==== 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 OXIDOREDUCTASE 21-MAY-04 1WE1 . COMPND 2 MOLECULE: HEME OXYGENASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: SYNECHOCYSTIS SP.; . AUTHOR M.SUGISHIMA,C.T.MIGITA,X.ZHANG,T.YOSHIDA,K.FUKUYAMA . 887 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 40705.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 716 80.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 1 0.1 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 . 34 3.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 128 14.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 533 60.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 20 2.3 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 3 0 0 4 6 0 0 0 5 4 1 1 7 1 0 0 0 0 0 2 6 0 2 1 0 0 0 RESIDUES PER ALPHA HELIX . 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 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 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 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 2 A S 0 0 97 0, 0.0 180,-0.1 0, 0.0 175,-0.1 0.000 360.0 360.0 360.0 -32.4 31.9 -6.3 50.1 2 3 A V - 0 0 28 175,-0.3 173,-0.1 172,-0.2 174,-0.1 0.604 360.0-124.9-130.7 -24.7 33.3 -7.3 46.7 3 4 A N >> + 0 0 75 172,-0.3 3,-1.2 171,-0.2 4,-1.0 0.882 38.7 168.2 76.5 44.7 33.7 -4.3 44.4 4 5 A L H 3> + 0 0 1 170,-0.4 4,-3.8 1,-0.2 5,-0.4 0.780 62.0 82.3 -59.8 -26.3 31.6 -5.5 41.4 5 6 A A H 3> S+ 0 0 2 166,-0.3 4,-1.7 1,-0.3 -1,-0.2 0.886 101.5 34.3 -45.6 -46.9 31.7 -1.9 39.9 6 7 A S H <> S+ 0 0 65 -3,-1.2 4,-2.6 2,-0.2 5,-0.3 0.770 115.8 57.3 -81.1 -27.1 35.2 -2.6 38.5 7 8 A Q H X S+ 0 0 40 -4,-1.0 4,-2.3 2,-0.2 -2,-0.2 0.896 109.8 43.9 -70.6 -39.9 34.4 -6.2 37.8 8 9 A L H X S+ 0 0 0 -4,-3.8 4,-1.6 2,-0.2 -2,-0.2 0.952 115.0 50.0 -68.9 -46.3 31.4 -5.3 35.6 9 10 A R H < S+ 0 0 143 -4,-1.7 3,-0.3 -5,-0.4 -2,-0.2 0.934 119.3 34.9 -58.5 -50.3 33.4 -2.6 33.9 10 11 A E H >< S+ 0 0 142 -4,-2.6 3,-1.2 1,-0.2 4,-0.4 0.904 116.4 58.3 -71.6 -36.8 36.4 -4.7 33.1 11 12 A G H 3< S+ 0 0 31 -4,-2.3 4,-0.3 -5,-0.3 -2,-0.2 0.671 108.8 41.7 -66.3 -21.5 34.2 -7.7 32.5 12 13 A T T 3X S+ 0 0 5 -4,-1.6 4,-2.5 -3,-0.3 5,-0.3 0.215 81.8 107.3-109.3 12.1 32.1 -6.2 29.8 13 14 A K H <> S+ 0 0 58 -3,-1.2 4,-1.6 2,-0.2 -2,-0.1 0.963 83.1 43.4 -52.5 -57.8 35.0 -4.5 28.0 14 15 A K H > S+ 0 0 151 -4,-0.4 4,-1.9 1,-0.2 3,-0.4 0.945 113.6 50.0 -53.8 -56.7 34.9 -7.0 25.1 15 16 A S H > S+ 0 0 7 1,-0.3 4,-2.3 -4,-0.3 -1,-0.2 0.887 107.8 52.1 -52.7 -46.5 31.1 -7.1 24.7 16 17 A H H X S+ 0 0 94 -4,-2.5 4,-1.9 1,-0.2 -1,-0.3 0.872 108.4 54.1 -59.4 -35.5 30.8 -3.3 24.6 17 18 A S H X S+ 0 0 49 -4,-1.6 4,-0.9 -3,-0.4 -1,-0.2 0.898 108.1 47.4 -64.9 -41.9 33.4 -3.3 21.9 18 19 A M H < S+ 0 0 44 -4,-1.9 4,-0.4 1,-0.2 3,-0.4 0.861 107.3 59.1 -67.4 -34.6 31.4 -5.8 19.8 19 20 A A H >< S+ 0 0 15 -4,-2.3 3,-1.4 1,-0.2 6,-0.2 0.937 103.2 50.4 -58.5 -47.6 28.3 -3.6 20.4 20 21 A E H 3< S+ 0 0 92 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.743 