==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 10-AUG-04 1WNV . COMPND 2 MOLECULE: HEME OXYGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: CORYNEBACTERIUM DIPHTHERIAE; . AUTHOR T.MATSUI,M.UNNO,M.IKEDA-SAITO . 624 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 29149.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 490 78.5 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 . 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 . 17 2.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 61 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 389 62.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 18 2.9 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 1 0 0 1 4 0 0 0 3 2 1 2 1 2 0 0 0 0 0 0 0 0 3 2 1 0 3 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 7 A G > 0 0 75 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 166.4 39.2 -8.7 13.4 2 8 A L H > + 0 0 4 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.853 360.0 53.4 -63.1 -42.6 36.6 -6.0 12.5 3 9 A A H > S+ 0 0 10 168,-0.3 4,-2.0 1,-0.2 -1,-0.2 0.943 113.8 43.3 -58.7 -47.3 35.7 -7.3 9.0 4 10 A V H > S+ 0 0 86 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.939 113.3 51.2 -64.4 -45.2 34.9 -10.7 10.4 5 11 A E H X S+ 0 0 76 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.891 109.0 51.4 -62.2 -39.6 33.0 -9.3 13.4 6 12 A L H X S+ 0 0 0 -4,-3.0 4,-1.3 2,-0.2 -1,-0.2 0.945 111.6 47.9 -59.2 -46.6 30.9 -7.0 11.1 7 13 A K H X S+ 0 0 146 -4,-2.0 4,-0.7 -5,-0.3 3,-0.4 0.941 115.8 42.6 -62.1 -46.2 30.0 -10.0 8.9 8 14 A Q H >< S+ 0 0 146 -4,-2.5 3,-0.7 1,-0.2 4,-0.4 0.914 112.1 52.6 -72.0 -39.9 29.1 -12.3 11.8 9 15 A S H 3< S+ 0 0 53 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.674 119.3 35.8 -71.2 -18.4 27.2 -9.7 13.8 10 16 A T H 3X S+ 0 0 3 -4,-1.3 4,-2.4 -3,-0.4 -1,-0.2 0.321 87.8 102.5-110.6 4.3 25.0 -8.9 10.7 11 17 A A H S+ 0 0 170 -4,-0.4 4,-1.8 1,-0.2 -1,-0.2 0.901 113.1 48.9 -77.4 -34.9 21.2 -13.1 10.6 13 19 A A H > S+ 0 0 30 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.841 108.8 54.2 -65.7 -35.5 19.9 -9.7 9.3 14 20 A H H X S+ 0 0 87 -4,-2.4 4,-1.5 2,-0.2 -2,-0.2 0.904 108.4 49.3 -70.1 -35.8 21.5 -10.3 5.9 15 21 A E H X S+ 0 0 119 -4,-1.8 4,-0.8 1,-0.2 -1,-0.2 0.875 110.2 50.3 -66.6 -38.2 19.6 -13.6 5.7 16 22 A K H < S+ 0 0 121 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.809 109.0 53.8 -65.2 -34.7 16.4 -11.8 6.7 17 23 A A H >< S+ 0 0 28 -4,-1.8 3,-0.8 1,-0.2 -2,-0.2 0.787 102.8 55.9 -71.1 -29.8 17.2 -9.2 3.8 18 24 A E H 3< S+ 0 0 113 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.847 