.2 27.4 -38.5 -106.1 84 87 A R H 3< S+ 0 0 80 -4,-2.8 -3,-0.2 1,-0.3 -2,-0.2 0.759 102.9 60.8 -69.5 -19.4 28.7 -35.2 -107.6 85 88 A Q T 3< S+ 0 0 35 -4,-2.6 -1,-0.3 -5,-0.2 -2,-0.1 0.585 88.5 93.3 -76.0 -15.0 25.4 -33.3 -107.2 86 89 A L S < S- 0 0 5 -3,-2.0 780,-0.1 -5,-0.2 -3,-0.0 -0.518 93.0 -88.5 -77.5 153.8 25.4 -33.8 -103.4 87 90 A P > - 0 0 38 0, 0.0 3,-2.0 0, 0.0 -1,-0.1 -0.340 36.6-126.0 -55.9 134.2 26.8 -31.3 -100.9 88 91 A R T 3 S+ 0 0 75 1,-0.3 -2,-0.1 -4,-0.1 53,-0.0 0.654 106.9 66.9 -58.3 -20.3 30.5 -32.0 -100.4 89 92 A E T 3 S+ 0 0 123 780,-0.1 -1,-0.3 2,-0.1 241,-0.1 0.488 75.7 117.2 -79.7 -6.2 30.0 -32.3 -96.6 90 93 A S S < S- 0 0 0 -3,-2.0 779,-0.1 1,-0.1 778,-0.1 -0.319 79.2 -97.3 -61.3 144.8 27.8 -35.4 -97.0 91 94 A D > - 0 0 39 777,-0.5 4,-2.0 1,-0.1 3,-0.4 -0.394 28.9-124.2 -61.0 145.5 29.2 -38.6 -95.4 92 95 A A H > S+ 0 0 0 238,-3.1 4,-2.4 1,-0.2 5,-0.1 0.892 111.9 51.8 -56.8 -45.6 31.1 -40.8 -97.9 93 96 A V H > S+ 0 0 1 237,-0.3 4,-2.3 238,-0.3 -1,-0.2 0.838 107.7 53.0 -68.7 -25.7 28.8 -43.9 -97.2 94 97 A A H > S+ 0 0 0 -3,-0.4 4,-2.5 2,-0.2 774,-0.3 0.904 106.6 52.3 -76.3 -35.9 25.7 -41.7 -97.8 95 98 A M H X S+ 0 0 0 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.942 108.8 50.8 -60.0 -48.2 27.1 -40.7 -101.2 96 99 A Q H X S+ 0 0 0 -4,-2.4 4,-2.9 2,-0.2 5,-0.3 0.930 109.1 52.1 -52.8 -44.8 27.6 -44.4 -102.0 97 100 A M H X S+ 0 0 1 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.903 108.5 49.4 -62.6 -43.9 23.9 -45.0 -101.0 98 101 A A H X S+ 0 0 3 -4,-2.5 4,-1.7 766,-0.3 -1,-0.2 0.881 113.1 47.2 -59.8 -36.3 22.7 -42.3 -103.3 99 102 A A H X S+ 0 0 0 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.925 113.8 46.1 -74.0 -45.1 24.7 -43.7 -106.2 100 103 A V H X S+ 0 0 0 -4,-2.9 4,-3.1 2,-0.2 -2,-0.2 0.893 110.7 53.9 -66.6 -37.0 23.6 -47.3 -105.6 101 104 A A H X S+ 0 0 0 -4,-2.4 4,-2.3 -5,-0.3 760,-0.3 0.924 108.1 49.7 -61.7 -40.7 20.0 -46.2 -105.3 102 105 A A H X S+ 0 0 2 -4,-1.7 4,-1.9 1,-0.2 -2,-0.2 0.943 112.7 48.2 -60.0 -47.3 20.2 -44.4 -108.7 103 106 A M H X S+ 0 0 2 -4,-2.3 4,-1.5 1,-0.2 -2,-0.2 0.914 107.0 55.2 -57.5 -47.1 21.7 -47.7 -110.0 104 107 A A H < S+ 0 0 0 -4,-3.1 3,-0.4 1,-0.2 -1,-0.2 0.915 108.4 50.4 -52.8 -48.0 18.9 -49.8 -108.4 105 108 A A H < S+ 0 0 2 -4,-2.3 749,-0.5 752,-0.3 -1,-0.2 0.923 112.3 44.9 -54.6 -48.8 16.3 -47.6 -110.2 106 109 A S H < S+ 0 0 26 -4,-1.9 2,-2.0 1,-0.2 3,-0.2 0.658 92.3 83.7 -70.9 -22.0 18.0 -47.9 -113.7 107 110 A E >< + 0 0 51 -4,-1.5 3,-1.8 -3,-0.4 -1,-0.2 -0.343 50.3 151.3 -87.2 61.9 18.5 -51.7 -113.4 108 111 A T T 3 + 0 0 78 -2,-2.0 -1,-0.2 1,-0.3 -2,-0.1 0.673 64.6 55.6 -76.4 -11.8 15.0 -52.5 -114.6 109 112 A K T 3 S+ 0 0 191 -3,-0.2 -1,-0.3 2,-0.0 2,-0.1 0.384 74.2 128.2-100.1 6.3 15.9 -55.9 -116.1 110 113 A F < + 0 0 30 -3,-1.8 2,-0.3 -6,-0.1 92,-0.0 -0.387 31.8 173.4 -60.1 132.4 17.5 -57.3 -113.0 111 114 A K - 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0 0 66 1,-0.1 4,-2.7 -2,-0.1 5,-0.2 -0.416 24.8-108.8 -83.9 161.8 53.3 -48.4 -104.1 168 171 A K H > S+ 0 0 165 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.883 120.8 52.0 -52.0 -43.6 53.6 -52.1 -103.6 169 172 A E H > S+ 0 0 68 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.897 110.6 46.7 -63.4 -41.4 53.2 -51.5 -99.8 170 173 A E H > S+ 0 0 20 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.908 112.6 49.7 -70.1 -41.3 50.1 -49.4 -100.2 171 174 A I H X S+ 0 0 23 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.933 111.1 48.4 -66.5 -43.6 48.5 -51.9 -102.6 172 175 A D H X S+ 0 0 75 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.895 111.7 50.6 -63.3 -42.7 49.2 -54.9 -100.3 173 176 A A H X S+ 0 0 1 -4,-2.0 4,-2.7 -5,-0.2 -1,-0.2 0.937 112.2 46.0 -58.1 -48.1 47.7 -53.1 -97.3 174 177 A M H X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.905 110.0 55.0 -63.5 -41.9 44.6 -52.2 -99.2 175 178 A N H X S+ 0 0 16 -4,-2.7 4,-2.1 2,-0.2 -1,-0.2 0.910 109.0 47.7 -55.6 -45.5 44.3 -55.7 -100.4 176 179 A T H X S+ 0 0 5 -4,-2.4 4,-3.1 2,-0.2 -2,-0.2 0.943 111.1 50.6 -58.6 -47.7 44.5 -56.9 -96.8 177 180 A A H X S+ 0 0 0 -4,-2.7 4,-1.9 1,-0.2 -2,-0.2 0.907 108.6 51.6 -60.7 -44.3 41.8 -54.4 -95.7 178 181 A L H < S+ 0 0 1 -4,-2.6 4,-0.4 1,-0.2 -1,-0.2 0.912 113.3 46.1 -60.8 -40.9 39.5 -55.5 -98.5 179 182 A I H >< S+ 0 0 0 -4,-2.1 3,-1.5 -5,-0.2 4,-0.3 0.953 111.5 50.6 -63.7 -50.0 39.9 -59.1 -97.4 180 183 A L H 3< S+ 0 0 0 -4,-3.1 -1,-0.2 1,-0.3 3,-0.2 0.744 115.1 41.9 -64.9 -25.9 39.4 -58.4 -93.8 181 184 A Y T 3< S+ 0 0 1 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.368 83.2 106.1 -95.5 2.0 36.2 -56.4 -94.3 182 185 A T S < S- 0 0 1 -3,-1.5 162,-1.5 -4,-0.4 2,-0.3 0.863 90.7 -16.1 -53.1 -44.5 34.7 -58.8 -96.9 183 186 A D - 0 0 0 -4,-0.3 -1,-0.2 -3,-0.2 3,-0.1 -0.994 38.8-176.2-160.5 