109.0 54.5 -63.7 -23.7 30.0 -0.7 18.7 21 22 A N T 3< S+ 0 0 90 -4,-0.9 -1,-0.2 -3,-0.4 -2,-0.2 0.422 74.6 119.3 -93.9 0.0 30.9 -2.8 15.7 22 23 A V S <> S- 0 0 13 -3,-1.4 4,-3.2 -4,-0.4 5,-0.2 -0.429 73.5-120.2 -63.7 140.7 27.5 -4.1 14.9 23 24 A G H > S+ 0 0 31 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.929 113.0 49.1 -47.3 -56.6 26.5 -3.0 11.3 24 25 A F H > S+ 0 0 7 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.918 115.0 45.8 -50.0 -49.2 23.5 -1.1 12.4 25 26 A V H > S+ 0 0 21 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.901 107.5 56.1 -63.8 -44.5 25.6 0.7 15.1 26 27 A K H X S+ 0 0 109 -4,-3.2 4,-2.1 1,-0.2 -1,-0.2 0.924 110.5 45.8 -54.1 -45.8 28.5 1.5 12.8 27 28 A C H <>S+ 0 0 38 -4,-2.3 5,-2.7 -5,-0.2 -1,-0.2 0.906 110.6 53.8 -64.0 -42.0 26.1 3.3 10.5 28 29 A F H ><5S+ 0 0 16 -4,-2.1 3,-1.5 -5,-0.2 -2,-0.2 0.919 108.8 48.9 -57.3 -47.0 24.5 5.1 13.4 29 30 A L H 3<5S+ 0 0 73 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.919 105.8 55.5 -61.5 -45.3 27.8 6.4 14.6 30 31 A K T 3<5S- 0 0 185 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.269 127.1-101.8 -73.0 14.2 28.8 7.6 11.2 31 32 A G T < 5S+ 0 0 33 -3,-1.5 2,-1.0 1,-0.2 -3,-0.2 0.452 85.5 125.1 83.3 0.0 25.6 9.6 11.3 32 33 A V < + 0 0 48 -5,-2.7 2,-0.3 -6,-0.2 -1,-0.2 -0.771 28.7 133.2-100.3 95.4 23.4 7.4 9.1 33 34 A V - 0 0 8 -2,-1.0 2,-0.4 111,-0.3 3,-0.0 -0.948 36.8-152.2-132.5 151.8 20.3 6.6 11.2 34 35 A E >> - 0 0 25 -2,-0.3 4,-2.0 1,-0.1 3,-0.9 -0.989 22.3-121.4-140.9 133.1 16.7 6.8 10.0 35 36 A K H 3> S+ 0 0 78 -2,-0.4 4,-1.3 1,-0.2 5,-0.1 0.710 103.9 54.7 -32.5 -45.1 13.4 7.4 11.8 36 37 A N H 3> S+ 0 0 85 2,-0.2 4,-0.7 1,-0.2 -1,-0.2 0.912 114.7 33.7 -69.6 -42.6 11.7 4.1 10.7 37 38 A S H X> S+ 0 0 0 -3,-0.9 3,-1.2 2,-0.2 4,-1.2 0.945 119.9 50.4 -76.7 -45.3 14.2 1.5 11.9 38 39 A Y H 3X S+ 0 0 3 -4,-2.0 4,-1.8 1,-0.3 -2,-0.2 0.767 103.4 63.0 -60.6 -25.4 15.3 3.5 15.0 39 40 A R H 3X S+ 0 0 58 -4,-1.3 4,-1.5 -5,-0.4 -1,-0.3 0.833 100.6 51.2 -68.6 -33.5 11.7 3.9 15.8 40 41 A K H X S+ 0 0 2 -4,-2.1 4,-2.2 1,-0.2 3,-1.1 0.979 111.6 47.7 -62.4 -56.1 11.6 -2.5 22.0 45 46 A L H 3X S+ 0 0 12 -4,-2.8 4,-3.2 1,-0.3 5,-0.4 0.876 104.3 65.3 -52.7 -35.4 13.5 -0.6 24.8 46 47 A Y H 3X S+ 0 0 9 -4,-2.1 4,-1.6 -5,-0.3 -1,-0.3 0.917 106.9 39.9 -52.8 -45.9 10.1 0.7 25.8 47 48 A F H X S+ 0 0 7 -4,-2.2 4,-1.1 1,-0.2 3,-0.6 0.891 111.2 56.3 -63.0 -41.1 10.1 -5.6 38.8 56 57 A M H 3< S+ 0 0 13 -4,-2.5 3,-0.3 1,-0.2 -1,-0.2 0.850 102.7 56.2 -61.3 -33.1 12.7 -3.3 40.4 57 58 A A H >< S+ 0 0 31 -4,-1.1 3,-1.2 -3,-0.3 -1,-0.2 0.795 100.4 58.2 -69.7 -28.9 9.9 -1.5 42.2 58 59 A K H << S+ 0 0 112 -4,-1.0 3,-0.3 -3,-0.6 -1,-0.2 0.810 110.4 44.6 -68.5 -29.4 8.8 -4.8 43.8 59 60 A F T >< S+ 0 0 34 -4,-1.1 3,-1.5 -3,-0.3 -1,-0.3 -0.019 71.7 122.4-104.3 29.8 12.3 -5.1 45.2 60 61 A K T < S+ 0 0 66 -3,-1.2 -1,-0.2 1,-0.3 9,-0.2 0.825 89.3 32.4 -59.5 -28.6 12.6 -1.5 46.4 61 62 A D T 3 S+ 0 0 126 -3,-0.3 -1,-0.3 -4,-0.2 -2,-0.1 0.100 