112.4 44.4 -68.0 -27.8 17.5 -12.0 1.3 19 25 A H T 3< S+ 0 0 123 -4,-0.8 -1,-0.2 -3,-0.1 -2,-0.2 0.113 75.0 132.3-109.3 12.3 14.0 -13.1 2.2 20 26 A S <> - 0 0 9 -3,-0.8 4,-3.1 1,-0.1 5,-0.3 -0.425 65.3-120.5 -65.2 148.5 12.0 -9.8 2.4 21 27 A T H > S+ 0 0 106 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.916 110.9 46.8 -59.6 -45.3 8.7 -10.2 0.4 22 28 A F H > S+ 0 0 13 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.950 118.0 39.7 -61.1 -52.3 9.6 -7.3 -1.9 23 29 A M H > S+ 0 0 15 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.900 115.7 51.3 -71.0 -37.6 13.2 -8.4 -2.7 24 30 A S H X S+ 0 0 23 -4,-3.1 4,-1.9 2,-0.2 6,-0.2 0.962 114.7 43.1 -60.2 -46.8 12.2 -12.0 -2.9 25 31 A D H X>S+ 0 0 32 -4,-2.6 5,-2.0 -5,-0.3 6,-0.6 0.930 114.7 51.5 -66.8 -43.3 9.4 -11.3 -5.3 26 32 A L H ><5S+ 0 0 0 -4,-2.8 3,-0.9 -5,-0.2 5,-0.3 0.928 113.1 42.7 -56.8 -53.4 11.6 -8.9 -7.3 27 33 A L H 3<5S+ 0 0 45 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.724 110.0 56.6 -71.0 -25.6 14.5 -11.3 -7.7 28 34 A K H 3<5S- 0 0 141 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.474 118.7-106.9 -81.9 -6.2 12.2 -14.3 -8.6 29 35 A G T <<5S+ 0 0 28 -3,-0.9 -3,-0.2 -4,-0.6 -2,-0.1 0.546 85.3 121.0 95.7 10.6 10.6 -12.4 -11.5 30 36 A R S - 0 0 17 1,-0.1 4,-2.0 -2,-0.0 5,-0.2 -0.972 34.2 -78.5-175.4 171.5 8.5 -5.7 -12.9 33 39 A V H > S+ 0 0 65 -2,-0.3 4,-2.4 1,-0.2 5,-0.1 0.810 122.6 63.0 -59.8 -30.0 10.8 -2.9 -14.0 34 40 A A H > S+ 0 0 49 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.961 105.9 43.9 -60.8 -47.5 8.3 -0.4 -12.4 35 41 A E H > S+ 0 0 74 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.896 113.0 50.8 -66.9 -38.6 9.0 -2.0 -9.0 36 42 A F H X S+ 0 0 0 -4,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.899 109.3 53.2 -62.7 -34.6 12.7 -2.1 -9.6 37 43 A T H X S+ 0 0 5 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.908 105.8 51.8 -72.8 -39.9 12.5 1.6 -10.6 38 44 A R H X S+ 0 0 83 -4,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.867 109.5 51.5 -59.9 -42.0 10.7 2.5 -7.3 39 45 A L H X S+ 0 0 7 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.927 109.3 48.6 -54.6 -53.4 13.6 0.7 -5.4 40 46 A Q H X S+ 0 0 4 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.807 108.0 56.3 -64.5 -30.5 16.2 2.7 -7.3 41 47 A E H X S+ 0 0 4 -4,-1.8 4,-1.5 2,-0.2 -1,-0.2 0.918 110.7 42.2 -63.6 -46.2 14.3 5.9 -6.6 42 48 A Q H X S+ 0 0 20 -4,-1.8 4,-2.2 2,-0.2 5,-0.2 0.881 113.0 55.2 -66.4 -40.7 14.4 5.3 -2.8 43 49 A A H X S+ 0 0 4 -4,-2.6 4,-3.4 2,-0.2 5,-0.3 0.911 103.1 55.6 -61.9 -35.4 18.0 4.2 -3.2 44 50 A W H X S+ 