==== 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 HYDROLASE INHIBITOR 28-JUN-05 2CX6 . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN YHCO; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR K.MURAYAMA,M.KAWAZOE,M.SHIROUZU,S.YOKOYAMA,RIKEN STRUCTURAL . 180 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10667.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 128 71.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 26 14.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 18 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 63 35.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 3.3 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 2 0 0 2 0 2 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 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 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 X 0 0 100 0, 0.0 2,-0.5 0, 0.0 50,-0.2 0.000 360.0 360.0 360.0 -49.5 24.5 0.7 85.2 2 2 A N E -a 51 0A 65 48,-1.9 50,-3.2 46,-0.3 2,-0.5 -0.661 360.0-153.6 -77.5 126.1 25.1 -2.5 83.0 3 3 A I E -a 52 0A 24 -2,-0.5 2,-0.4 48,-0.2 50,-0.2 -0.873 14.6-178.2-105.4 126.9 26.9 -1.4 79.8 4 4 A Y E -a 53 0A 49 48,-2.6 50,-2.9 -2,-0.5 2,-0.4 -0.972 10.0-152.3-126.3 141.9 26.5 -3.4 76.6 5 5 A T E -a 54 0A 58 -2,-0.4 2,-0.6 48,-0.2 50,-0.2 -0.909 9.0-163.0-120.2 140.1 28.1 -2.7 73.3 6 6 A F E -a 55 0A 0 48,-3.2 50,-3.4 -2,-0.4 2,-0.8 -0.965 12.3-157.3-120.3 112.2 27.1 -3.5 69.8 7 7 A D E > -a 56 0A 42 -2,-0.6 3,-1.6 48,-0.2 50,-0.2 -0.801 2.3-162.1 -89.5 109.9 30.0 -3.2 67.3 8 8 A F T 3 S+ 0 0 6 48,-3.4 3,-0.4 -2,-0.8 49,-0.1 0.509 80.7 80.0 -75.6 3.0 28.6 -2.6 63.9 9 9 A D T 3 S+ 0 0 112 1,-0.2 -1,-0.3 47,-0.2 48,-0.1 0.741 105.1 38.1 -74.2 -16.7 31.8 -3.6 62.2 10 10 A E S < S+ 0 0 149 -3,-1.6 2,-0.5 1,-0.0 -1,-0.2 0.332 105.5 74.9-112.5 4.0 30.5 -7.1 62.9 11 11 A I + 0 0 1 -3,-0.4 3,-0.1 -4,-0.2 -1,-0.0 -0.984 43.7 159.6-119.8 127.0 26.7 -6.6 62.3 12 12 A E + 0 0 114 -2,-0.5 2,-0.3 1,-0.2 -1,-0.1 0.612 62.3 32.6-121.4 -21.5 25.5 -6.3 58.7 13 13 A S S > S- 0 0 33 1,-0.1 4,-1.1 53,-0.0 -1,-0.2 -0.825 80.3-113.1-127.3 169.9 21.8 -7.1 58.7 14 14 A Q H > S+ 0 0 42 -2,-0.3 4,-2.2 1,-0.2 5,-0.2 0.854 120.1 61.6 -69.4 -31.1 19.1 -6.5 61.2 15 15 A E H > S+ 0 0 134 1,-0.3 4,-1.4 2,-0.2 -1,-0.2 0.850 99.4 54.3 -60.8 -35.5 19.0 -10.3 61.5 16 16 A D H > S+ 0 0 42 2,-0.2 4,-2.2 1,-0.2 -1,-0.3 0.874 107.5 51.9 -65.2 -36.8 22.6 -10.1 62.7 