89.6 131.1-115.1 20.3 13.2 -2.9 49.9 62 63 A H S <> S- 0 0 42 -3,-1.5 4,-1.5 1,-0.1 5,-0.2 -0.453 70.9-111.3 -74.1 145.4 15.0 -6.2 49.0 63 64 A P T 4 S+ 0 0 97 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 0.787 111.0 16.5 -45.5 -35.5 18.2 -7.0 50.8 64 65 A I T >4 S+ 0 0 24 113,-0.1 3,-2.3 2,-0.1 4,-0.4 0.849 123.5 50.1-105.0 -64.0 20.3 -6.4 47.7 65 66 A L G >4 S+ 0 0 0 1,-0.3 3,-1.6 2,-0.2 4,-0.1 0.750 94.6 75.0 -49.9 -31.7 18.3 -4.5 45.0 66 67 A S G >< S+ 0 0 45 -4,-1.5 3,-0.6 1,-0.3 -1,-0.3 0.724 90.2 61.2 -55.4 -22.4 17.3 -1.8 47.4 67 68 A H G < S+ 0 0 70 -3,-2.3 -1,-0.3 1,-0.2 -2,-0.2 0.782 110.7 35.9 -76.1 -30.8 20.9 -0.6 47.1 68 69 A I G < S+ 0 0 3 -3,-1.6 2,-1.1 -4,-0.4 -1,-0.2 0.043 85.2 121.9-111.3 25.0 20.6 0.1 43.4 69 70 A Y < + 0 0 52 -3,-0.6 -3,-0.0 -9,-0.2 3,-0.0 -0.741 25.1 154.8 -92.9 94.3 17.0 1.3 43.5 70 71 A F > - 0 0 34 -2,-1.1 3,-3.4 1,-0.1 4,-0.4 -0.766 23.5-172.0-122.0 82.8 17.1 4.8 42.0 71 72 A P T 3 S+ 0 0 57 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.565 80.8 79.5 -51.9 -5.8 13.7 5.6 40.5 72 73 A E T 3 S+ 0 0 70 1,-0.2 87,-0.3 86,-0.0 86,-0.1 0.629 88.0 56.1 -76.9 -14.2 15.4 8.7 39.2 73 74 A L S < S+ 0 0 3 -3,-3.4 -1,-0.2 84,-0.1 87,-0.0 0.770 74.6 131.7 -87.1 -28.6 16.8 6.5 36.5 74 75 A N + 0 0 50 -4,-0.4 4,-0.3 1,-0.1 -24,-0.1 0.120 29.7 179.7 -32.2 118.7 13.4 5.2 35.2 75 76 A R > + 0 0 10 2,-0.1 4,-2.4 1,-0.1 5,-0.3 0.570 54.6 94.5-101.7 -13.2 13.3 5.6 31.4 76 77 A K H > S+ 0 0 27 1,-0.2 4,-1.5 -27,-0.2 5,-0.2 0.911 89.0 42.2 -47.4 -57.8 9.7 4.2 30.7 77 78 A Q H > S+ 0 0 96 1,-0.2 4,-1.9 2,-0.2 3,-0.3 0.906 114.4 49.8 -57.6 -47.4 7.9 7.6 30.7 78 79 A S H > S+ 0 0 13 -4,-0.3 4,-1.5 1,-0.3 76,-0.2 0.868 110.9 51.9 -61.2 -34.4 10.6 9.4 28.7 79 80 A L H X S+ 0 0 2 -4,-2.4 4,-1.8 2,-0.2 -1,-0.3 0.786 105.2 54.5 -72.1 -29.1 10.5 6.5 26.2 80 81 A E H X S+ 0 0 27 -4,-1.5 4,-2.1 -5,-0.3 -1,-0.2 0.875 105.2 54.9 -70.8 -34.6 6.7 6.9 26.0 81 82 A Q H X S+ 0 0 124 -4,-1.9 4,-1.6 1,-0.2 -2,-0.2 0.897 107.6 49.3 -63.8 -38.5 7.4 10.5 25.1 82 83 A D H X S+ 0 0 2 -4,-1.5 4,-2.5 2,-0.2 5,-0.2 0.867 107.8 52.6 -69.5 -36.4 9.6 9.4 22.3 83 84 A L H X>S+ 0 0 0 -4,-1.8 4,-3.3 2,-0.2 5,-0.8 0.896 106.1 55.3 -64.6 -39.5 7.1 6.9 20.9 84 85 A Q H X5S+ 0 0 90 -4,-2.1 4,-1.8 3,-0.2 -1,-0.2 0.919 111.3 45.0 -57.1 -44.9 4.5 9.8 20.8 85 86 A F H <5S+ 0 0 92 -4,-1.6 -2,-0.2 2,-0.2 -1,-0.2 0.903 120.5 37.0 -67.6 -45.2 7.0 11.7 18.7 86 87 A Y H <5S+ 0 0 3 -4,-2.5 -2,-0.2 1,-0.1 -1,-0.2 0.792 134.9 22.8 -80.0 -29.0 7.9 8.9 16.3 87 88 A Y H <5S- 0 0 33 -4,-3.3 3,-0.3 -5,-0.2 -3,-0.2 0.678 100.0-139.6-109.3 -27.3 4.5 7.3 16.1 88 89 A G ><< - 0 0 27 -4,-1.8 3,-2.2 -5,-0.8 6,-0.2 -0.273 50.4 -32.6 92.9 179.0 2.1 10.1 17.1 89 90 A S T 3 S+ 0 0 87 1,-0.3 3,-0.4 2,-0.1 -1,-0.2 0.720 133.5 55.3 -46.0 -34.1 -1.0 10.2 19.2 90 91 A N T >> S+ 0 0 82 -3,-0.3 3,-1.7 1,-0.2 4,-0.9 0.161 71.2 122.6 -89.7 23.5 -2.1 6.7 18.3 91 92 A W H <> + 0 0 13 -3,-2.2 4,-2.6 1,-0.3 3,-0.5 0.803 62.2 65.1 -54.5 -34.9 