0 0 42 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.938 107.5 50.6 -61.5 -41.1 18.9 7.5 -4.9 45 51 A L H X S+ 0 0 37 -4,-1.5 4,-1.8 2,-0.2 -2,-0.2 0.936 116.7 37.6 -62.5 -46.3 17.5 9.3 -1.9 46 52 A F H X S+ 0 0 4 -4,-2.2 4,-2.9 2,-0.2 -2,-0.2 0.888 115.4 52.5 -81.6 -29.0 19.5 7.3 0.7 47 53 A Y H X S+ 0 0 4 -4,-3.4 4,-2.7 -5,-0.2 27,-0.2 0.907 107.7 53.7 -67.0 -36.8 22.7 7.1 -1.4 48 54 A T H X S+ 0 0 39 -4,-2.4 4,-1.4 -5,-0.3 -2,-0.2 0.943 113.2 42.3 -59.0 -50.8 22.6 10.8 -1.9 49 55 A A H X S+ 0 0 5 -4,-1.8 4,-1.8 2,-0.2 3,-0.2 0.913 113.3 52.0 -60.3 -45.2 22.4 11.3 1.9 50 56 A L H X S+ 0 0 0 -4,-2.9 4,-2.6 1,-0.2 -2,-0.2 0.926 107.0 55.1 -59.8 -38.6 25.0 8.6 2.6 51 57 A E H X S+ 0 0 10 -4,-2.7 4,-2.3 1,-0.3 -1,-0.2 0.824 103.7 52.9 -73.4 -23.1 27.4 10.3 0.2 52 58 A Q H X S+ 0 0 78 -4,-1.4 4,-2.1 -3,-0.2 -1,-0.3 0.908 110.9 48.2 -68.8 -44.0 27.1 13.7 2.0 53 59 A A H X S+ 0 0 0 -4,-1.8 4,-2.5 2,-0.2 -2,-0.2 0.928 110.3 51.2 -60.5 -43.1 28.0 11.9 5.2 54 60 A V H X S+ 0 0 1 -4,-2.6 4,-3.0 1,-0.2 5,-0.3 0.910 108.8 51.8 -59.6 -46.6 30.9 10.1 3.5 55 61 A D H X S+ 0 0 78 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.922 110.7 48.8 -57.2 -41.6 32.2 13.5 2.1 56 62 A A H X S+ 0 0 26 -4,-2.1 4,-1.4 2,-0.2 -2,-0.2 0.932 114.6 42.9 -63.7 -47.3 32.1 14.9 5.6 57 63 A V H X>S+ 0 0 0 -4,-2.5 5,-1.5 1,-0.2 4,-0.6 0.905 112.6 51.9 -69.8 -43.9 33.9 12.1 7.3 58 64 A R H ><5S+ 0 0 49 -4,-3.0 3,-1.2 1,-0.2 -1,-0.2 0.884 108.8 52.4 -58.3 -44.0 36.5 11.7 4.5 59 65 A A H 3<5S+ 0 0 89 -4,-2.0 -1,-0.2 -5,-0.3 -2,-0.2 0.858 101.8 59.7 -63.4 -30.3 37.3 15.5 4.8 60 66 A S H 3<5S- 0 0 68 -4,-1.4 -1,-0.2 -3,-0.2 -2,-0.2 0.619 117.6-114.1 -70.5 -14.9 37.8 15.1 8.6 61 67 A G T <<5S+ 0 0 48 -3,-1.2 3,-0.5 -4,-0.6 2,-0.4 0.511 70.5 136.3 93.1 7.7 40.6 12.7 7.8 62 68 A F S > S+ 0 0 13 -2,-0.4 4,-1.5 1,-0.1 3,-0.6 0.845 81.7 164.9 49.5 42.2 39.1 6.2 7.3 64 70 A E T 34 + 0 0 128 -3,-0.5 3,-0.4 1,-0.3 -1,-0.1 0.919 65.5 50.4 -64.3 -44.2 40.2 8.2 4.3 65 71 A S T 34 S+ 0 0 75 1,-0.3 -1,-0.3 2,-0.1 3,-0.2 0.741 109.3 52.2 -68.9 -23.7 41.5 5.3 2.2 66 72 A L T <4 S+ 0 0 3 -3,-0.6 2,-2.4 1,-0.2 -1,-0.3 0.851 94.6 73.3 -72.4 -36.5 38.3 3.2 2.7 67 73 A L S < S+ 0 0 1 -4,-1.5 -1,-0.2 -3,-0.4 -2,-0.1 -0.289 70.5 177.2 -82.7 57.6 36.1 6.1 1.6 68 74 A D > - 0 0 48 -2,-2.4 3,-1.9 -3,-0.2 4,-0.2 -0.463 27.7-146.1 -66.0 118.5 37.0 5.8 -2.1 69 75 A P G > S+ 0 0 68 0, 0.0 3,-1.6 0, 0.0 -1,-0.2 0.697 93.5 74.6 -62.4 -18.5 35.0 8.3 -4.2 70 76 A A G 3 S+ 0 0 41 1,-0.3 90,-0.1 89,-0.1 88,-0.1 0.748 87.6 64.5 -64.1 -19.8 34.8 5.8 -7.1 71 77 A L G < S+ 0 0 1 -3,-1.9 -1,-0.3 