17 17 A F H X S+ 0 0 0 -4,-1.1 4,-3.3 2,-0.2 5,-0.3 0.986 104.4 52.2 -64.2 -59.1 21.5 -7.7 65.3 18 18 A Y H X S+ 0 0 13 -4,-2.2 4,-2.6 1,-0.3 -1,-0.2 0.823 113.8 46.2 -44.3 -41.0 18.7 -9.8 66.8 19 19 A R H X S+ 0 0 137 -4,-1.4 4,-2.6 2,-0.2 -1,-0.3 0.907 113.3 46.7 -73.2 -42.8 21.0 -12.7 67.2 20 20 A D H X S+ 0 0 34 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.881 114.3 50.3 -67.4 -34.1 23.8 -10.7 68.7 21 21 A F H X S+ 0 0 0 -4,-3.3 4,-2.3 2,-0.2 6,-0.2 0.966 112.2 45.3 -66.0 -53.8 21.3 -9.1 71.0 22 22 A S H <>S+ 0 0 9 -4,-2.6 5,-2.9 -5,-0.3 -2,-0.2 0.911 114.3 49.9 -56.8 -44.1 19.8 -12.4 72.1 23 23 A Q H ><5S+ 0 0 136 -4,-2.6 3,-1.0 3,-0.2 -1,-0.2 0.902 110.7 50.4 -60.3 -44.3 23.3 -13.8 72.5 24 24 A T H 3<5S+ 0 0 54 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.869 116.9 37.7 -67.3 -35.5 24.3 -10.8 74.6 25 25 A F T 3<5S- 0 0 26 -4,-2.3 -1,-0.2 -5,-0.1 -2,-0.2 0.211 109.9-116.2-100.0 17.1 21.4 -10.9 77.0 26 26 A G T < 5 + 0 0 70 -3,-1.0 -3,-0.2 -4,-0.2 2,-0.2 0.868 58.2 163.3 52.2 39.0 21.3 -14.7 77.2 27 27 A L < - 0 0 32 -5,-2.9 -1,-0.2 -6,-0.2 5,-0.0 -0.562 37.6-100.3 -87.2 155.0 17.8 -14.7 75.6 28 28 A A > - 0 0 73 -2,-0.2 3,-1.4 2,-0.1 4,-0.4 -0.020 52.1 -64.1 -68.6 175.7 16.4 -17.9 74.1 29 29 A K T 3 S- 0 0 186 1,-0.3 3,-0.2 2,-0.1 -7,-0.1 0.744 119.9 -7.6 -17.8 -85.5 16.2 -19.1 70.4 30 30 A D T 3 S+ 0 0 80 1,-0.1 3,-0.3 -8,-0.0 -1,-0.3 -0.273 84.1 129.4-122.0 45.8 13.9 -16.6 68.7 31 31 A K S < S+ 0 0 110 -3,-1.4 2,-0.4 1,-0.3 10,-0.2 0.750 87.8 33.6 -69.6 -20.2 12.6 -14.5 71.7 32 32 A V + 0 0 5 -4,-0.4 -1,-0.3 -3,-0.2 -10,-0.2 -0.910 69.2 135.9-139.3 105.6 13.7 -11.6 69.5 33 33 A R S S+ 0 0 152 -2,-0.4 2,-0.3 1,-0.3 -15,-0.1 0.543 70.8 10.4-122.9 -24.6 13.3 -12.0 65.7 34 34 A D S > S- 0 0 64 -16,-0.1 4,-1.9 1,-0.0 -1,-0.3 -0.869 91.2 -79.1-146.2-178.1 11.8 -8.8 64.5 35 35 A L H > S+ 0 0 55 -2,-0.3 4,-2.7 1,-0.2 5,-0.1 0.833 122.9 51.8 -55.4 -42.4 11.1 -5.3 65.7 36 36 A D H > S+ 0 0 123 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.891 111.6 46.2 -67.9 -38.8 7.9 -6.2 67.6 37 37 A S H > S+ 0 0 16 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.833 112.5 51.0 -72.8 -31.0 9.5 -9.0 69.5 38 38 A L H X S+ 0 0 0 -4,-1.9 4,-1.4 1,-0.2 -2,-0.2 0.925 110.7 50.5 -68.5 -44.5 12.5 -6.7 70.3 39 39 A W H X S+ 0 0 66 -4,-2.7 4,-1.6 2,-0.2 -2,-0.2 0.885 106.9 53.1 -62.3 -39.7 10.0 -4.1 71.5 40 40 A D H >X S+ 0 0 84 -4,-2.1 4,-2.7 1,-0.2 