1.3 5.2 19.4 92 93 A R H 34 S+ 0 0 45 -3,-0.4 -1,-0.3 1,-0.2 -2,-0.1 0.857 110.2 41.7 -56.0 -31.4 -0.3 2.8 21.9 93 94 A Q H <4 S+ 0 0 23 -3,-1.7 -1,-0.2 1,-0.1 -2,-0.2 0.668 118.5 42.6 -90.4 -19.3 -1.8 1.1 18.9 94 95 A E H < S+ 0 0 103 -4,-0.9 -2,-0.2 -3,-0.5 -3,-0.2 0.727 88.6 97.0 -98.8 -26.6 1.2 1.3 16.5 95 96 A V < + 0 0 17 -4,-2.6 2,-0.3 -5,-0.2 -55,-0.1 -0.397 50.2 175.1 -68.5 139.1 4.1 0.3 18.8 96 97 A K - 0 0 77 -2,-0.1 2,-0.4 -56,-0.1 -49,-0.1 -0.927 26.3-125.0-140.0 165.3 5.1 -3.3 18.6 97 98 A I - 0 0 49 -2,-0.3 2,-0.1 -51,-0.1 -56,-0.1 -0.919 22.2-137.2-115.0 138.3 7.8 -5.6 20.1 98 99 A S > - 0 0 24 -2,-0.4 4,-2.4 -58,-0.2 5,-0.2 -0.368 30.0-102.1 -85.7 171.6 10.2 -7.8 18.0 99 100 A A H > S+ 0 0 79 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.924 124.1 47.2 -60.0 -45.3 11.2 -11.4 18.8 100 101 A A H > S+ 0 0 7 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.914 111.9 51.5 -63.0 -40.6 14.6 -10.3 20.1 101 102 A G H > S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.880 109.7 49.4 -62.9 -37.5 12.9 -7.6 22.2 102 103 A Q H X S+ 0 0 68 -4,-2.4 4,-3.0 2,-0.2 -2,-0.2 0.907 108.7 52.0 -68.4 -40.9 10.5 -10.2 23.6 103 104 A A H X S+ 0 0 53 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.910 109.6 51.7 -60.4 -40.8 13.4 -12.5 24.5 104 105 A Y H X S+ 0 0 0 -4,-2.4 4,-1.9 2,-0.2 3,-0.3 0.979 112.3 43.6 -58.2 -58.0 14.9 -9.6 26.2 105 106 A V H X S+ 0 0 10 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.866 111.4 57.1 -54.1 -41.0 11.8 -8.9 28.3 106 107 A D H X S+ 0 0 89 -4,-3.0 4,-2.2 1,-0.2 -1,-0.2 0.904 105.5 49.0 -59.0 -45.2 11.4 -12.6 28.9 107 108 A R H X S+ 0 0 60 -4,-2.4 4,-3.0 -3,-0.3 5,-0.3 0.913 108.7 52.7 -62.8 -43.8 14.9 -12.8 30.5 108 109 A V H X S+ 0 0 0 -4,-1.9 4,-1.8 1,-0.2 -2,-0.2 0.941 112.6 45.1 -56.3 -48.9 14.2 -9.9 32.8 109 110 A R H X S+ 0 0 43 -4,-2.1 4,-0.6 2,-0.2 -1,-0.2 0.857 113.9 49.6 -63.4 -38.4 11.0 -11.4 34.0 110 111 A Q H >X S+ 0 0 66 -4,-2.2 3,-2.0 1,-0.2 4,-1.4 0.973 110.1 48.6 -65.5 -56.3 12.6 -14.8 34.4 111 112 A V H 3X S+ 0 0 5 -4,-3.0 4,-2.3 1,-0.3 7,-0.3 0.846 106.0 60.1 -53.2 -35.6 15.6 -13.5 36.4 112 113 A A H 3< S+ 0 0 6 -4,-1.8 -1,-0.3 -5,-0.3 -2,-0.2 0.698 106.6 46.6 -69.1 -17.6 13.2 -11.6 38.6 113 114 A A H << S+ 0 0 76 -3,-2.0 -1,-0.2 -4,-0.6 -2,-0.2 0.784 129.8 15.5 -94.3 -29.1 11.5 -14.9 39.7 114 115 A T H < S+ 0 0 19 -4,-1.4 -2,-0.2 -3,-0.1 -3,-0.2 0.625 136.9 22.6-119.7 -21.0 14.5 -17.1 40.5 115 116 A A >< + 0 0 0 -4,-2.3 3,-3.6 -5,-0.4 4,-0.4 -0.247 57.3 169.8-146.5 55.9 17.6 -14.8 40.8 116 117 A P G > S+ 0 0 23 0, 0.0 3,-1.3 0, 0.0 4,-0.2 0.696 76.9 68.2 -40.6 -26.1 16.5 -11.2 41.6 117 118 A E G > S+ 0 0 28 1,-0.3 3,-1.7 2,-0.2 4,-0.3 0.789 86.2 66.6 -69.9 -24.1 20.2 -10.4 42.2 118 119 A L G X> S+ 0 0 8 -3,-3.6 3,-1.4 1,-0.3 4,-0.9 0.657 81.5 81.2 -68.2 -13.3 20.9 -10.8 38.5 119 120 A L H <> S+ 0 0 0 -3,-1.3 4,-2.4 -4,-0.4 -1,-0.3 0.693 78.9 66.5 -64.4 -20.0 18.7 -7.7 38.0 120 121 A V H <> S+ 0 0 0 -3,-1.7 4,-2.0 2,-0.2 -1,-0.3 0.775 96.0 55.8 -73.5 -23.0 21.8 -5.6 39.0 121 122 A A H <> S+ 0 0 0 -3,-1.4 4,-2.9 -4,-0.3 -1,-0.2 0.879 110.8 44.1 -73.0 -37.7 23.4 -6.8 35.8 122 123 A H H X S+ 0 0 0 -4,-0.9 4,-2.1 2,-0.2 5,-0.3 0.883 113.4 49.0 -72.8 -42.2 20.4 -5.5 33.8 123 124 A S H X>S+ 0 0 2 -4,-2.4 5,-1.0 2,-0.2 4,-0.8 0.919 115.1 47.7 -62.4 -42.7 20.3 -2.3 35.7 124 125 A Y H X>S+ 0 0 24 -4,-2.0 4,-1.1 1,-0.2 5,-0.7 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B L H X S+ 0 0 0 -4,-2.7 4,-1.4 2,-0.2 -2,-0.2 0.906 112.1 48.1 -76.1 -42.6 18.4 -45.3 40.7 232 10 B R H < S+ 0 0 138 -4,-1.8 3,-0.4 -5,-0.3 -2,-0.2 0.968 120.8 36.9 -60.8 -52.9 20.7 -47.4 38.6 233 11 B E H >< S+ 0 0 111 -4,-2.8 3,-1.0 1,-0.2 4,-0.4 0.878 115.4 54.6 -67.2 -39.9 18.3 -50.3 38.5 234 12 B G H 3< S+ 0 0 33 -4,-2.1 -1,-0.2 -5,-0.3 4,-0.2 0.690 114.8 38.6 -69.7 -19.4 15.2 -48.1 38.3 235 13 B T T 3X S+ 0 0 5 -4,-1.4 4,-2.5 -3,-0.4 -1,-0.2 0.211 86.2 104.4-112.8 11.0 16.4 -46.2 35.2 236 14 B K H <> S+ 0 0 96 -3,-1.0 4,-1.7 2,-0.2 5,-0.2 0.956 82.3 45.0 -55.5 -57.2 17.9 -49.3 33.5 237 15 B K H > S+ 0 0 153 -4,-0.4 4,-2.1 1,-0.2 -1,-0.2 0.914 113.1 52.0 -54.8 -45.4 15.1 -49.7 31.0 238 16 B S H > S+ 0 0 14 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.884 105.3 53.2 -61.2 -41.6 15.1 -45.9 30.3 239 17 B H H X S+ 0 0 95 -4,-2.5 4,-1.2 1,-0.2 -1,-0.2 0.867 110.3 50.1 -62.8 -33.0 18.8 -45.8 29.6 240 18 B S H X S+ 0 0 50 -4,-1.7 4,-0.9 2,-0.2 -2,-0.2 0.886 109.2 49.0 -72.9 -37.7 18.2 -48.6 27.1 241 19 B M H >< S+ 0 0 98 -4,-2.1 3,-1.0 1,-0.2 -2,-0.2 0.921 107.6 56.9 -64.6 -42.6 15.4 -46.8 25.4 242 20 B A H >< S+ 0 0 17 -4,-2.8 3,-0.8 1,-0.3 -1,-0.2 0.845 105.9 50.0 -56.3 -35.2 17.6 -43.7 25.3 243 21 B E H 3< S+ 0 0 86 -4,-1.2 -1,-0.3 1,-0.2 -2,-0.2 0.687 107.9 54.9 -77.7 -18.9 20.2 -45.8 23.4 244 22 B N T << S+ 0 0 97 -3,-1.0 2,-0.5 -4,-0.9 -1,-0.2 0.114 74.8 119.9-102.0 20.0 17.6 -47.0 20.9 245 23 B V S X> S- 0 0 13 -3,-0.8 4,-2.1 1,-0.1 3,-1.6 -0.767 72.3-123.5 -85.6 125.3 16.3 -43.6 19.8 246 24 B G H 3> S+ 0 0 32 -2,-0.5 4,-1.9 1,-0.3 5,-0.2 0.802 110.4 51.3 -33.9 -50.6 16.9 -43.3 16.0 247 25 B F H 3> S+ 0 0 6 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.872 112.3 46.5 -60.4 -37.5 19.0 -40.1 16.4 248 26 B V H <> S+ 0 0 21 -3,-1.6 4,-3.6 2,-0.2 -2,-0.2 0.857 107.3 55.4 -76.3 -35.6 21.2 -41.8 19.0 249 27 B K H X S+ 0 0 99 -4,-2.1 4,-1.8 2,-0.2 6,-0.2 0.949 110.2 46.6 -60.8 -46.2 21.8 -45.0 17.1 250 28 B C H <>S+ 0 0 37 -4,-1.9 5,-3.8 -5,-0.2 -1,-0.2 0.891 113.2 50.0 -61.2 -40.6 23.0 -43.0 14.1 251 29 B F H ><5S+ 0 0 11 -4,-1.6 3,-2.7 3,-0.2 -2,-0.2 0.982 109.1 50.9 -59.6 -56.4 25.2 -41.0 16.4 252 30 B L H 3<5S+ 0 0 71 -4,-3.6 -1,-0.2 1,-0.3 -2,-0.2 0.769 108.7 52.6 -53.6 -29.6 26.6 -44.2 18.0 253 31 B K T 3<5S- 0 0 170 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.225 128.5 -96.4 -92.6 14.9 27.4 -45.6 14.5 254 32 B G T < 5S+ 0 0 36 -3,-2.7 2,-0.8 1,-0.2 -3,-0.2 0.594 86.2 128.0 84.8 11.5 29.3 -42.4 13.6 255 33 B V < + 0 0 54 -5,-3.8 2,-0.3 -6,-0.2 -1,-0.2 -0.838 26.2 136.7-106.3 100.6 26.5 -40.7 11.8 256 34 B V - 0 0 18 -2,-0.8 2,-0.3 -5,-0.1 -8,-0.0 -0.909 43.1-141.6-151.0 119.4 26.0 -37.2 13.3 257 35 B E > - 0 0 41 -2,-0.3 4,-1.9 1,-0.1 5,-0.1 -0.590 16.9-136.8 -77.7 134.1 25.4 -33.8 11.6 258 36 B K H > S+ 0 0 90 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.890 99.9 53.7 -58.2 -42.4 27.2 -30.9 13.2 259 37 B N H > S+ 0 0 75 1,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.904 110.7 42.5 -63.0 -46.2 24.2 -28.5 12.9 260 38 B S H > S+ 0 0 0 2,-0.2 4,-1.0 1,-0.2 3,-0.2 0.867 113.7 55.9 -69.7 -31.8 21.7 -30.8 14.7 261 39 B Y H >X S+ 0 0 6 -4,-1.9 4,-2.1 1,-0.2 3,-1.2 0.965 105.1 48.9 -63.2 -52.3 24.3 -31.6 17.3 262 40 B R H 3X S+ 0 0 64 -4,-2.5 4,-2.3 1,-0.3 -1,-0.2 0.688 105.1 59.7 -62.6 -18.4 25.0 -28.0 18.3 263 41 B K H 3X S+ 0 0 61 -4,-0.8 4,-1.7 -3,-0.2 -1,-0.3 0.800 106.2 48.4 -77.2 -29.5 21.3 -27.5 18.6 264 42 B L H X S+ 0 0 2 -4,-1.7 4,-2.0 1,-0.2 3,-0.7 0.932 111.2 50.6 -61.1 -44.4 19.4 -26.9 24.8 268 46 B L H 3X S+ 0 0 15 -4,-2.3 4,-3.1 1,-0.2 5,-0.4 0.886 101.1 62.9 -61.0 -38.7 21.7 -28.5 27.3 269 47 B Y H 3X S+ 0 0 8 -4,-2.5 4,-1.6 1,-0.2 -1,-0.2 0.864 109.0 42.5 -53.3 -37.0 23.3 -25.1 28.0 270 48 B F H < S+ 0 0 12 -4,-2.6 3,-0.7 1,-0.2 -1,-0.2 0.918 105.2 50.2 -62.1 -43.2 21.4 -26.1 43.0 280 58 B A H >< S+ 0 0 28 -4,-1.0 3,-2.0 1,-0.3 4,-0.2 0.922 104.5 57.6 -61.3 -45.0 23.6 -23.3 44.3 281 59 B K H 3< S+ 0 0 111 -4,-1.6 3,-0.3 1,-0.3 -1,-0.3 0.747 111.0 45.0 -59.1 -22.3 20.6 -21.7 46.1 282 60 B F T X< S+ 0 0 42 -4,-1.0 3,-2.5 -3,-0.7 -1,-0.3 0.164 71.2 118.2-108.7 19.6 20.2 -25.0 48.0 283 61 B K T < S+ 0 0 77 -3,-2.0 -1,-0.2 1,-0.3 9,-0.2 0.772 84.4 44.8 -55.4 -26.3 23.8 -25.7 48.9 284 62 B D T 3 S+ 0 0 147 -3,-0.3 -1,-0.3 -4,-0.2 -2,-0.1 0.056 86.5 128.8-105.7 23.5 22.8 -25.5 52.6 285 63 B H <> - 0 0 46 -3,-2.5 4,-2.6 1,-0.1 5,-0.3 -0.642 66.7-124.7 -83.7 134.2 19.7 -27.6 52.1 286 64 B P T 4 S+ 0 0 98 0, 0.0 4,-0.2 0, 0.0 -1,-0.1 0.825 108.7 21.9 -43.1 -43.4 19.2 -30.6 54.5 287 65 B I T >4 S+ 0 0 30 2,-0.1 3,-0.7 113,-0.1 4,-0.2 0.867 125.9 47.3 -96.4 -43.9 18.9 -33.1 51.6 288 66 B L G >4 S+ 0 0 1 1,-0.2 3,-1.2 2,-0.2 4,-0.4 0.625 92.9 76.4 -76.8 -13.8 20.6 -31.3 48.7 289 67 B S G >< S+ 0 0 48 -4,-2.6 3,-0.9 1,-0.2 -1,-0.2 0.854 88.3 63.2 -63.4 -31.3 23.7 -30.2 50.5 290 68 B H G < S+ 0 0 75 -3,-0.7 -1,-0.2 -5,-0.3 -2,-0.2 0.667 110.3 35.8 -66.9 -19.9 24.9 -33.9 50.3 291 69 B I G < S+ 0 0 2 -3,-1.2 2,-1.1 -4,-0.2 -1,-0.2 0.275 80.4 123.1-117.6 9.9 25.1 -33.7 46.5 292 70 B Y < + 0 0 64 -3,-0.9 3,-0.1 -4,-0.4 -3,-0.0 -0.626 27.3 156.3 -74.9 101.0 26.2 -30.1 46.0 293 71 B F > - 0 0 34 -2,-1.1 3,-3.0 1,-0.1 4,-0.3 -0.661 20.0-177.9-128.3 75.6 29.4 -30.7 44.0 294 72 B P G > S+ 0 0 54 0, 0.0 3,-1.1 0, 0.0 -1,-0.1 0.689 75.8 78.8 -47.7 -20.4 30.2 -27.5 42.0 295 73 B E G 3 S+ 0 0 65 1,-0.3 87,-0.4 87,-0.1 88,-0.1 0.675 90.5 57.7 -63.2 -14.9 33.2 -29.3 40.5 296 74 B L G < S+ 0 0 2 -3,-3.0 -1,-0.3 86,-0.1 