86,-0.1 -3,-0.1 0.685 72.5 123.1 -71.3 -19.9 32.3 4.0 -4.9 72 78 A N < + 0 0 48 -3,-1.6 4,-0.2 -4,-0.2 -24,-0.1 -0.212 33.9 176.0 -50.9 125.1 29.8 7.0 -5.1 73 79 A R > + 0 0 6 -26,-0.1 4,-3.0 2,-0.1 5,-0.2 0.574 53.5 86.1-102.6 -19.6 26.5 5.8 -6.6 74 80 A A H > S+ 0 0 3 1,-0.2 4,-2.2 -27,-0.2 5,-0.1 0.908 93.5 42.6 -63.4 -46.3 24.2 8.7 -6.5 75 81 A E H > S+ 0 0 132 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.906 116.4 48.8 -64.5 -45.2 25.1 10.3 -9.9 76 82 A V H > S+ 0 0 26 1,-0.2 4,-2.0 2,-0.2 78,-0.2 0.916 111.2 51.2 -61.3 -42.4 25.2 6.9 -11.6 77 83 A L H X S+ 0 0 0 -4,-3.0 4,-2.4 2,-0.2 -2,-0.2 0.884 106.6 53.6 -59.3 -40.7 21.8 6.0 -10.1 78 84 A A H X S+ 0 0 5 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.922 108.5 49.7 -64.4 -40.5 20.3 9.3 -11.3 79 85 A R H X S+ 0 0 123 -4,-2.1 4,-1.3 1,-0.2 -1,-0.2 0.887 111.0 50.0 -60.8 -39.9 21.5 8.4 -14.9 80 86 A D H X S+ 0 0 2 -4,-2.0 4,-2.7 1,-0.2 -1,-0.2 0.889 110.9 49.2 -62.6 -39.8 19.9 4.9 -14.5 81 87 A L H X S+ 0 0 0 -4,-2.4 4,-2.8 1,-0.2 6,-0.3 0.844 103.5 58.6 -73.8 -37.0 16.7 6.5 -13.4 82 88 A D H X S+ 0 0 45 -4,-2.2 4,-0.9 -5,-0.2 -1,-0.2 0.887 113.7 41.2 -52.7 -39.1 16.7 9.0 -16.3 83 89 A K H < S+ 0 0 106 -4,-1.3 -2,-0.2 2,-0.2 -1,-0.2 0.893 115.9 47.4 -77.1 -45.8 16.7 5.9 -18.6 84 90 A L H < S+ 0 0 37 -4,-2.7 -2,-0.2 1,-0.2 -3,-0.2 0.934 121.1 36.9 -60.1 -46.8 14.2 3.8 -16.6 85 91 A N H < S- 0 0 37 -4,-2.8 -1,-0.2 2,-0.2 -2,-0.2 0.588 106.2-125.2 -85.4 -15.3 11.7 6.7 -16.3 86 92 A G S < S+ 0 0 65 -4,-0.9 2,-0.3 -5,-0.3 -3,-0.2 0.314 79.8 15.5 92.0 -9.9 12.4 8.1 -19.8 87 93 A S S S- 0 0 54 -6,-0.3 3,-0.5 -5,-0.1 -2,-0.2 -0.930 94.5 -82.3-168.2-174.4 13.2 11.6 -18.7 88 94 A S S > S+ 0 0 73 -2,-0.3 3,-1.4 1,-0.2 4,-0.4 0.345 89.1 112.0 -87.4 4.7 14.2 13.7 -15.6 89 95 A E T >> + 0 0 82 1,-0.2 3,-1.4 2,-0.1 4,-0.6 0.807 64.2 71.5 -42.4 -35.3 10.4 13.9 -14.6 90 96 A W H >> S+ 0 0 0 -3,-0.5 4,-2.4 1,-0.2 3,-1.2 0.802 79.2 67.7 -61.1 -38.0 11.3 11.7 -11.6 91 97 A R H <4 S+ 0 0 132 -3,-1.4 -1,-0.2 1,-0.3 -2,-0.1 0.713 108.1 41.2 -58.8 -19.6 13.3 14.2 -9.4 92 98 A S H <4 S+ 0 0 116 -3,-1.4 -1,-0.3 -4,-0.4 -2,-0.2 0.530 118.6 45.4-102.7 -10.3 10.1 16.3 -8.9 93 99 A R H << S+ 0 0 100 -3,-1.2 -2,-0.2 -4,-0.6 -3,-0.1 0.827 89.2 90.2 -95.0 -43.8 7.7 13.3 -8.3 94 100 A I < - 0 0 23 -4,-2.4 2,-0.3 1,-0.0 -56,-0.0 -0.241 51.3-173.2 -67.6 143.1 9.6 11.0 -6.0 95 101 A T - 0 0 108 0, 0.0 2,-0.2 0, 0.0 -50,-0.1 -0.954 31.3-100.7-129.1 149.5 9.1 11.3 -2.3 96 102 A A - 0 0 33 -2,-0.3 -54,-0.0 1,-0.1 -55,-0.0 -0.458 34.6-127.0 -65.8 132.4 10.9 9.5 0.5 97 103 A S > - 0 0 22 -2,-0.2 