150.4 32.1 -60.3 -94.6 184 187 A H - 0 0 4 1,-0.3 2,-0.5 -2,-0.3 -1,-0.0 -0.056 52.9-108.3-145.8 43.2 31.0 -60.8 -91.0 185 188 A E S S- 0 0 3 1,-0.2 -1,-0.3 -166,-0.1 941,-0.1 -0.581 85.2 -13.8 68.9-117.0 27.9 -63.1 -91.2 186 189 A V S S+ 0 0 0 -2,-0.5 -1,-0.2 939,-0.2 -174,-0.1 -0.345 76.5 157.3-126.1 63.8 24.7 -61.1 -90.3 187 190 A P > - 0 0 9 0, 0.0 4,-2.8 0, 0.0 5,-0.2 -0.060 64.7 -81.7 -67.1-178.8 25.6 -57.7 -88.8 188 191 A A H > S+ 0 0 1 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.868 129.8 50.3 -62.0 -41.6 23.0 -54.9 -89.0 189 192 A S H > S+ 0 0 0 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.966 113.9 44.0 -60.4 -52.1 23.9 -53.9 -92.6 190 193 A T H > S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.918 113.7 53.2 -58.9 -42.5 23.7 -57.4 -94.0 191 194 A T H X S+ 0 0 0 -4,-2.8 4,-2.6 2,-0.2 -1,-0.2 0.920 107.8 48.9 -59.2 -48.0 20.5 -57.9 -92.0 192 195 A A H X S+ 0 0 0 -4,-2.8 4,-2.1 -5,-0.2 -1,-0.2 0.944 111.8 49.2 -58.5 -42.1 18.8 -54.9 -93.5 193 196 A G H X S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 5,-0.2 0.888 109.7 53.3 -61.7 -41.6 19.8 -55.9 -97.0 194 197 A L H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.912 105.8 51.9 -61.2 -45.3 18.4 -59.4 -96.2 195 198 A V H < S+ 0 0 1 -4,-2.6 4,-0.4 2,-0.2 165,-0.4 0.936 112.4 48.0 -52.4 -49.7 15.1 -57.9 -95.2 196 199 A A H ><>S+ 0 0 0 -4,-2.1 3,-1.3 1,-0.2 5,-1.1 0.930 113.6 43.5 -57.5 -50.0 15.0 -56.0 -98.5 197 200 A V H ><5S+ 0 0 0 -4,-2.6 3,-2.1 1,-0.3 -1,-0.2 0.734 98.2 75.9 -75.9 -15.9 15.9 -58.9 -100.8 198 201 A S T 3<5S+ 0 0 0 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.692 93.1 53.3 -63.6 -23.2 13.4 -61.1 -98.8 199 202 A T T < 5S- 0 0 0 -3,-1.3 782,-2.7 -4,-0.4 783,-0.4 0.385 126.8-107.7 -84.3 5.3 10.6 -59.2 -100.7 200 203 A L T < 5 + 0 0 55 -3,-2.1 -3,-0.2 779,-0.2 -88,-0.2 0.609 67.0 159.0 64.8 25.3 12.5 -60.3 -103.9 201 204 A S < - 0 0 1 -5,-1.1 -1,-0.2 778,-0.2 775,-0.1 -0.217 49.2 -82.9 -63.1 161.9 13.6 -56.6 -104.3 202 205 A D > - 0 0 5 773,-0.1 4,-2.2 1,-0.1 3,-0.2 -0.214 33.8-107.3 -74.9 165.5 16.7 -56.4 -106.6 203 206 A M H > S+ 0 0 0 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.820 118.6 53.7 -56.7 -41.4 20.4 -56.8 -105.5 204 207 A Y H > S+ 0 0 7 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.887 106.6 50.4 -67.0 -37.9 21.1 -53.1 -105.8 205 208 A S H > S+ 0 0 0 -3,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.887 108.2 54.4 -64.8 -38.9 18.2 -52.2 -103.5 206 209 A G H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.944 109.6 47.0 -57.2 -40.6 19.6 -54.8 -101.0 207 210 A I H X S+ 0 0 0 -4,-2.0 4,-2.8 2,-0.2 -2,-0.2 0.907 110.2 54.0 -68.1 -44.3 23.0 -53.0 -101.1 208 211 A T H X S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.942 109.4 46.0 -53.7 -53.1 21.1 -49.6 -100.7 209 212 A A H X S+ 0 0 0 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.907 112.2 52.5 -57.2 -41.4 19.3 -50.9 -97.5 210 213 A A H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.931 109.1 48.9 -60.5 -45.1 22.7 -52.3 -96.2 211 214 A L H X S+ 0 0 1 -4,-2.8 4,-2.0 2,-0.2 -2,-0.2 0.901 106.3 58.0 -62.6 -39.8 24.4 -48.9 -96.7 212 215 A A H < S+ 0 0 0 -4,-2.4 4,-0.3 1,-0.2 -1,-0.2 0.903 111.5 41.8 -56.1 -44.9 21.5 -47.2 -94.9 213 216 A A H >< S+ 0 0 0 -4,-1.9 3,-1.7 1,-0.2 7,-0.4 0.906 109.5 56.9 -69.7 -45.5 22.2 -49.3 -91.8 214 217 A L H 3< S+ 0 0 0 -4,-2.5 6,-1.0 1,-0.3 5,-0.2 0.808 94.5 70.4 -55.7 -30.7 26.0 -49.0 -92.1 215 218 A K T 3< S+ 0 0 35 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.740 77.9 95.7 -56.8 -30.8 25.6 -45.2 -91.9 216 219 A G S X> S- 0 0 0 -3,-1.7 3,-2.1 -4,-0.3 4,-2.0 -0.411 82.5-124.6 -72.6 148.3 24.6 -45.3 -88.3 217 220 A P T 34 S+ 0 0 74 0, 0.0 746,-0.2 0, 0.0 -1,-0.1 0.589 108.0 65.4 -70.1 -10.6 27.4 -44.7 -85.7 218 221 A L T 34 S+ 0 0 67 744,-2.5 745,-0.1 3,-0.0 3,-0.1 0.393 123.4 16.0 -85.6 1.9 26.6 -48.0 -83.9 219 222 A H T <4 S+ 0 0 28 -3,-2.1 3,-0.4 1,-0.4 -5,-0.2 0.468 128.9 35.0-132.4 -64.2 27.8 -49.8 -87.1 220 223 A G S < S+ 0 0 1 -4,-2.0 -1,-0.4 -6,-1.0 -5,-0.1 -0.222 99.7 46.1 -81.3 175.0 29.8 -47.4 -89.4 221 224 A G S > S+ 0 0 15 110,-0.2 4,-2.6 1,-0.1 -1,-0.2 0.312 71.5 113.9 82.9 -5.7 32.1 -44.6 -88.3 222 225 A A H > S+ 0 0 16 -3,-0.4 4,-2.5 2,-0.2 5,-0.2 0.810 73.3 53.3 -74.9 -33.3 34.1 -46.5 -85.6 223 226 A A H > S+ 0 0 2 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.944 114.6 44.7 -67.6 -38.2 37.5 -46.5 -87.4 224 227 A E H > S+ 0 0 6 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.927 111.9 51.4 -64.5 -49.5 37.1 -42.7 -87.7 225 228 A A H X S+ 0 0 30 -4,-2.6 4,-2.3 2,-0.2 -1,-0.2 0.856 108.8 52.5 -57.5 -40.3 35.9 -42.4 -84.1 226 229 A A H X S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.965 110.2 46.6 -61.9 -51.7 39.0 -44.4 -82.9 227 230 A I H X