87,-0.1 0.749 75.7 128.8 -84.9 -28.4 30.6 -31.0 38.2 297 75 B N < - 0 0 68 -3,-1.1 4,-0.2 -4,-0.3 -24,-0.1 0.109 31.4-178.8 -34.9 132.9 29.1 -27.7 36.8 298 76 B R > + 0 0 9 2,-0.1 4,-2.9 3,-0.1 5,-0.3 0.502 53.6 98.4-117.9 -5.8 28.9 -27.7 33.0 299 77 B K H > S+ 0 0 53 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.919 90.7 45.4 -47.8 -52.5 27.5 -24.3 32.1 300 78 B Q H > S+ 0 0 105 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.901 112.4 50.3 -61.3 -42.0 31.0 -22.9 31.4 301 79 B S H > S+ 0 0 8 1,-0.2 4,-1.8 2,-0.2 76,-0.3 0.896 110.1 50.5 -65.9 -38.2 32.0 -26.0 29.4 302 80 B L H X S+ 0 0 1 -4,-2.9 4,-3.0 1,-0.2 -1,-0.2 0.863 106.7 55.7 -65.7 -35.7 28.8 -25.7 27.3 303 81 B E H X S+ 0 0 17 -4,-2.0 4,-1.5 -5,-0.3 -1,-0.2 0.879 106.9 49.8 -64.2 -36.6 29.6 -22.0 26.7 304 82 B Q H X S+ 0 0 94 -4,-1.7 4,-1.2 2,-0.2 -1,-0.2 0.869 112.3 47.6 -69.8 -35.7 33.0 -23.0 25.3 305 83 B D H X S+ 0 0 2 -4,-1.8 4,-2.6 2,-0.2 5,-0.2 0.905 109.2 52.4 -72.6 -38.7 31.3 -25.6 23.0 306 84 B L H X S+ 0 0 0 -4,-3.0 4,-2.0 1,-0.2 5,-0.4 0.829 108.1 53.4 -64.7 -29.5 28.7 -23.1 21.8 307 85 B Q H X S+ 0 0 103 -4,-1.5 4,-1.4 -5,-0.2 -1,-0.2 0.828 110.6 46.6 -72.9 -30.7 31.5 -20.7 21.0 308 86 B F H < S+ 0 0 75 -4,-1.2 -2,-0.2 -3,-0.2 -1,-0.2 0.911 119.5 38.3 -75.4 -45.1 33.2 -23.5 18.9 309 87 B Y H < S+ 0 0 12 -4,-2.6 -2,-0.2 1,-0.1 -3,-0.2 0.729 132.4 25.1 -79.2 -23.4 30.0 -24.5 17.1 310 88 B Y H < S- 0 0 35 -4,-2.0 3,-0.4 -5,-0.2 -3,-0.2 0.614 100.3-128.5-116.4 -18.8 28.6 -21.0 16.7 311 89 B G >< - 0 0 30 -4,-1.4 3,-1.6 -5,-0.4 -1,-0.2 -0.434 54.7 -39.0 97.3-176.2 31.5 -18.6 16.7 312 90 B S T 3 S+ 0 0 80 1,-0.3 3,-0.3 -2,-0.1 -1,-0.2 0.666 136.1 55.1 -61.2 -19.0 32.0 -15.4 18.8 313 91 B N T >> + 0 0 65 -3,-0.4 3,-1.4 1,-0.2 4,-0.9 0.053 67.0 121.4-102.5 25.1 28.4 -14.4 18.5 314 92 B W H X> + 0 0 5 -3,-1.6 4,-3.8 1,-0.3 3,-1.4 0.890 64.3 68.5 -53.9 -41.4 26.9 -17.7 19.8 315 93 B R H 34 S+ 0 0 74 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.836 107.8 37.9 -47.3 -37.1 25.1 -15.8 22.6 316 94 B Q H <4 S+ 0 0 18 -3,-1.4 -1,-0.3 1,-0.1 -2,-0.2 0.596 119.4 50.4 -90.2 -13.6 22.9 -14.3 19.9 317 95 B E H << S+ 0 0 94 -3,-1.4 -2,-0.2 -4,-0.9 -3,-0.2 0.819 81.5 105.5 -91.2 -39.3 22.8 -17.6 17.9 318 96 B V < - 0 0 17 -4,-3.8 2,-0.3 -5,-0.1 -55,-0.1 -0.169 48.5-178.7 -48.3 130.7 21.8 -20.0 20.7 319 97 B K - 0 0 97 -56,-0.1 2,-0.4 0, 0.0 -2,-0.1 -0.879 18.9-136.7-129.8 159.0 18.2 -21.1 20.5 320 98 B I - 0 0 52 -2,-0.3 2,-0.1 -50,-0.0 -56,-0.1 -0.970 14.3-138.2-121.9 136.3 16.1 -23.4 22.6 321 99 B S > - 0 0 18 -2,-0.4 4,-2.5 -58,-0.2 5,-0.2 -0.356 29.9-106.9 -82.6 168.8 13.7 -26.0 21.3 322 100 B A H > S+ 0 0 75 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.909 123.3 50.5 -62.3 -41.9 10.2 -26.6 22.8 323 101 B A H > S+ 0 0 7 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.917 109.7 50.9 -62.1 -43.7 11.5 -29.9 24.4 324 102 B G H > S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.929 110.2 49.1 -60.1 -43.9 14.4 -28.0 25.8 325 103 B Q H X S+ 0 0 79 -4,-2.5 4,-3.1 2,-0.2 -2,-0.2 0.919 110.2 50.4 -62.8 -43.3 12.1 -25.3 27.3 326 104 B A H X S+ 0 0 39 -4,-2.7 4,-2.2 2,-0.2 -1,-0.2 0.943 110.2 50.8 -59.0 -45.5 9.9 -28.0 28.8 327 105 B Y H X S+ 0 0 1 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.941 112.9 46.0 -55.1 -52.1 13.0 -29.6 30.4 328 106 B V H X S+ 0 0 10 -4,-2.6 4,-2.3 1,-0.2 5,-0.2 0.894 110.3 53.2 -58.4 -45.9 14.0 -26.2 31.8 329 107 B D H X S+ 0 0 79 -4,-3.1 4,-1.8 1,-0.2 -1,-0.2 0.856 107.9 52.0 -60.1 -36.0 10.5 -25.4 33.1 330 108 B R H X S+ 0 0 12 -4,-2.2 4,-2.4 2,-0.2 5,-0.3 0.923 107.8 50.3 -67.8 -45.0 10.5 -28.8 34.9 331 109 B V H X S+ 0 0 0 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.948 113.6 45.8 -57.7 -47.3 13.8 -28.1 36.6 332 110 B R H X S+ 0 0 46 -4,-2.3 4,-0.6 1,-0.2 -1,-0.2 0.848 112.1 54.1 -64.6 -32.0 12.5 -24.7 37.8 333 111 B Q H >X S+ 0 0 41 -4,-1.8 4,-1.0 -5,-0.2 3,-0.5 0.909 108.5 44.0 -71.0 -44.8 9.2 -26.2 38.9 334 112 B V H >X S+ 0 0 1 -4,-2.4 4,-3.2 1,-0.2 3,-0.5 0.883 109.3 59.3 -67.1 -37.4 10.6 -29.0 41.1 335 113 B A H 3< S+ 0 0 7 -4,-1.9 -1,-0.2 -5,-0.3 -2,-0.2 0.716 110.0 43.6 -63.3 -21.3 13.0 -26.5 42.7 336 114 B A H << S+ 0 0 83 -4,-0.6 -1,-0.2 -3,-0.5 -2,-0.2 0.633 130.9 18.3 -99.3 -16.4 10.0 -24.3 43.7 337 115 B T H << S+ 0 0 109 -4,-1.0 -2,-0.2 -3,-0.5 -3,-0.2 0.608 138.2 15.1-128.3 -21.4 7.7 -27.0 45.1 338 116 B A >< + 0 0 12 -4,-3.2 3,-2.7 -5,-0.2 4,-0.4 -0.351 58.9 177.8-157.8 66.8 9.8 -30.2 45.8 339 117 B P G > S+ 0 0 23 0, 0.0 3,-1.6 0, 0.0 4,-0.2 0.709 77.1 71.0 -42.6 -32.9 13.6 -29.4 45.8 340 118 B E G > S+ 0 0 41 1,-0.3 3,-2.0 2,-0.2 4,-0.3 0.809 85.0 64.5 -61.0 -32.2 14.3 -33.0 46.7 341 119 B L G X> S+ 0 0 11 -3,-2.7 3,-1.2 1,-0.3 4,-0.9 0.716 82.6 81.7 -66.1 -14.5 13.3 -34.2 43.2 342 120 B L H <> S+ 0 0 0 -3,-1.6 4,-1.7 -4,-0.4 -1,-0.3 0.723 77.4 69.0 -61.9 -18.8 16.3 -32.2 42.1 343 121 B V H <> S+ 0 0 0 -3,-2.0 4,-2.4 1,-0.2 -1,-0.3 0.889 93.8 55.7 -69.2 -32.2 18.4 -35.2 43.1 344 122 B A H <> S+ 0 0 0 -3,-1.2 4,-2.4 -4,-0.3 -1,-0.2 0.865 108.4 49.5 -63.9 -33.1 16.9 -37.1 40.2 345 123 B H H X S+ 0 0 0 -4,-0.9 4,-1.7 2,-0.2 5,-0.4 0.845 110.2 47.8 -75.3 -34.2 18.1 -34.3 37.9 346 124 B S H X>S+ 0 0 2 -4,-1.7 4,-1.8 2,-0.2 5,-1.0 0.902 115.8 45.9 -71.6 -41.7 21.7 -34.2 39.2 347 125 B Y H X>S+ 0 0 25 -4,-2.4 5,-1.1 3,-0.2 4,-0.6 0.955 112.5 49.3 -64.9 -51.5 21.9 -38.0 38.9 348 126 B T H <5S+ 0 0 12 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.888 125.4 26.2 -58.1 -42.8 20.4 -38.2 35.4 349 127 B R H X5S+ 0 0 31 -4,-1.7 4,-1.9 -5,-0.1 -2,-0.2 0.945 127.9 36.4 -88.0 -55.8 22.7 -35.5 34.0 350 128 B Y H X5S+ 0 0 7 -4,-1.8 4,-2.5 -5,-0.4 -3,-0.2 0.937 117.9 45.5 -69.2 -49.2 25.9 -35.5 36.0 351 129 B L H XX S+ 0 0 25 -4,-2.7 4,-2.3 -5,-0.2 3,-0.5 0.473 92.5 105.2 -93.7 0.3 29.6 -42.2 29.5 357 135 B G H 3X S+ 0 0 2 -4,-1.2 4,-2.6 -5,-0.4 -1,-0.2 0.857 81.3 43.1 -45.8 -53.2 31.4 -39.0 28.9 358 136 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