4,-2.7 1,-0.1 3,-0.3 -0.364 32.3-102.3 -64.5 162.2 9.0 6.6 2.0 98 104 A P H > S+ 0 0 59 0, 0.0 4,-1.9 0, 0.0 275,-0.2 0.911 125.4 53.1 -55.7 -40.8 8.8 6.8 5.9 99 105 A A H > S+ 0 0 3 101,-0.2 4,-1.7 1,-0.2 102,-0.2 0.853 110.0 47.9 -54.8 -44.1 11.5 4.2 6.1 100 106 A V H > S+ 0 0 0 -3,-0.3 4,-3.3 2,-0.2 5,-0.3 0.870 105.9 57.0 -72.0 -37.0 13.7 6.3 3.9 101 107 A I H X S+ 0 0 59 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.902 109.9 46.1 -57.3 -47.2 13.0 9.5 5.9 102 108 A D H X S+ 0 0 11 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.875 114.4 47.4 -58.5 -44.6 14.3 7.7 9.1 103 109 A Y H X S+ 0 0 0 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.952 113.5 46.5 -65.5 -50.7 17.3 6.4 7.3 104 110 A V H X S+ 0 0 21 -4,-3.3 4,-2.5 1,-0.2 -2,-0.2 0.859 109.6 56.4 -57.5 -39.5 18.2 9.7 5.7 105 111 A N H X S+ 0 0 39 -4,-2.1 4,-1.9 -5,-0.3 -1,-0.2 0.904 108.7 46.2 -64.3 -42.6 17.6 11.4 9.1 106 112 A R H X S+ 0 0 24 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.897 112.3 49.9 -64.4 -40.3 20.2 9.1 10.7 107 113 A L H X S+ 0 0 0 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.864 110.1 51.5 -66.8 -34.7 22.7 9.7 7.8 108 114 A E H X S+ 0 0 45 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.872 108.6 51.0 -68.8 -39.9 22.3 13.5 8.1 109 115 A E H X S+ 0 0 42 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.872 110.4 48.5 -57.5 -44.6 23.0 13.2 11.9 110 116 A I H <>S+ 0 0 3 -4,-2.1 5,-2.3 2,-0.2 4,-0.5 0.903 112.2 50.8 -65.9 -35.6 26.1 11.2 11.1 111 117 A R H ><5S+ 0 0 50 -4,-2.1 3,-0.8 1,-0.2 -2,-0.2 0.941 113.8 42.3 -64.0 -53.1 27.1 13.9 8.5 112 118 A D H 3<5S+ 0 0 46 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.800 118.4 44.4 -71.3 -32.5 26.6 16.8 10.9 113 119 A N T 3<5S- 0 0 48 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.489 101.7-135.6 -81.4 -8.1 28.3 15.1 13.9 114 120 A V T < 5 - 0 0 62 -3,-0.8 2,-1.1 -4,-0.5 -3,-0.2 0.955 33.2-176.0 46.0 54.8 31.1 13.9 11.5 115 121 A D >< - 0 0 34 -5,-2.3 4,-2.5 1,-0.2 -1,-0.2 -0.721 11.0-175.1 -90.3 94.2 30.7 10.6 13.2 116 122 A G H > S+ 0 0 5 -2,-1.1 4,-2.7 2,-0.2 -1,-0.2 0.918 79.2 47.6 -61.0 -54.4 33.5 8.5 11.6 117 123 A P H 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14.4 20.2 216 313 B K H X S+ 0 0 134 -4,-1.7 4,-0.5 -5,-0.2 -2,-0.2 0.943 117.9 41.3 -60.6 -52.4 -3.5 15.9 17.3 217 314 B Q H >< S+ 0 0 141 -4,-2.7 3,-0.7 1,-0.2 4,-0.4 0.886 112.0 52.5 -65.6 -41.1 -6.4 18.0 16.0 218 315 B S H 3< S+ 0 0 54 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.772 119.6 35.5 -73.1 -24.4 -7.6 19.2 19.4 219 316 B T H 3X S+ 0 0 3 -4,-1.5 