S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.927 111.1 53.9 -54.9 -44.9 41.5 -42.0 -84.8 228 231 A A H X S+ 0 0 42 -4,-2.5 4,-1.7 1,-0.2 -1,-0.2 0.886 108.6 47.9 -59.8 -42.8 39.6 -39.0 -83.3 229 232 A Q H X S+ 0 0 4 -4,-2.3 4,-1.9 2,-0.2 -1,-0.2 0.901 111.2 50.4 -65.6 -39.9 40.0 -40.3 -79.8 230 233 A F H X S+ 0 0 1 -4,-2.4 4,-1.6 1,-0.2 -2,-0.2 0.904 110.1 51.3 -59.3 -40.7 43.7 -41.0 -80.4 231 234 A D H < S+ 0 0 56 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.794 106.7 53.9 -69.5 -31.4 44.0 -37.4 -81.7 232 235 A E H < S+ 0 0 85 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.881 104.0 54.8 -63.3 -46.4 42.3 -36.0 -78.6 233 236 A I H < S+ 0 0 5 -4,-1.9 2,-1.9 1,-0.2 -2,-0.2 0.909 83.7 177.3 -57.5 -43.5 44.8 -37.7 -76.4 234 237 A K < + 0 0 157 -4,-1.6 -1,-0.2 -5,-0.1 -2,-0.1 -0.176 56.1 41.6 79.1 -44.8 47.5 -35.9 -78.5 235 238 A D S > S- 0 0 70 -2,-1.9 3,-1.7 -3,-0.1 4,-0.2 -0.994 77.2-129.5-139.0 139.3 50.6 -37.1 -76.6 236 239 A P G > S+ 0 0 48 0, 0.0 3,-1.2 0, 0.0 4,-0.3 0.767 107.1 61.9 -66.9 -21.8 51.4 -40.6 -75.3 237 240 A A G 3 S+ 0 0 75 1,-0.2 4,-0.3 2,-0.1 3,-0.2 0.700 100.8 56.3 -71.8 -16.8 52.3 -39.4 -71.8 238 241 A M G <> S+ 0 0 86 -3,-1.7 4,-2.4 1,-0.2 -1,-0.2 0.373 79.1 97.7 -94.3 0.1 48.7 -38.1 -71.6 239 242 A V H <> S+ 0 0 0 -3,-1.2 4,-2.8 1,-0.2 5,-0.2 0.937 82.8 44.8 -57.3 -50.6 47.1 -41.5 -72.2 240 243 A E H > S+ 0 0 92 -4,-0.3 4,-2.9 -3,-0.2 5,-0.2 0.922 114.4 49.0 -65.3 -43.6 46.4 -42.5 -68.7 241 244 A K H > S+ 0 0 123 -4,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.917 112.9 47.2 -57.9 -47.2 45.0 -39.1 -67.7 242 245 A W H X>S+ 0 0 23 -4,-2.4 4,-1.5 2,-0.2 5,-0.5 0.941 112.8 50.5 -60.9 -45.2 42.7 -39.0 -70.7 243 246 A F H X>S+ 0 0 8 -4,-2.8 5,-2.3 -5,-0.2 4,-2.3 0.949 114.1 43.2 -57.1 -53.5 41.6 -42.6 -70.0 244 247 A N H <>S+ 0 0 71 -4,-2.9 5,-0.9 1,-0.2 -1,-0.2 0.922 118.5 44.5 -57.5 -43.1 40.8 -41.9 -66.3 245 248 A D H <5S+ 0 0 68 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.593 130.3 20.5 -81.2 -12.7 39.1 -38.5 -67.1 246 249 A N H <5S+ 0 0 19 -4,-1.5 6,-2.9 -3,-0.5 5,-0.3 0.678 132.1 26.6-123.5 -36.1 37.0 -39.8 -70.1 247 250 A I T >< - 0 0 12 -2,-0.2 3,-1.1 -7,-0.1 2,-0.1 -0.716 39.9-136.6 -76.4 110.3 36.0 -46.2 -75.7 255 258 A M T 3 S+ 0 0 46 -2,-0.8 3,-0.1 1,-0.2 -33,-0.0 -0.385 79.3 21.5 -75.3 143.4 36.0 -46.3 -79.5 256 259 A G T 3 S+ 0 0 1 1,-0.3 56,-2.8 -2,-0.1 59,-0.4 0.634 100.6 110.0 75.7 12.4 37.0 -49.4 -81.4 257 260 A F B < +G 311 0D 12 -3,-1.1 -1,-0.3 54,-0.3 52,-0.1 -0.917 55.5 28.5-112.6 150.1 36.3 -51.7 -78.4 258 261 A G - 0 0 19 52,-2.6 2,-0.3 -2,-0.3 51,-0.1 0.179 52.9-153.9 89.6 153.9 33.6 -54.2 -77.9 259 262 A H - 0 0 46 3,-0.4 -1,-0.1 49,-0.2 51,-0.0 -0.969 26.1-129.3-163.8 145.4 31.5 -56.5 -80.2 260 263 A R S S+ 0 0 53 -2,-0.3 -1,-0.1 1,-0.1 -238,-0.1 0.806 113.4 20.5 -71.2 -24.1 28.1 -58.2 -80.2 261 264 A V S S+ 0 0 12 1,-0.1 2,-0.2 -3,-0.1 -1,-0.1 0.838 109.2 74.5-107.5 -56.2 29.8 -61.5 -81.1 262 265 A Y + 0 0 4 1,-0.2 -3,-0.4 -4,-0.1 48,-0.2 -0.429 41.5 172.1 -63.6 124.3 33.5 -61.3 -80.1 263 266 A K S S+ 0 0 94 -241,-2.6 2,-0.2 -2,-0.2 -1,-0.2 0.043 73.6 44.9-117.4 20.8 34.0 -61.6 -76.3 264 267 A T S S- 0 0 35 -242,-0.2 46,-0.3 44,-0.1 -239,-0.1 -0.831 114.9 -46.0-146.0 177.9 37.7 -61.8 -77.0 265 268 A Y - 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0 0 68 1,-0.1 4,-2.7 -2,-0.1 5,-0.2 -0.377 25.7-108.3 -77.2 164.0 22.5 -87.8 -72.5 549 171 B K H > S+ 0 0 182 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.855 121.5 54.3 -57.0 -40.6 22.6 -91.6 -73.0 550 172 B E H > S+ 0 0 76 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.927 110.3 43.5 -57.2 -50.1 22.4 -91.8 -69.2 551 173 B E H > S+ 0 0 22 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.920 114.3 51.0 -69.1 -41.6 19.2 -89.7 -68.9 552 174 B I H X S+ 0 0 27 -4,-2.7 4,-2.9 1,-0.2 -1,-0.2 0.909 109.7 48.7 -60.4 -45.9 17.6 -91.5 -71.9 553 175 B D H X S+ 0 0 91 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.846 111.2 50.0 -68.2 -36.0 18.2 -95.0 -70.6 554 176 B A H X S+ 0 0 2 -4,-1.7 4,-2.6 2,-0.2 -1,-0.2 0.927 112.5 47.3 -65.4 -47.3 16.8 -94.1 -67.1 555 177 B M H X S+ 0 0 0 -4,-2.5 4,-3.0 1,-0.2 -2,-0.2 0.929 110.2 53.7 -57.9 -46.7 13.6 -92.6 -68.8 556 178 B N H X S+ 0 0 16 -4,-2.9 4,-2.1 1,-0.2 -1,-0.2 0.898 110.4 46.7 -49.8 -47.7 13.4 -95.7 -70.9 557 179 B T H X S+ 0 0 5 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.925 111.6 50.1 -65.8 -45.0 13.5 -97.9 -67.8 558 180 B A H X S+ 0 0 0 -4,-2.6 4,-2.1 2,-0.2 -2,-0.2 0.933 108.3 53.7 -59.0 -45.5 10.9 -95.7 -66.0 559 181 B L H X S+ 0 0 2 -4,-3.0 4,-0.5 1,-0.2 -1,-0.2 0.939 113.0 43.9 -56.5 -47.4 8.5 -95.9 -69.0 560 182 B I H >< S+ 0 0 0 -4,-2.1 3,-1.2 -5,-0.2 4,-0.4 0.931 110.7 53.2 -58.7 -49.7 8.8 -99.8 -68.9 561 183 B L H 