3,-0.7 0.971 108.5 49.3 -60.4 -51.6 8.2 -6.5 73.8 41 41 A V H 3<>S+ 0 0 5 -4,-1.9 5,-0.8 1,-0.3 6,-0.6 0.792 111.5 50.3 -55.7 -30.8 11.4 -7.6 75.5 42 42 A L H 3<5S+ 0 0 3 -4,-1.4 3,-0.3 1,-0.2 -1,-0.3 0.766 117.4 41.5 -78.9 -24.4 12.2 -3.9 76.0 43 43 A X H <<5S+ 0 0 69 -4,-1.6 -2,-0.2 -3,-0.7 -3,-0.2 0.754 104.5 64.1 -94.5 -23.1 8.8 -3.3 77.4 44 44 A N T <5S- 0 0 104 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.1 0.020 103.8-109.7 -98.3 31.7 8.4 -6.4 79.6 45 45 A D T 5S+ 0 0 130 -3,-0.3 -3,-0.1 1,-0.1 4,-0.1 0.708 78.6 128.3 53.8 28.4 11.0 -6.0 82.3 46 46 A V < + 0 0 61 -5,-0.8 -4,-0.1 -6,-0.2 -1,-0.1 0.810 48.6 81.2 -81.6 -30.4 13.1 -8.9 80.9 47 47 A L S S- 0 0 11 -6,-0.6 2,-3.1 1,-0.1 4,-0.0 -0.391 94.9 -97.9 -82.8 154.2 16.4 -7.0 80.6 48 48 A P - 0 0 56 0, 0.0 -46,-0.3 0, 0.0 -1,-0.1 -0.304 63.8-141.4 -65.2 62.7 19.0 -6.4 83.3 49 49 A L S S+ 0 0 48 -2,-3.1 2,-0.1 -4,-0.1 35,-0.1 -0.461 77.0 52.6 -74.9 148.5 17.8 -2.8 84.0 50 50 A P S S+ 0 0 54 0, 0.0 -48,-1.9 0, 0.0 2,-0.3 0.532 87.8 138.2 -77.1 145.0 19.1 -0.2 84.6 51 51 A L E -ab 2 84A 2 32,-2.1 34,-2.6 -50,-0.2 2,-0.4 -0.925 45.4-131.9-148.5 169.9 21.4 -0.6 81.6 52 52 A E E -ab 3 85A 1 -50,-3.2 -48,-2.6 -2,-0.3 2,-0.5 -0.997 10.8-153.6-130.5 135.8 23.0 1.2 78.7 53 53 A I E -ab 4 86A 0 32,-3.4 34,-2.6 -2,-0.4 2,-0.5 -0.939 13.2-162.2-107.5 121.5 23.0 0.1 75.0 54 54 A E E -ab 5 87A 13 -50,-2.9 -48,-3.2 -2,-0.5 2,-0.7 -0.922 7.0-159.2-109.7 123.2 26.0 1.4 73.0 55 55 A F E -ab 6 88A 0 32,-3.4 34,-3.9 -2,-0.5 2,-0.3 -0.885 23.9-172.2 -97.5 115.1 25.9 1.3 69.2 56 56 A V E +a 7 0A 10 -50,-3.4 -48,-3.4 -2,-0.7 -47,-0.2 -0.854 51.6 14.5-117.4 149.9 29.5 1.6 68.0 57 57 A H S S+ 0 0 80 -2,-0.3 2,-0.7 1,-0.2 -1,-0.2 0.830 78.2 151.3 63.7 37.2 31.3 2.0 64.6 58 58 A L - 0 0 19 -3,-0.3 -1,-0.2 4,-0.1 32,-0.2 -0.879 22.8-172.5-103.5 114.6 28.1 3.1 62.9 59 59 A G > - 0 0 39 -2,-0.7 4,-3.5 -3,-0.1 5,-0.3 -0.443 39.6 -75.1 -99.9 176.5 28.6 5.4 60.0 60 60 A E H > S+ 0 0 138 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.817 124.6 34.4 -28.1 -73.8 26.4 7.4 57.8 61 61 A K H > S+ 0 0 152 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.908 120.7 48.1 -60.7 -45.3 24.9 4.8 55.5 62 62 A T H > S+ 0 0 18 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.895 108.4 53.9 -66.6 -38.3 24.8 2.1 58.1 63 63 A R H < S+ 0 0 125 -4,-3.5 7,-0.2 1,-0.2 -1,-0.2 0.944 112.6 47.1 -56.5 -46.0 23.1 4.4 60.7 64 64 A R