4,-2.7 -3,-0.2 -1,-0.2 0.339 86.8 103.2-102.1 5.9 -4.1 20.5 20.4 220 317 B A H S+ 0 0 171 -4,-0.4 4,-2.4 1,-0.2 -1,-0.2 0.864 112.8 50.9 -76.3 -34.8 -3.5 25.4 17.7 222 319 B A H > S+ 0 0 21 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.869 107.6 52.9 -64.5 -39.1 -1.8 25.0 21.1 223 320 B H H X S+ 0 0 91 -4,-2.7 4,-3.0 2,-0.2 -2,-0.2 0.905 109.4 50.2 -62.2 -43.0 1.2 23.3 19.5 224 321 B E H X S+ 0 0 109 -4,-1.7 4,-2.4 -5,-0.2 -2,-0.2 0.938 109.1 50.8 -58.2 -47.7 1.4 26.3 17.1 225 322 B K H < S+ 0 0 120 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.892 113.2 46.5 -60.3 -37.8 1.3 28.7 20.1 226 323 B A H >< S+ 0 0 11 -4,-2.2 3,-1.5 2,-0.2 6,-0.2 0.959 111.7 49.8 -67.2 -54.0 4.2 26.6 21.8 227 324 B E H 3< S+ 0 0 100 -4,-3.0 -2,-0.2 1,-0.3 -1,-0.2 0.871 116.9 40.7 -51.6 -46.4 6.3 26.5 18.6 228 325 B H T 3< S+ 0 0 103 -4,-2.4 -1,-0.3 -5,-0.2 -2,-0.2 0.151 81.1 132.6 -99.1 17.8 6.0 30.3 18.0 229 326 B S <> - 0 0 11 -3,-1.5 4,-2.7 -4,-0.1 5,-0.3 -0.348 69.8-115.3 -56.9 146.6 6.4 31.4 21.6 230 327 B T H > S+ 0 0 110 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.936 113.7 47.8 -53.4 -48.1 8.9 34.3 21.9 231 328 B F H > S+ 0 0 12 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.945 115.8 42.1 -58.8 -54.1 11.3 32.2 24.0 232 329 B M H > S+ 0 0 13 -6,-0.2 4,-2.4 1,-0.2 5,-0.2 0.907 114.3 50.5 -68.2 -39.0 11.2 29.1 21.8 233 330 B S H X S+ 0 0 26 -4,-2.7 4,-2.1 1,-0.2 6,-0.2 0.940 113.7 45.7 -56.8 -52.6 11.4 31.0 18.5 234 331 B D H <>S+ 0 0 45 -4,-2.5 5,-2.5 -5,-0.3 6,-0.7 0.899 113.8 49.8 -59.0 -42.7 14.4 33.0 19.7 235 332 B L H ><5S+ 0 0 0 -4,-2.5 3,-1.4 -5,-0.2 5,-0.3 0.974 114.6 42.5 -63.6 -51.4 16.1 29.9 21.1 236 333 B L H 3<5S+ 0 0 30 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.742 110.2 57.1 -68.7 -27.0 15.7 27.8 17.9 237 334 B K T 3<5S- 0 0 127 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.361 117.8-110.5 -82.0 -1.4 16.6 30.8 15.6 238 335 B G T < 5S+ 0 0 26 -3,-1.4 -3,-0.2 -4,-0.3 -2,-0.1 0.673 82.9 124.4 89.0 14.9 20.0 31.1 17.4 239 336 B R < + 0 0 148 -5,-2.5 -4,-0.2 -6,-0.2 -5,-0.1 0.610 69.5 40.2 -86.8 -12.1 19.1 34.4 19.1 240 337 B L S S- 0 0 52 -6,-0.7 2,-0.3 -5,-0.3 -5,-0.1 0.214 85.8-122.7-105.2-128.0 19.8 33.2 22.7 241 338 B G > - 0 0 16 1,-0.1 4,-2.0 -2,-0.0 3,-0.5 -0.959 34.6 -71.7-166.3-178.7 22.6 31.0 23.9 242 339 B V H > S+ 0 0 61 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.852 122.0 62.5 -54.8 -40.9 23.8 27.9 25.7 243 340 B A H > S+ 0 0 52 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.902 105.5 45.2 -54.0 -44.7 22.7 29.4 29.0 244 341 B E H > S+ 0 0 57 -3,-0.5 4,-2.0 