3< S+ 0 0 0 -4,-2.6 3,-0.2 1,-0.3 -1,-0.2 0.796 115.9 39.1 -64.6 -28.3 8.4 -100.1 -65.1 562 184 B Y H 3< S+ 0 0 1 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.398 84.3 106.2 -96.8 2.5 5.1 -98.0 -65.1 563 185 B T S << S- 0 0 1 -3,-1.2 162,-1.4 -4,-0.5 2,-0.3 0.868 92.0 -15.6 -50.3 -44.9 3.7 -99.5 -68.4 564 186 B D - 0 0 0 -4,-0.4 -1,-0.2 -3,-0.2 3,-0.1 -0.998 39.4-177.0-161.2 151.6 1.1 -101.6 -66.5 565 187 B H - 0 0 4 1,-0.3 2,-0.5 -2,-0.3 -164,-0.1 -0.019 53.0-110.5-147.6 41.4 0.0 -103.0 -63.2 566 188 B E S S- 0 0 2 1,-0.2 -1,-0.3 -166,-0.1 163,-0.1 -0.581 84.5 -10.8 70.5-111.1 -3.1 -105.1 -64.0 567 189 B V S S+ 0 0 0 -2,-0.5 -1,-0.2 939,-0.2 -174,-0.1 -0.367 75.7 155.1-127.3 61.0 -6.3 -103.4 -62.6 568 190 B P > - 0 0 10 0, 0.0 4,-2.7 0, 0.0 5,-0.2 -0.051 64.8 -82.0 -66.7-178.9 -5.4 -100.6 -60.2 569 191 B A H > S+ 0 0 2 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.886 129.4 50.0 -58.9 -41.6 -8.0 -97.8 -59.6 570 192 B S H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.973 113.8 44.2 -65.9 -49.8 -7.0 -95.8 -62.8 571 193 B T H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.893 114.2 52.5 -56.8 -41.4 -7.2 -98.9 -65.1 572 194 B T H X S+ 0 0 1 -4,-2.7 4,-2.4 2,-0.2 -1,-0.2 0.926 107.4 49.4 -62.3 -48.0 -10.5 -99.9 -63.4 573 195 B A H X S+ 0 0 0 -4,-2.9 4,-2.1 1,-0.2 -2,-0.2 0.917 111.9 50.3 -60.5 -40.1 -12.2 -96.5 -63.9 574 196 B G H X S+ 0 0 0 -4,-2.3 4,-2.7 -5,-0.2 5,-0.2 0.896 109.3 52.0 -58.8 -41.2 -11.1 -96.6 -67.6 575 197 B L H X S+ 0 0 1 -4,-2.3 4,-1.6 2,-0.2 -2,-0.2 0.906 106.1 51.8 -68.0 -41.5 -12.6 -100.1 -67.8 576 198 B V H < S+ 0 0 1 -4,-2.4 165,-0.4 1,-0.2 4,-0.4 0.952 112.4 49.5 -57.5 -46.0 -16.0 -99.0 -66.4 577 199 B A H ><>S+ 0 0 0 -4,-2.1 3,-1.4 1,-0.2 5,-1.2 0.933 112.9 42.5 -60.4 -48.4 -16.0 -96.2 -69.0 578 200 B V H ><5S+ 0 0 0 -4,-2.7 3,-2.0 1,-0.3 -1,-0.2 0.701 98.8 76.1 -76.4 -13.6 -15.2 -98.4 -72.1 579 201 B S T 3<5S+ 0 0 0 -4,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.645 93.1 53.0 -67.4 -16.1 -17.6 -101.1 -70.8 580 202 B T T < 5S- 0 0 0 -3,-1.4 782,-2.8 -4,-0.4 783,-0.4 0.280 128.1-105.5 -91.7 2.8 -20.4 -98.7 -72.0 581 203 B L T < 5 + 0 0 56 -3,-2.0 -3,-0.2 779,-0.2 -88,-0.2 0.616 66.3 161.1 71.4 18.8 -18.5 -98.7 -75.4 582 204 B S < - 0 0 1 -5,-1.2 -1,-0.2 778,-0.2 775,-0.1 -0.245 47.3 -85.4 -56.8 155.8 -17.3 -95.2 -74.7 583 205 B D > - 0 0 6 773,-0.1 4,-2.1 1,-0.1 3,-0.2 -0.164 34.0-106.6 -70.2 162.7 -14.3 -94.3 -76.9 584 206 B M H > S+ 0 0 0 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.847 119.8 51.7 -51.1 -41.2 -10.6 -95.1 -76.1 585 207 B Y H > S+ 0 0 5 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.848 106.3 51.1 -70.4 -41.2 -9.9 -91.5 -75.2 586 208 B S H > S+ 0 0 0 2,-0.2 4,-2.3 -3,-0.2 -1,-0.2 0.889 108.0 55.9 -58.9 -40.0 -12.8 -91.2 -72.8 587 209 B G H X S+ 0 0 0 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.949 109.5 45.5 -55.3 -51.8 -11.3 -94.5 -71.2 588 210 B I H X S+ 0 0 0 -4,-2.1 4,-2.7 1,-0.2 -1,-0.2 0.899 109.4 55.1 -57.1 -43.5 -8.0 -92.7 -70.7 589 211 B T H X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.922 109.0 47.1 -60.9 -44.4 -9.7 -89.6 -69.4 590 212 B A H X S+ 0 0 0 -4,-2.3 4,-1.7 2,-0.2 -1,-0.2 0.886 111.8 51.6 -59.9 -46.8 -11.5 -91.7 -66.7 591 213 B A H X S+ 0 0 0 -4,-2.2 4,-2.8 1,-0.2 -2,-0.2 0.908 109.8 48.9 -55.5 -46.8 -8.2 -93.4 -65.8 592 214 B L H X S+ 0 0 1 -4,-2.7 4,-1.9 1,-0.2 -2,-0.2 0.880 106.1 57.3 -62.8 -37.1 -6.5 -90.0 -65.4 593 215 B A H < S+ 0 0 0 -4,-2.1 4,-0.4 1,-0.2 -1,-0.2 0.893 112.7 41.3 -59.8 -41.1 -9.4 -88.8 -63.2 594 216 B A H >< S+ 0 0 0 -4,-1.7 3,-1.7 1,-0.2 7,-0.4 0.920 109.9 57.2 -75.3 -47.0 -8.7 -91.7 -60.8 595 217 B L H 3< S+ 0 0 0 -4,-2.8 6,-1.3 1,-0.3 5,-0.2 0.837 95.5 69.3 -49.9 -34.9 -4.8 -91.4 -61.1 596 218 B K T 3< S+ 0 0 36 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.768 77.5 96.1 -60.1 -28.0 -5.2 -87.8 -59.8 597 219 B G S X> S- 0 0 1 -3,-1.7 3,-2.4 -4,-0.4 4,-1.7 -0.423 83.5-121.5 -73.3 145.6 -6.2 -88.8 -56.3 598 220 B P T 34 S+ 0 0 74 0, 0.0 746,-0.2 0, 0.0 -1,-0.1 0.609 109.6 65.2 -65.0 -13.0 -3.5 -88.9 -53.6 599 221 B L T 34 S+ 0 0 62 744,-2.6 745,-0.1 3,-0.0 3,-0.1 0.370 123.4 15.3 -85.3 3.9 -4.2 -92.6 -52.9 600 222 B H T <4 S+ 0 0 27 -3,-2.4 3,-0.4 1,-0.4 -5,-0.2 0.401 128.8 35.7-136.2 -68.1 -3.0 -93.4 -56.4 601 223 B G S < S+ 0 0 2 -4,-1.7 -1,-0.4 -6,-1.3 -5,-0.1 -0.166 99.8 46.1 -73.4 174.2 -1.1 -90.5 -57.9 602 224 B G S > S+ 0 0 12 110,-0.2 4,-2.3 1,-0.1 -1,-0.2 0.340 72.0 113.9 85.0 -7.9 1.2 -88.1 -56.1 603 225 B A H > S+ 0 0 12 -3,-0.4 4,-2.7 2,-0.2 5,-0.2 0.847 73.0 52.6 -72.9 -36.4 3.2 -90.7 -54.1 604 226 B A H > S+ 0 0 3 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.935 115.3 44.4 -65.6 -39.7 6.7 -90.3 -55.7 605 227 B E H > S+ 0 0 8 2,-0.2 4,-2.9 1,-0.2 -2,-0.2 0.928 