H >< S+ 0 0 180 -4,-2.0 3,-1.5 -5,-0.3 -2,-0.2 0.907 109.8 50.5 -63.4 -45.3 20.5 5.0 57.9 65 65 A R H 3< S+ 0 0 116 -4,-2.8 3,-0.4 1,-0.3 -1,-0.2 0.872 115.7 43.5 -63.2 -35.0 20.0 1.4 57.1 66 66 A F T 3X S+ 0 0 0 -4,-2.3 4,-2.0 1,-0.2 3,-0.3 0.068 78.7 120.7 -97.0 23.1 19.5 0.6 60.8 67 67 A G H <> + 0 0 29 -3,-1.5 4,-2.2 1,-0.2 -1,-0.2 0.757 67.7 57.9 -58.3 -32.1 17.3 3.6 61.4 68 68 A A H > S+ 0 0 47 -3,-0.4 4,-3.0 2,-0.2 -1,-0.2 0.945 109.0 46.8 -64.7 -46.2 14.3 1.5 62.5 69 69 A L H > S+ 0 0 0 -3,-0.3 4,-2.7 1,-0.2 -2,-0.2 0.896 112.8 48.4 -60.3 -44.2 16.5 0.0 65.3 70 70 A I H X S+ 0 0 12 -4,-2.0 4,-1.5 -7,-0.2 -1,-0.2 0.866 112.6 49.6 -65.8 -35.1 17.8 3.4 66.3 71 71 A L H X S+ 0 0 100 -4,-2.2 4,-2.0 -5,-0.2 -2,-0.2 0.948 110.0 50.5 -68.3 -46.7 14.3 4.7 66.3 72 72 A L H X S+ 0 0 18 -4,-3.0 4,-2.1 1,-0.2 -2,-0.2 0.939 111.2 48.2 -55.9 -50.4 13.1 1.8 68.5 73 73 A F H X S+ 0 0 0 -4,-2.7 4,-1.7 1,-0.2 -1,-0.2 0.806 108.2 52.7 -65.5 -29.3 15.9 2.3 71.0 74 74 A D H X S+ 0 0 38 -4,-1.5 4,-2.4 1,-0.2 -1,-0.2 0.896 112.1 47.8 -71.1 -36.1 15.4 6.1 71.4 75 75 A E H X S+ 0 0 81 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.864 108.0 53.2 -71.3 -34.5 11.8 5.4 72.1 76 76 A A H X S+ 0 0 0 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.895 110.9 48.4 -66.4 -38.2 12.5 2.7 74.6 77 77 A E H <>S+ 0 0 28 -4,-1.7 5,-1.3 2,-0.2 7,-0.3 0.940 110.1 50.5 -66.0 -45.4 14.7 5.1 76.4 78 78 A E H ><5S+ 0 0 150 -4,-2.4 3,-0.6 1,-0.2 -2,-0.2 0.914 117.1 42.5 -58.6 -38.7 12.0 7.8 76.3 79 79 A E H 3<5S+ 0 0 113 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.751 106.6 60.1 -80.9 -25.1 9.6 5.2 77.7 80 80 A L T >X5S- 0 0 29 -4,-2.2 3,-4.3 4,-0.2 4,-0.5 -0.130 105.2-117.8 -98.7 37.4 11.8 3.7 80.3 81 81 A E T <45S- 0 0 168 -3,-0.6 -3,-0.1 1,-0.3 -2,-0.1 0.807 72.3 -57.0 32.2 56.9 12.4 6.8 82.3 82 82 A G T 34 -c 147 0B 47 -2,-0.6 3,-1.4 48,-0.2 4,-0.4 -0.739 3.9-158.6 -85.7 114.8 23.8 19.2 82.2 99 8 B F T 3 S+ 0 0 9 48,-3.1 49,-0.1 -2,-0.7 -1,-0.1 0.385 82.8 77.6 -79.4 9.0 25.1 22.1 80.2 100 9 B D T 3 S+ 0 0 116 1,-0.2 -1,-0.3 47,-0.1 48,-0.1 0.735 107.5 34.3 -81.3 -22.6 21.9 24.1 80.6 101 10 B E S < S+ 0 0 146 -3,-1.4 2,-0.6 1,-0.0 -2,-0.2 0.447 105.1 82.9-108.3 -6.5 23.2 24.9 84.1 102 11 B I + 0 0 2 -4,-0.4 3,-0.1 1,-0.2 -1,-0.0 -0.905 38.7 152.0-107.5 120.1 26.9 25.0 83.2 103 12 B E + 0 0 111 -2,-0.6 2,-0.2 1,-0.1 -1,-0.2 0.757 60.5 39.6-110.9 -45.5 28.3 28.2 81.8 104 