1,-0.2 -1,-0.2 0.888 111.8 51.3 -71.6 -41.5 19.0 29.6 27.9 245 342 B F H X S+ 0 0 0 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.925 110.1 50.0 -55.6 -42.8 19.1 26.1 26.5 246 343 B T H X S+ 0 0 13 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.887 107.9 53.5 -67.1 -39.1 20.5 24.8 29.8 247 344 B R H X S+ 0 0 115 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.891 107.8 51.1 -62.4 -36.9 17.8 26.6 31.7 248 345 B L H X S+ 0 0 13 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.944 111.3 47.8 -62.9 -49.2 15.1 24.9 29.5 249 346 B Q H X S+ 0 0 4 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.848 107.5 55.7 -67.5 -30.0 16.7 21.5 30.2 250 347 B E H X S+ 0 0 28 -4,-2.3 4,-1.6 2,-0.2 -1,-0.2 0.930 110.7 44.6 -62.5 -45.4 16.9 22.1 34.0 251 348 B Q H X S+ 0 0 11 -4,-2.0 4,-2.1 1,-0.2 5,-0.2 0.922 111.4 54.5 -69.4 -38.4 13.2 22.8 34.1 252 349 B A H X S+ 0 0 3 -4,-2.3 4,-3.0 1,-0.2 5,-0.4 0.881 104.2 54.7 -57.7 -41.9 12.6 19.7 31.9 253 350 B W H X S+ 0 0 9 -4,-2.4 4,-1.9 1,-0.2 -1,-0.2 0.933 108.5 49.8 -59.4 -43.0 14.5 17.5 34.3 254 351 B L H X S+ 0 0 7 -4,-1.6 4,-1.5 2,-0.2 -2,-0.2 0.916 117.1 37.6 -62.7 -47.3 12.2 18.7 37.1 255 352 B F H X S+ 0 0 4 -4,-2.1 4,-3.1 2,-0.2 -2,-0.2 0.865 114.8 52.5 -78.8 -31.8 8.9 18.0 35.3 256 353 B Y H X S+ 0 0 2 -4,-3.0 4,-2.4 -5,-0.2 27,-0.3 0.859 105.9 56.8 -69.3 -33.2 10.0 14.8 33.5 257 354 B T H X S+ 0 0 11 -4,-1.9 4,-1.6 -5,-0.4 -2,-0.2 0.968 113.1 40.0 -58.1 -50.8 11.1 13.5 37.0 258 355 B A H X S+ 0 0 1 -4,-1.5 4,-1.7 1,-0.2 -2,-0.2 0.903 114.1 54.3 -64.4 -43.9 7.5 14.2 38.2 259 356 B L H X S+ 0 0 0 -4,-3.1 4,-2.7 1,-0.2 -1,-0.2 0.883 108.0 49.0 -52.3 -48.3 6.0 12.9 35.0 260 357 B E H X S+ 0 0 13 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.797 105.8 56.1 -75.1 -26.6 7.8 9.6 35.1 261 358 B Q H X S+ 0 0 33 -4,-1.6 4,-1.9 -5,-0.2 -1,-0.2 0.904 111.2 46.1 -64.3 -36.9 6.8 9.1 38.8 262 359 B A H X S+ 0 0 0 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.891 111.0 51.3 -71.4 -41.4 3.1 9.4 37.5 263 360 B V H X S+ 0 0 2 -4,-2.7 4,-3.0 2,-0.2 5,-0.2 0.935 109.5 51.1 -58.8 -45.0 3.8 7.1 34.6 264 361 B D H X S+ 0 0 74 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.907 111.2 47.7 -60.6 -42.9 5.2 4.5 37.0 265 362 B A H X S+ 0 0 29 -4,-1.9 4,-1.1 2,-0.2 -1,-0.2 0.915 114.3 46.1 -63.1 -44.5 2.2 4.7 39.3 266 363 B V H ><>S+ 0 0 0 -4,-2.3 5,-1.6 1,-0.2 3,-0.7 0.943 111.7 50.9 -70.3 -41.1 -0.3 4.4 36.3 267 364 B R H ><5S+ 0 0 45 -4,-3.0 3,-1.9 1,-0.3 -1,-0.2 0.913 105.3 56.8 -58.2 -43.6 1.6 1.5 34.8 268 365 B A H 3<5S+ 0 0 91 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.780 