111.5 51.4 -65.3 -46.1 6.3 -86.5 -55.0 606 228 B A H X S+ 0 0 29 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.886 109.3 53.3 -59.3 -39.3 5.1 -87.2 -51.4 607 229 B A H X S+ 0 0 0 -4,-2.7 4,-2.0 2,-0.2 -2,-0.2 0.959 110.1 45.6 -61.4 -50.7 8.2 -89.4 -50.9 608 230 B I H X S+ 0 0 2 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.936 110.8 55.1 -55.5 -45.8 10.5 -86.7 -52.1 609 231 B A H X S+ 0 0 43 -4,-2.9 4,-2.0 1,-0.2 -2,-0.2 0.901 107.6 48.2 -54.6 -45.7 8.6 -84.2 -49.8 610 232 B Q H X S+ 0 0 5 -4,-2.4 4,-1.6 2,-0.2 -1,-0.2 0.885 110.7 51.4 -69.0 -33.5 9.2 -86.4 -46.8 611 233 B F H X S+ 0 0 0 -4,-2.0 4,-1.4 1,-0.2 -2,-0.2 0.912 110.2 50.1 -63.4 -43.4 12.9 -86.8 -47.5 612 234 B D H < S+ 0 0 56 -4,-2.5 -2,-0.2 2,-0.2 -1,-0.2 0.848 106.5 53.0 -65.9 -37.2 13.2 -83.0 -47.8 613 235 B E H < S+ 0 0 91 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.865 105.7 55.1 -69.7 -31.4 11.5 -82.3 -44.5 614 236 B I H < S+ 0 0 3 -4,-1.6 2,-2.3 1,-0.2 -1,-0.2 0.893 82.0 172.1 -60.1 -42.9 13.9 -84.7 -42.8 615 237 B K < + 0 0 139 -4,-1.4 -1,-0.2 -5,-0.1 58,-0.1 -0.363 51.9 55.1 72.5 -62.0 16.7 -82.6 -44.3 616 238 B D S > S- 0 0 77 -2,-2.3 3,-1.9 -3,-0.2 4,-0.1 -0.890 74.0-138.3-113.2 130.3 19.8 -84.1 -42.5 617 239 B P G > S+ 0 0 40 0, 0.0 3,-0.9 0, 0.0 4,-0.2 0.753 105.3 60.4 -57.4 -26.9 20.6 -87.9 -42.7 618 240 B A G 3 S+ 0 0 86 1,-0.2 4,-0.3 2,-0.1 3,-0.2 0.605 100.2 55.9 -72.9 -18.1 21.5 -87.7 -39.0 619 241 B M G <> S+ 0 0 98 -3,-1.9 4,-2.2 1,-0.2 -1,-0.2 0.329 77.4 100.4-100.7 10.6 18.0 -86.6 -38.2 620 242 B V H <> S+ 0 0 1 -3,-0.9 4,-2.6 2,-0.2 5,-0.2 0.892 80.7 46.8 -62.4 -48.0 16.2 -89.6 -39.8 621 243 B E H > S+ 0 0 104 -4,-0.2 4,-2.7 -3,-0.2 5,-0.2 0.921 113.0 49.1 -68.5 -40.9 15.5 -91.7 -36.7 622 244 B K H > S+ 0 0 132 -4,-0.3 4,-2.9 2,-0.2 5,-0.2 0.926 112.9 47.2 -59.9 -46.7 14.1 -88.7 -34.7 623 245 B W H X S+ 0 0 22 -4,-2.2 4,-2.6 1,-0.2 5,-0.5 0.931 112.2 51.4 -62.1 -44.8 11.9 -87.7 -37.6 624 246 B F H X>S+ 0 0 7 -4,-2.6 5,-2.5 2,-0.2 4,-2.2 0.918 114.6 42.0 -57.3 -46.7 10.7 -91.3 -38.0 625 247 B N H <>S+ 0 0 62 -4,-2.7 5,-1.3 3,-0.2 -2,-0.2 0.944 118.0 45.3 -67.4 -45.6 9.9 -91.6 -34.3 626 248 B D H <5S+ 0 0 65 -4,-2.9 -2,-0.2 -5,-0.2 -1,-0.2 0.833 130.3 20.9 -67.9 -31.0 8.2 -88.2 -34.1 627 249 B N H <>S+ 0 0 27 -4,-2.6 6,-3.0 -5,-0.2 5,-0.6 0.779 131.9 26.0-110.6 -37.4 6.2 -88.6 -37.3 628 250 B I T ><5S+ 0 0 13 -4,-2.2 3,-1.9 -5,-0.5 -3,-0.2 0.878 120.0 45.8-100.3 -57.5 5.7 -92.2 -38.3 629 251 B I T 3 - 0 0 15 -2,-0.3 3,-1.0 -7,-0.1 2,-0.1 -0.656 39.3-137.4 -73.7 108.6 5.1 -93.2 -44.5 636 258 B M T 3 S+ 0 0 46 -2,-0.8 3,-0.1 1,-0.2 -1,-0.0 -0.418 78.4 21.0 -77.1 144.5 5.1 -92.3 -48.2 637 259 B G T 3 S+ 0 0 1 1,-0.3 56,-3.1 -2,-0.1 59,-0.4 0.635 100.7 108.3 69.6 17.5 6.1 -94.8 -50.9 638 260 B F B < +N 692 0H 12 -3,-1.0 -1,-0.3 54,-0.3 52,-0.1 -0.914 57.6 27.8-116.3 152.3 5.5 -97.8 -48.5 639 261 B G - 0 0 17 52,-2.5 2,-0.3 -2,-0.3 51,-0.1 0.138 54.6-157.1 86.0 155.5 2.7 -100.3 -48.7 640 262 B H - 0 0 48 3,-0.3 -1,-0.1 49,-0.2 51,-0.0 -0.951 27.5-125.8-169.3 147.2 0.5 -101.7 -51.5 641 263 B R S S+ 0 0 49 -2,-0.3 -1,-0.1 1,-0.1 -238,-0.1 0.788 113.1 20.6 -67.2 -33.7 -2.8 -103.4 -52.1 642 264 B V S S+ 0 0 13 1,-0.1 2,-0.3 -3,-0.1 -236,-0.1 0.828 109.5 74.9-103.2 -55.5 -1.2 -106.3 -53.9 643 265 B Y + 0 0 4 1,-0.2 -3,-0.3 -4,-0.1 48,-0.2 -0.457 41.4 171.1 -68.8 121.0 2.5 -106.4 -52.8 644 266 B K S S+ 0 0 98 -241,-3.3 2,-0.2 -2,-0.3 -1,-0.2 0.101 73.9 42.9-106.5 15.6 2.9 -107.8 -49.3 645 267 B T S S- 0 0 40 -242,-0.3 46,-0.3 46,-0.1 -240,-0.1 -0.796 114.3 -43.8-147.5 179.6 6.7 -107.8 -50.0 646 268 B Y - 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0 0 1 -5,-1.3 -1,-0.2 -748,-0.2 -748,-0.1 -0.265 47.2 -83.9 -58.8 158.5 21.3 -44.1 -88.7 965 205 C D > - 0 0 6 -753,-0.1 4,-2.3 1,-0.1 5,-0.1 -0.132 33.6-107.6 -70.7 165.1 19.3 -41.1 -89.6 966 206 C M H > S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 5,-0.1 0.835 118.9 53.4 -56.4 -41.1 15.5 -41.0 -90.3 967 207 C Y H > S+ 0 0 6 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.919 107.7 49.5 -68.6 -40.4 16.0 -40.5 -94.1 968 208 C S H > S+ 0 0 0 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.880 108.5 55.4 -59.1 -38.8 18.3 -43.6 -94.3 969 209 C G H X S+ 0 0 0 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.963 110.1 45.1 -60.7 -49.1 15.5 -45.5 -92.3 970 210 C I H X S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.2 -2,-0.2 0.912 109.4 55.4 -60.0 -40.9 13.1 -44.5 -95.0 971 211 C T H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.915 109.4 47.8 -59.1 -44.3 15.6 -45.4 -97.9 972 212 C A H X S+ 0 0 0 -4,-2.7 4,-1.7 2,-0.2 -1,-0.2 0.870 110.2 51.5 -64.3 -41.6 15.9 -48.9 -96.4 973 213 C A H X S+ 0 0 0 -4,-2.0 4,-2.6 1,-0.2 -2,-0.2 0.930 110.7 49.5 -60.1 -44.8 12.0 -49.2 -96.1 974 214 C L H X S+ 0 0 1 -4,-2.8 4,-1.9 1,-0.2 -2,-0.2 0.912 103.9 57.9 -59.8 -45.6 11.7 -48.2 -99.7 975 215 C A H < S+ 0 0 0 -4,-2.2 4,-0.4 1,-0.2 -1,-0.2 0.890 113.7 40.8 -53.0 -41.7 14.4 -50.8 -100.8 976 216 C A H >< S+ 0 0 0 -4,-1.7 3,-1.2 1,-0.2 7,-0.4 0.886 110.0 56.0 -72.9 -42.3 12.1 -53.5 -99.2 977 217 C L H 3< S+ 0 0 0 -4,-2.6 6,-0.9 1,-0.3 -1,-0.2 0.792 96.2 68.0 -65.0 -26.9 8.8 -52.2 -100.5 978 218 C K T 3< S+ 0 0 35 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.815 79.1 96.9 -62.7 -31.6 10.1 -52.3 -104.1 979 219 C G S X> S- 0 0 1 -3,-1.2 3,-2.2 -4,-0.4 4,-2.2 -0.283 84.3-122.3 -66.8 143.7 10.2 -56.1 -104.1 980 220 C P T 34 S+ 0 0 83 0, 0.0 -780,-0.2 0, 0.0 -1,-0.1 0.550 108.2 66.1 -70.0 -7.2 7.1 -57.8 -105.6 981 221 C L T 34 S+ 0 0 86 -782,-2.7 -781,-0.1 3,-0.0 3,-0.1 0.388 123.0 16.3 -85.6 3.2 6.3 -59.8 -102.4 982 222 C H T <4 S+ 0 0 28 -3,-2.2 3,-0.4 1,-0.4 -5,-0.1 0.490 130.1 36.2-135.6 -62.2 5.5 -56.4 -100.8 983 223 C G S < S+ 0 0 3 -4,-2.2 -1,-0.4 -6,-0.9 -5,-0.1 -0.234 99.2 49.2 -81.3 174.6 5.1 -53.7 -103.5 984 224 C G S > S+ 0 0 16 110,-0.2 4,-2.1 -3,-0.1 -1,-0.2 0.245 71.0 112.3 86.9 -11.4 3.4 -54.3 -106.8 985 225 C A H > S+ 0 0 28 -3,-0.4 4,-2.3 2,-0.2 5,-0.2 0.850 75.9 50.4 -70.3 -39.8 0.2 -56.1 -105.7 986 226 C A H > S+ 0 0 3 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.922 112.5 49.2 -65.5 -35.9 -2.3 -53.3 -106.6 987 227 C E H > S+ 0 0 10 1,-0.2 4,-2.9 2,-0.2 -2,-0.2 0.925 110.0 51.0 -65.3 -42.8 -0.8 -53.2 -110.1 988 228 C A H X S+ 0 0 29 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.902 108.1 51.6 -66.2 -37.3 -1.0 -57.0 -110.4 989 229 C A H X S+ 0 0 0 -4,-2.3 4,-2.3 88,-0.3 5,-0.2 0.943 112.3 47.4 -61.8 -48.5 -4.7 -57.0 -109.4 990 230 C I H X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.932 109.6 51.8 -57.5 -47.0 -5.4 -54.3 -112.1 991 231 C A H X S+ 0 0 43 -4,-2.9 4,-1.8 1,-0.2 -1,-0.2 0.897 110.1 51.2 -60.1 -39.1 -3.4 -56.2 -114.8 992 232 C Q H X S+ 0 0 4 -4,-2.1 4,-1.6 2,-0.2 -1,-0.2 0.927 110.4 46.7 -64.5 -44.1 -5.5 -59.4 -113.9 993 233 C F H X S+ 0 0 0 -4,-2.3 4,-1.7 1,-0.2 -1,-0.2 0.882 110.8 54.6 -63.1 -36.2 -8.9 -57.5 -114.3 994 234 C D H < S+ 0 0 75 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.838 103.4 55.2 -66.5 -33.0 -7.5 -56.1 -117.6 995 235 C E H < S+ 0 0 93 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.884 107.7 49.1 -64.2 -40.7 -6.8 -59.6 -118.9 996 236 C I H < S+ 0 0 7 -4,-1.6 2,-2.3 1,-0.2 -1,-0.2 0.863 82.6 175.9 -67.4 -39.0 -10.4 -60.6 -118.3 997 237 C K < + 0 0 161 -4,-1.7 -1,-0.2 -5,-0.1 58,-0.1 -0.163 57.1 52.4 72.0 -43.4 -11.4 -57.4 -120.1 998 238 C D S > S- 0 0 72 -2,-2.3 3,-2.3 -3,-0.1 4,-0.1 -0.994 74.4-137.2-131.7 125.4 -15.3 -58.0 -120.0 999 239 C P G > S+ 0 0 23 0, 0.0 3,-1.4 0, 0.0 4,-0.3 0.812 104.5 64.4 -53.9 -32.0 -17.3 -58.9 -116.8 1000 240 C A G 3 S+ 0 0 81 1,-0.2 4,-0.3 2,-0.1 3,-0.2 0.666 99.2 53.9 -64.3 -17.4 -19.2 -61.6 -118.8 1001 241 C M G <> S+ 0 0 81 -3,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.276 76.6 99.9-100.6 8.3 -15.9 -63.5 -119.2 1002 242 C V H <> S+ 0 0 2 -3,-1.4 4,-3.1 2,-0.2 5,-0.2 0.930 81.3 49.9 -64.2 -45.8 -14.9 -63.8 -115.5 1003 243 C E H > S+ 0 0 117 -4,-0.3 4,-2.5 1,-0.2 -1,-0.2 0.936 114.0 44.8 -61.8 -49.6 -16.2 -67.3 -115.0 1004 244 C K H > S+ 0 0 117 -4,-0.3 4,-2.9 2,-0.2 -1,-0.2 0.905 114.6 48.9 -56.0 -47.0 -14.3 -68.6 -118.1 1005 245 C W H X S+ 0 0 26 -4,-2.5 4,-1.4 2,-0.2 5,-0.4 0.927 109.6 52.3 -61.3 -43.5 -11.2 -66.8 -117.1 1006 246 C F H X>S+ 0 0 8 -4,-3.1 4,-2.4 1,-0.2 5,-2.0 0.941 114.3 42.9 -60.4 -46.5 -11.3 -68.1 -113.6 1007 247 C N H <>S+ 0 0 76 -4,-2.5 5,-1.0 1,-0.2 -2,-0.2 0.935 116.3 47.6 -58.9 -48.6 -11.6 -71.7 -114.9 1008 248 C D H <5S+ 0 0 74 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.560 130.6 16.9 -73.1 -14.0 -8.9 -71.2 -117.6 1009 249 C N H <5S+ 0 0 26 -4,-1.4 6,-2.7 -3,-0.5 5,-0.3 0.657 130.1 30.5-129.2 -35.0 -6.4 -69.5 -115.2 1010 250 C I T ><5S+ 0 0 11 -4,-2.4 3,-1.9 -5,-0.4 -3,-0.2 0.889 117.3 46.0-101.3 -59.8 -7.1 -70.1 -111.4 1011 251 C I T 3 - 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0 0 13 1,-0.1 4,-2.7 -108,-0.0 5,-0.2 -0.999 64.9-126.3-154.9 149.5 -36.6 -71.8 -60.8 1297 156 D Y H > S+ 0 0 3 -2,-0.3 4,-2.2 2,-0.2 5,-0.2 0.898 115.3 54.3 -55.6 -42.7 -33.4 -73.6 -61.8 1298 157 D A H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.955 111.1 45.2 -57.9 -50.3 -35.3 -75.2 -64.7 1299 158 D E H > S+ 0 0 38 2,-0.2 4,-2.9 1,-0.2 5,-0.3 0.912 109.7 54.5 -59.5 -46.5 -36.3 -71.7 -65.9 1300 159 D S H X S+ 0 0 1 -4,-2.7 4,-1.6 1,-0.2 -8,-0.2 0.914 111.2 46.7 -57.0 -43.6 -32.8 -70.3 -65.5 1301 160 D F H X S+ 0 0 0 -4,-2.2 4,-2.8 2,-0.2 -2,-0.2 0.962 115.6 41.8 -59.2 -58.1 -31.4 -73.0 -67.6 1302 161 D L H X S+ 0 0 0 -4,-2.3 4,-2.8 1,-0.2 5,-0.4 