13 B S S > S- 0 0 31 1,-0.1 4,-1.7 53,-0.0 -1,-0.1 -0.631 76.9-117.8-108.8 167.9 31.9 28.4 82.8 105 14 B Q H > S+ 0 0 44 1,-0.2 4,-2.0 -2,-0.2 5,-0.1 0.831 122.0 52.9 -68.3 -30.6 34.8 25.9 83.1 106 15 B E H > S+ 0 0 113 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.832 101.5 58.1 -72.6 -34.3 34.7 26.8 86.8 107 16 B D H > S+ 0 0 55 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.926 110.8 45.7 -57.9 -43.9 31.0 26.1 86.9 108 17 B F H X S+ 0 0 0 -4,-1.7 4,-3.2 2,-0.2 -2,-0.2 0.873 107.5 54.1 -68.2 -41.9 32.0 22.6 85.7 109 18 B Y H X S+ 0 0 16 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.901 112.2 45.7 -60.9 -38.6 34.9 22.1 88.1 110 19 B R H X S+ 0 0 181 -4,-2.2 4,-2.7 2,-0.2 5,-0.2 0.933 114.0 47.6 -69.0 -45.8 32.6 22.9 91.1 111 20 B D H X S+ 0 0 52 -4,-2.0 4,-2.9 -5,-0.2 -2,-0.2 0.926 113.3 49.0 -59.3 -45.7 29.9 20.6 89.7 112 21 B F H X S+ 0 0 0 -4,-3.2 4,-2.3 1,-0.2 -2,-0.2 0.924 112.2 48.2 -60.7 -46.6 32.5 17.8 89.1 113 22 B S H <>S+ 0 0 19 -4,-2.4 5,-2.2 -5,-0.2 4,-0.5 0.890 113.1 47.3 -63.4 -41.5 33.9 18.2 92.6 114 23 B Q H ><5S+ 0 0 159 -4,-2.7 3,-0.8 3,-0.2 -2,-0.2 0.935 109.1 55.0 -65.7 -45.3 30.4 18.1 94.2 115 24 B T H 3<5S+ 0 0 51 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.945 120.3 30.0 -53.3 -53.4 29.5 15.1 92.2 116 25 B F T 3<5S- 0 0 29 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.400 108.4-124.2 -89.8 7.0 32.4 13.1 93.3 117 26 B G T < 5 + 0 0 64 -3,-0.8 -3,-0.2 -4,-0.5 -4,-0.1 0.849 46.4 175.6 54.5 42.7 32.6 14.9 96.7 118 27 B L < - 0 0 31 -5,-2.2 -1,-0.1 -6,-0.2 3,-0.1 -0.345 33.2 -96.4 -77.9 155.3 36.2 16.0 96.3 119 28 B A > - 0 0 71 1,-0.2 3,-1.7 -2,-0.1 4,-0.4 -0.193 57.7 -72.0 -66.0 162.8 38.1 18.2 98.7 120 29 B K T 3 S+ 0 0 179 1,-0.3 -1,-0.2 2,-0.1 4,-0.1 -0.293 118.1 5.6 -57.0 136.9 38.4 21.9 98.2 121 30 B D T 3 S+ 0 0 84 2,-0.2 3,-0.3 -3,-0.1 -1,-0.3 0.392 88.9 121.2 67.9 -2.0 40.8 22.8 95.3 122 31 B K S < S+ 0 0 103 -3,-1.7 2,-0.4 1,-0.3 10,-0.2 0.862 88.5 21.6 -58.9 -32.9 41.3 19.2 94.3 123 32 B V S S+ 0 0 7 -4,-0.4 -1,-0.3 1,-0.1 -2,-0.2 -0.944 74.1 130.0-137.4 110.9 39.9 20.1 90.8 124 33 B R S S+ 0 0 156 -2,-0.4 2,-0.3 -3,-0.3 -1,-0.1 0.317 73.7 13.5-140.6 -4.9 40.1 23.8 89.9 125 34 B D S > S- 0 0 68 -3,-0.1 4,-2.3 -4,-0.1 -1,-0.3 -0.937 88.0 -83.3-160.2-179.2 41.7 23.5 86.4 126 35 B L H > S+ 0 0 60 -2,-0.3 4,-3.0 2,-0.2 5,-0.1 0.901 121.4 51.2 -63.3 -44.3 42.6 21.2 83.6 127 36 B D H > S+ 0 