0.892 111.6 56.0 -62.8 -41.3 -33.9 -72.9 -70.5 1303 162 D N H X>S+ 0 0 28 -4,-2.9 4,-1.6 -5,-0.2 5,-0.7 0.903 115.0 39.0 -56.8 -44.0 -33.9 -69.0 -70.6 1304 163 D A H <5S+ 0 0 7 -4,-1.6 -2,-0.2 -5,-0.3 -1,-0.2 0.904 115.1 52.1 -74.5 -41.5 -30.2 -69.0 -71.1 1305 164 D A H <5S+ 0 0 0 -4,-2.8 -2,-0.2 1,-0.2 -3,-0.2 0.947 121.6 30.6 -61.5 -50.3 -30.0 -71.9 -73.4 1306 165 D F H <5S- 0 0 31 -4,-2.8 -1,-0.2 2,-0.3 -2,-0.2 0.663 99.2-129.2 -85.5 -22.2 -32.7 -70.5 -75.8 1307 166 D G T <5S+ 0 0 48 -4,-1.6 2,-0.3 -5,-0.4 -3,-0.2 0.775 79.9 75.6 74.3 29.3 -32.0 -66.8 -75.3 1308 167 D R S - 0 0 59 1,-0.1 4,-3.1 -2,-0.1 5,-0.2 -0.431 22.3-112.2 -83.2 162.2 -43.0 -70.9 -71.2 1312 171 D K H > S+ 0 0 137 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.914 121.3 51.2 -52.4 -47.5 -44.7 -72.4 -68.1 1313 172 D E H > S+ 0 0 122 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.878 112.7 45.1 -60.6 -43.1 -45.3 -75.6 -70.1 1314 173 D E H > S+ 0 0 27 2,-0.2 4,-2.6 3,-0.1 -2,-0.2 0.938 115.0 47.7 -61.7 -51.6 -41.5 -75.8 -71.1 1315 174 D I H X S+ 0 0 20 -4,-3.1 4,-2.8 2,-0.2 -2,-0.2 0.933 112.2 48.3 -58.5 -52.9 -40.3 -74.9 -67.6 1316 175 D D H X S+ 0 0 75 -4,-3.0 4,-2.4 1,-0.2 -1,-0.2 0.903 113.2 48.2 -59.1 -41.9 -42.6 -77.5 -65.8 1317 176 D A H X S+ 0 0 6 -4,-1.7 4,-2.4 -5,-0.3 -1,-0.2 0.917 112.3 47.7 -67.4 -40.1 -41.6 -80.3 -68.3 1318 177 D M H X S+ 0 0 0 -4,-2.6 4,-2.9 2,-0.2 -1,-0.2 0.901 109.2 56.3 -62.6 -39.8 -37.8 -79.5 -67.9 1319 178 D N H X S+ 0 0 19 -4,-2.8 4,-2.2 1,-0.2 -2,-0.2 0.941 109.0 45.5 -59.2 -46.6 -38.4 -79.5 -64.1 1320 179 D T H X S+ 0 0 17 -4,-2.4 4,-3.0 1,-0.2 -1,-0.2 0.915 111.1 52.3 -61.2 -46.2 -39.8 -83.0 -64.3 1321 180 D A H X S+ 0 0 0 -4,-2.4 4,-1.6 1,-0.2 -2,-0.2 0.916 109.0 50.9 -56.7 -45.1 -37.0 -84.2 -66.6 1322 181 D L H < S+ 0 0 0 -4,-2.9 4,-0.3 2,-0.2 -1,-0.2 0.916 113.2 45.9 -59.8 -45.6 -34.4 -82.8 -64.1 1323 182 D I H >< S+ 0 0 0 -4,-2.2 3,-1.8 1,-0.2 4,-0.4 0.963 111.8 50.7 -59.7 -49.3 -36.1 -84.7 -61.2 1324 183 D L H 3< S+ 0 0 0 -4,-3.0 3,-0.2 1,-0.3 -1,-0.2 0.758 114.4 41.9 -67.9 -26.9 -36.5 -88.0 -63.1 1325 184 D Y T 3< S+ 0 0 0 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.294 84.2 106.6 -95.3 5.8 -32.8 -88.1 -64.2 1326 185 D T S < S- 0 0 0 -3,-1.8 162,-1.4 -4,-0.3 2,-0.3 0.882 90.5 -17.0 -58.2 -47.0 -31.4 -87.0 -60.8 1327 186 D D - 0 0 0 -4,-0.4 -1,-0.2 -3,-0.2 3,-0.1 -0.993 40.2-175.8-157.1 155.7 -30.1 -90.4 -59.7 1328 187 D H - 0 0 5 1,-0.4 2,-0.4 -2,-0.3 -1,-0.0 -0.023 52.6-107.6-150.1 41.0 -30.3 -94.1 -60.4 1329 188 D E S S- 0 0 3 1,-0.2 -1,-0.4 -166,-0.0 -585,-0.1 -0.598 84.9 -15.4 73.1-115.1 -28.2 -95.8 -57.7 1330 189 D V S S+ 0 0 0 -2,-0.4 -1,-0.2 -587,-0.2 -174,-0.0 -0.470 76.3 157.5-125.6 67.1 -24.9 -97.1 -59.3 1331 190 D P > - 0 0 9 0, 0.0 4,-2.8 0, 0.0 5,-0.2 -0.102 63.7 -80.3 -71.5-178.6 -25.1 -97.3 -63.1 1332 191 D A H > S+ 0 0 1 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.886 129.2 49.6 -53.9 -44.8 -21.9 -97.3 -65.1 1333 192 D S H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.971 113.4 44.4 -62.3 -53.2 -21.4 -93.5 -65.0 1334 193 D T H > S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.894 113.4 53.4 -58.7 -38.9 -21.8 -93.2 -61.2 1335 194 D T H X S+ 0 0 1 -4,-2.8 4,-2.5 2,-0.2 -2,-0.2 0.940 107.3 50.0 -63.6 -43.5 -19.6 -96.3 -60.8 1336 195 D A H X S+ 0 0 0 -4,-2.7 4,-2.1 -5,-0.2 -2,-0.2 0.934 112.1 47.9 -58.9 -45.7 -16.8 -94.8 -62.9 1337 196 D G H X S+ 0 0 0 -4,-2.3 4,-3.2 1,-0.2 5,-0.3 0.902 109.3 54.1 -63.7 -39.5 -16.9 -91.6 -60.8 1338 197 D L H X S+ 0 0 0 -4,-2.5 4,-1.9 2,-0.2 -1,-0.2 0.912 106.5 51.6 -61.8 -42.6 -16.9 -93.7 -57.5 1339 198 D V H < S+ 0 0 1 -4,-2.5 4,-0.4 2,-0.2 165,-0.4 0.950 112.3 47.2 -55.5 -48.5 -13.7 -95.4 -58.7 1340 199 D A H ><>S+ 0 0 0 -4,-2.1 3,-1.5 1,-0.2 5,-1.1 0.943 114.1 44.4 -60.5 -50.2 -12.2 -92.0 -59.3 1341 200 D V H ><5S+ 0 0 0 -4,-3.2 3,-2.0 1,-0.3 -1,-0.2 0.736 98.2 74.7 -73.0 -16.7 -13.2 -90.5 -56.0 1342 201 D S T 3<5S+ 0 0 0 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.667 92.9 53.9 -64.6 -17.5 -12.1 -93.7 -54.1 1343 202 D T T < 5S- 0 0 0 -3,-1.5 -744,-2.6 -4,-0.4 -743,-0.3 0.356 127.7-105.4 -90.3 2.2 -8.5 -92.6 -54.7 1344 203 D L T < 5 + 0 0 56 -3,-2.0 -88,-0.2 1,-0.2 -3,-0.2 0.579 66.7 161.1 74.7 19.5 -9.6 -89.2 -53.0 1345 204 D S < - 0 0 1 -5,-1.1 -1,-0.2 -748,-0.2 -751,-0.1 -0.223 47.2 -84.3 -59.1 156.8 -9.6 -87.5 -56.4 1346 205 D D > - 0 0 5 -753,-0.1 4,-2.1 1,-0.1 3,-0.2 -0.182 33.7-106.7 -70.4 161.3 -11.5 -84.3 -56.4 1347 206 D M H > S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.844 119.8 52.5 -48.5 -40.5 -15.3 -83.9 -57.0 1348 207 D Y H > S+ 0 0 7 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.901 106.9 50.2 -72.7 -37.8 -14.7 -82.6 -60.5 1349 208 D S H > S+ 0 0 0 -3,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.874 