0 120 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.934 114.2 42.2 -61.0 -47.1 45.8 20.0 85.1 128 37 B S H > S+ 0 0 19 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.871 112.8 53.9 -68.4 -36.4 44.3 19.1 88.4 129 38 B L H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 5,-0.2 0.965 109.5 50.8 -59.8 -48.9 41.3 17.6 86.6 130 39 B W H X S+ 0 0 61 -4,-3.0 4,-1.5 1,-0.2 -2,-0.2 0.866 107.4 50.0 -58.2 -41.8 43.7 15.5 84.7 131 40 B D H X S+ 0 0 89 -4,-2.1 4,-0.9 2,-0.2 -1,-0.2 0.865 109.7 52.8 -67.2 -33.4 45.6 14.2 87.7 132 41 B V H ><>S+ 0 0 3 -4,-1.9 3,-1.1 1,-0.2 5,-0.8 0.962 111.1 45.2 -64.3 -48.0 42.4 13.2 89.3 133 42 B L H 3<5S+ 0 0 4 -4,-2.1 3,-0.4 1,-0.3 -1,-0.2 0.787 114.2 53.5 -63.5 -27.6 41.2 11.2 86.3 134 43 B X H 3<5S+ 0 0 60 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.596 105.2 51.8 -85.4 -12.0 44.7 9.8 86.2 135 44 B N T <<5S- 0 0 100 -3,-1.1 -1,-0.2 -4,-0.9 -2,-0.1 -0.019 98.8-108.8-127.5 39.8 45.0 8.4 89.7 136 45 B D T 5S+ 0 0 130 -3,-0.4 -3,-0.1 1,-0.1 -4,-0.1 0.788 78.3 123.2 45.8 43.5 42.1 6.2 90.8 137 46 B V < + 0 0 72 -5,-0.8 -1,-0.1 2,-0.0 -4,-0.1 0.566 60.0 81.2-100.6 -16.4 40.5 8.6 93.2 138 47 B L S S- 0 0 10 -6,-0.4 2,-3.7 1,-0.1 4,-0.0 -0.672 99.2-105.2 -91.8 145.3 37.3 8.3 91.2 139 48 B P - 0 0 63 0, 0.0 -46,-0.2 0, 0.0 -1,-0.1 -0.222 60.5-145.5 -63.0 53.8 34.9 5.4 91.7 140 49 B L S S+ 0 0 46 -2,-3.7 35,-0.1 2,-0.1 2,-0.1 -0.338 74.8 62.2 -62.8 148.1 36.0 3.8 88.5 141 50 B P S S+ 0 0 60 0, 0.0 -48,-1.2 0, 0.0 2,-0.3 0.487 84.5 132.7 -75.9 138.2 34.6 2.1 86.3 142 51 B L E -cd 93 175B 3 32,-1.7 34,-2.1 -50,-0.2 2,-0.4 -0.937 47.1-129.5-149.7 172.5 32.3 5.1 85.5 143 52 B E E -cd 94 176B 1 -50,-3.4 -48,-3.6 -2,-0.3 2,-0.5 -0.994 8.4-152.0-133.4 135.7 30.8 7.1 82.7 144 53 B I E -cd 95 177B 0 32,-3.0 34,-2.3 -2,-0.4 2,-0.4 -0.931 15.6-167.9-105.6 122.4 30.7 10.9 82.3 145 54 B E E -cd 96 178B 3 -50,-3.4 -48,-3.2 -2,-0.5 2,-0.5 -0.941 7.2-161.5-113.1 129.5 27.8 12.2 80.2 146 55 B F E -cd 97 179B 0 32,-2.5 34,-1.8 -2,-0.4 2,-0.3 -0.948 19.6-173.2-107.7 126.0 27.6 15.7 78.9 147 56 B V E +c 98 0B 19 -50,-2.6 -48,-3.1 -2,-0.5 -47,-0.1 -0.879 52.9 19.7-125.5 156.6 24.0 16.8 77.9 148 57 B H S S+ 0 0 110 -2,-0.3 2,-0.6 1,-0.2 -1,-0.2 0.918 77.5 154.1 57.0 49.8 22.3 19.8 76.3 149 58 B L - 0 0 29 31,-0.2 -1,-0.2 -3,-0.2 2,-0.2 -0.932 23.7-165.2-112.3 113.8 25.5 20.9 74.7 150 59 B G > - 0 0 38 -2,-0.6 4,-3.9 -51,-0.1 5,-0.4 -0.492 36.9 -89.8 -97.6 170.1 25.2 22.9 71.5 151 60 B E H > S+ 0 0 131 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.873 123.5 44.5 -40.2 -56.3 27.6 23.9 68.7 152 61 B K H > S+ 0 0 151 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.958 120.3 39.0 -60.4 -50.5 28.8 27.1 70.3 153 62 B T H > S+ 0 0 33 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.894 112.1 56.9 -68.1 -39.9 29.2 25.7 73.9 154 63 B R H < S+ 0 0 130 -4,-3.9 -1,-0.2 1,-0.2 7,-0.2 0.923 110.7 46.8 -54.1 -42.9 30.6 22.4 72.6 155 64 B R H >< S+ 0 0 155 -4,-2.0 3,-1.4 -5,-0.4 -2,-0.2 0.904 109.9 51.8 -67.6 -41.7 33.2 24.6 71.0 156 65 B R H 3< S+ 0 0 124 -4,-2.1 3,-0.4 1,-0.3 -1,-0.2 0.843 112.0 46.3 -66.6 -31.4 33.8 26.7 74.1 157 66 B F T 3X S+ 0 0 1 -4,-2.6 4,-2.5 1,-0.2 -1,-0.3 0.037 75.0 122.2 -97.7 25.5 34.4 23.6 76.2 158 67 B G H <> + 0 0 30 -3,-1.4 4,-2.6 1,-0.2 5,-0.2 0.824 68.7 57.6 -58.7 -33.8 36.7 22.0 73.6 159 68 B A H > S+ 0 0 45 -3,-0.4 4,-2.3 2,-0.2 -1,-0.2 0.949 110.5 43.2 -63.4 -46.1 39.5 21.7 76.1 160 69 B L H > S+ 0 0 0 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.899 112.9 52.7 -65.9 -39.4 37.4 19.7 78.5 161 70 B I H X S+ 0 0 11 -4,-2.5 4,-2.0 -7,-0.2 -2,-0.2 0.948 111.6 45.5 -62.1 -46.1 36.0 17.6 75.7 162 71 B L H X S+ 0 0 105 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.910 111.4 53.5 -61.9 -43.0 39.5 16.8 74.4 163 72 B L H X S+ 0 0 15 -4,-2.3 4,-1.7 1,-0.2 -1,-0.2 0.894 111.3 43.7 -62.0 -42.7 40.7 16.0 77.9 164 73 B F H X S+ 0 0 0 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.857 111.1 54.5 -72.8 -33.1 38.0 13.5 78.7 165 74 B D H X S+ 0 0 59 -4,-2.0 4,-1.5 -5,-0.2 -2,-0.2 0.942 111.1 46.6 -63.3 -42.4 38.3 11.8 75.3 166 75 B E H X S+ 0 0 98 -4,-2.4 4,-1.7 1,-0.2 -1,-0.2 0.840 110.3 52.8 -67.3 -32.8 42.0 11.3 76.0 167 76 B A H X S+ 0 0 0 -4,-1.7 4,-2.4 2,-0.2 -1,-0.2 0.824 105.1 53.8 -72.7 -31.0 41.3 10.0 79.5 168 77 B E H <>S+ 0 0 41 -4,-1.9 5,-1.8 1,-0.2 7,-0.3 0.898 111.3 48.4 -68.3 -33.9 38.9 7.4 78.1 169 78 B E H ><5S+ 0 0 158 -4,-1.5 3,-0.6 1,-0.2 -2,-0.2 0.823 115.3 41.6 -71.9 -35.4 41.7 6.4 75.8 170 79 B E H 3<5S+ 0 0 116 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.799 111.4 57.2 -81.7 -32.7 44.3 6.2 78.6 171 80 B L T ><5S- 0 0 18 -4,-2.4 3,-3.5 -5,-0.2 4,-0.4 0.088 105.1-127.1 -89.2 24.4 41.9 4.5 81.0 172 81 B E T < 5 - 0 0 146 -3,-0.6 -3,-0.2 1,-0.3 -4,-0.1 0.835 69.8 -53.3 31.0 64.9 41.2 1.6 78.6 173 82 B G T 3