108.0 54.8 -62.9 -40.1 -12.5 -85.4 -61.6 1350 209 D G H X S+ 0 0 0 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.955 109.8 47.0 -56.6 -48.8 -15.3 -87.8 -60.2 1351 210 D I H X S+ 0 0 0 -4,-2.2 4,-2.8 1,-0.2 -2,-0.2 0.896 109.5 54.5 -60.1 -39.7 -17.8 -86.0 -62.5 1352 211 D T H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.918 109.1 47.2 -61.7 -45.8 -15.3 -86.2 -65.5 1353 212 D A H X S+ 0 0 0 -4,-2.3 4,-1.6 2,-0.2 -1,-0.2 0.897 110.6 52.3 -61.4 -40.5 -15.0 -90.0 -65.1 1354 213 D A H X S+ 0 0 0 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.910 109.5 50.0 -64.3 -43.6 -18.8 -90.3 -64.9 1355 214 D L H X S+ 0 0 1 -4,-2.8 4,-2.0 1,-0.2 -1,-0.2 0.876 104.6 57.5 -62.6 -37.8 -19.1 -88.3 -68.1 1356 215 D A H < S+ 0 0 0 -4,-2.1 4,-0.4 1,-0.2 -1,-0.2 0.871 111.8 42.8 -59.7 -39.7 -16.5 -90.6 -69.8 1357 216 D A H >< S+ 0 0 0 -4,-1.6 3,-1.4 1,-0.2 7,-0.4 0.903 109.2 57.8 -71.4 -43.2 -18.8 -93.6 -69.0 1358 217 D L H 3< S+ 0 0 0 -4,-2.5 6,-1.0 1,-0.3 5,-0.2 0.843 94.9 66.8 -58.7 -33.5 -22.0 -91.7 -70.0 1359 218 D K T 3< S+ 0 0 37 -4,-2.0 -1,-0.3 -5,-0.1 -2,-0.2 0.777 78.8 99.6 -58.3 -31.7 -20.6 -91.1 -73.5 1360 219 D G S X> S- 0 0 0 -3,-1.4 3,-2.4 -4,-0.4 4,-2.1 -0.366 80.5-127.2 -62.4 138.3 -20.8 -94.8 -74.4 1361 220 D P T 34 S+ 0 0 74 0, 0.0 -780,-0.2 0, 0.0 -1,-0.1 0.582 108.0 66.0 -65.8 -10.4 -23.8 -95.9 -76.4 1362 221 D L T 34 S+ 0 0 68 -782,-2.8 -781,-0.1 3,-0.0 3,-0.1 0.463 122.7 14.9 -83.4 1.3 -24.6 -98.6 -73.8 1363 222 D H T <4 S+ 0 0 28 -3,-2.4 3,-0.4 -783,-0.4 -5,-0.1 0.505 129.2 35.4-135.6 -65.3 -25.3 -95.8 -71.3 1364 223 D G S < S+ 0 0 2 -4,-2.1 -1,-0.4 -6,-1.0 -5,-0.1 -0.276 98.8 48.0 -82.3 176.8 -25.8 -92.4 -73.1 1365 224 D G S > S+ 0 0 14 110,-0.2 4,-2.4 -3,-0.1 -1,-0.2 0.261 72.3 113.3 81.9 -8.6 -27.4 -91.8 -76.5 1366 225 D A H > S+ 0 0 16 -3,-0.4 4,-2.5 2,-0.2 5,-0.2 0.838 73.3 52.7 -68.3 -37.1 -30.6 -93.9 -76.0 1367 226 D A H > S+ 0 0 2 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.941 114.4 45.0 -63.8 -41.8 -33.1 -91.1 -76.1 1368 227 D E H > S+ 0 0 9 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.919 111.9 51.9 -63.1 -45.5 -31.6 -90.0 -79.4 1369 228 D A H X S+ 0 0 29 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.838 108.1 51.7 -61.2 -39.2 -31.5 -93.5 -80.7 1370 229 D A H X S+ 0 0 0 -4,-2.5 4,-2.3 88,-0.3 -1,-0.2 0.933 111.1 47.6 -62.0 -47.3 -35.2 -94.0 -79.8 1371 230 D I H X S+ 0 0 1 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.908 110.1 53.5 -59.0 -42.8 -36.1 -90.8 -81.7 1372 231 D A H X S+ 0 0 48 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.877 108.9 48.4 -62.2 -38.2 -34.0 -92.0 -84.7 1373 232 D Q H X S+ 0 0 8 -4,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.924 111.2 49.6 -72.9 -38.8 -35.9 -95.3 -84.8 1374 233 D F H X S+ 0 0 0 -4,-2.3 4,-1.6 1,-0.2 -2,-0.2 0.910 111.4 51.1 -59.1 -43.0 -39.3 -93.5 -84.7 1375 234 D D H < S+ 0 0 77 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.888 107.8 50.7 -64.9 -40.5 -38.1 -91.3 -87.5 1376 235 D E H < S+ 0 0 86 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.945 106.5 54.5 -62.7 -46.0 -37.0 -94.2 -89.7 1377 236 D I H < S- 0 0 4 -4,-2.3 2,-1.3 1,-0.2 -1,-0.2 0.854 87.1-174.3 -54.2 -41.5 -40.4 -95.9 -89.3 1378 237 D K < + 0 0 129 -4,-1.6 -1,-0.2 -5,-0.1 58,-0.1 -0.180 53.7 33.1 83.3 -44.0 -41.9 -92.6 -90.5 1379 238 D D S > S- 0 0 53 -2,-1.3 3,-1.9 1,-0.1 4,-0.3 -0.993 76.2-120.6-146.2 143.6 -45.7 -93.4 -90.1 1380 239 D P G > S+ 0 0 20 0, 0.0 3,-1.5 0, 0.0 4,-0.4 0.824 112.3 60.9 -51.6 -36.3 -47.8 -95.4 -87.6 1381 240 D A G 3 S+ 0 0 76 1,-0.3 4,-0.3 2,-0.1 3,-0.2 0.737 102.4 53.6 -65.6 -18.3 -49.1 -97.6 -90.4 1382 241 D M G <> S+ 0 0 93 -3,-1.9 4,-2.4 1,-0.2 -1,-0.3 0.433 83.5 92.4 -93.6 -3.6 -45.5 -98.7 -91.2 1383 242 D V H <> S+ 0 0 0 -3,-1.5 4,-2.5 -4,-0.3 5,-0.2 0.921 82.8 48.6 -61.5 -51.3 -44.8 -99.8 -87.6 1384 243 D E H > S+ 0 0 109 -4,-0.4 4,-2.3 1,-0.2 -1,-0.2 0.921 114.4 44.6 -60.6 -46.2 -45.8 -103.5 -87.9 1385 244 D K H > S+ 0 0 140 -4,-0.3 4,-2.7 1,-0.2 -1,-0.2 0.939 114.7 49.1 -64.4 -44.0 -43.8 -104.1 -91.1 1386 245 D W H X S+ 0 0 20 -4,-2.4 4,-2.4 1,-0.2 5,-0.4 0.904 112.0 49.3 -60.0 -42.5 -40.7 -102.2 -89.7 1387 246 D F H X>S+ 0 0 4 -4,-2.5 5,-2.3 2,-0.2 4,-1.8 0.894 114.0 44.4 -65.6 -44.1 -40.8 -104.2 -86.5 1388 247 D N H <>S+ 0 0 57 -4,-2.3 5,-2.6 -5,-0.2 -2,-0.2 0.910 117.7 45.6 -68.2 -38.3 -41.1 -107.5 -88.2 1389 248 D D H <5S+ 0 0 76 -4,-2.7 5,-0.3 -5,-0.2 -2,-0.2 0.832 128.0 21.7 -69.9 -39.5 -38.3 -106.6 -90.7 1390 249 D N H <5S+ 0 0 37 -4,-2.4 6,-3.1 -5,-0.2 -3,-0.2 0.712 133.1 25.7-109.3 -28.4 -35.8 -105.1 -88.3 1391 250 D I T <5S+ 0 0 6 -4,-1.8 -3,-0.2 -5,-0.4 -4,-0.1 0.847 125.8 33.0-105.4 -65.0 -36.5 -106.4 -84.8 1392 251 D I T - 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