102.3 56.8 -65.1 -22.2 1.6 -0.3 38.1 269 366 B S T <<5S- 0 0 67 -4,-1.1 -1,-0.3 -3,-0.7 -2,-0.2 0.561 116.1-115.3 -78.3 -12.7 -2.2 -0.0 38.1 270 367 B G T X 5 + 0 0 38 -3,-1.9 3,-0.6 -4,-0.5 2,-0.4 0.524 68.0 140.1 90.1 6.5 -2.4 -1.8 34.7 271 368 B F T 3 > S+ 0 0 11 -2,-0.4 4,-1.5 1,-0.1 3,-0.8 0.796 81.8 164.6 54.2 36.3 -2.3 1.7 29.2 273 370 B E T <4 + 0 0 119 -3,-0.6 3,-0.3 1,-0.3 -1,-0.1 0.864 66.3 51.5 -56.6 -43.0 0.6 -0.6 30.0 274 371 B S T 34 S+ 0 0 81 1,-0.2 -1,-0.3 3,-0.1 3,-0.2 0.814 110.2 50.7 -66.5 -28.8 1.8 -1.2 26.5 275 372 B L T <4 S+ 0 0 3 -3,-0.8 2,-2.2 1,-0.2 -1,-0.2 0.843 94.1 74.7 -72.7 -34.8 1.9 2.6 25.8 276 373 B L < + 0 0 0 -4,-1.5 -1,-0.2 -3,-0.3 -2,-0.1 -0.347 69.8 177.3 -84.5 58.9 3.9 3.4 28.9 277 374 B D > - 0 0 43 -2,-2.2 3,-2.0 -3,-0.2 4,-0.2 -0.487 26.8-148.3 -67.9 117.6 7.1 2.0 27.5 278 375 B P G > S+ 0 0 75 0, 0.0 3,-1.8 0, 0.0 -1,-0.2 0.761 92.4 75.0 -64.7 -15.8 10.0 2.6 30.0 279 376 B A G 3 S+ 0 0 50 1,-0.3 88,-0.2 89,-0.1 90,-0.1 0.713 87.1 63.6 -65.5 -19.9 12.4 3.0 27.1 280 377 B L G < S+ 0 0 1 -3,-2.0 -1,-0.3 86,-0.1 -3,-0.0 0.632 73.1 128.6 -72.6 -17.3 10.8 6.5 26.7 281 378 B N < + 0 0 57 -3,-1.8 4,-0.1 -4,-0.2 -25,-0.0 -0.162 30.1 175.6 -51.3 130.4 12.0 7.7 30.2 282 379 B R > + 0 0 8 -26,-0.1 4,-2.7 2,-0.1 5,-0.2 0.547 53.3 85.9-107.2 -18.4 13.9 11.0 29.9 283 380 B A H > S+ 0 0 7 -27,-0.3 4,-2.0 1,-0.2 5,-0.2 0.918 93.8 42.4 -65.7 -47.6 14.7 12.1 33.4 284 381 B E H > S+ 0 0 114 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.890 115.2 52.5 -65.4 -36.3 18.0 10.2 33.9 285 382 B V H > S+ 0 0 25 1,-0.2 4,-2.3 2,-0.2 78,-0.2 0.916 108.1 50.4 -59.6 -48.8 19.1 11.2 30.4 286 383 B L H X S+ 0 0 0 -4,-2.7 4,-2.4 2,-0.2 -2,-0.2 0.891 107.1 53.6 -57.5 -41.8 18.4 14.8 31.1 287 384 B A H X S+ 0 0 2 -4,-2.0 4,-2.2 -5,-0.2 -2,-0.2 0.924 110.0 49.2 -66.2 -33.8 20.5 14.7 34.3 288 385 B R H X S+ 0 0 142 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.908 110.0 50.2 -67.8 -38.9 23.3 13.3 32.2 289 386 B D H X S+ 0 0 4 -4,-2.3 4,-3.0 1,-0.2 -1,-0.2 0.894 110.3 50.1 -61.5 -42.6 22.9 16.0 29.6 290 387 B L H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 6,-0.3 0.878 106.9 54.3 -66.5 -36.1 23.0 18.6 32.4 291 388 B D H X S+ 0 0 18 -4,-2.2 4,-1.8 2,-0.2 5,-0.4 0.898 112.9 44.8 -63.3 -38.6 26.2 17.0 33.9 292 389 B K H < S+ 0 0 111 -4,-1.9 -2,-0.2 2,-0.2 -1,-0.2 0.910 112.6 49.4 -71.2 -43.7 27.7 17.5 30.4 293 390 B L H < S+ 0 0 40 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.909 122.6 33.5 -60.1 -40.2 26.5 21.0 29.9 294 391 B N H < S- 0 0 47 -4,-2.7 -2,-0.2 2,-0.2 -1,-0.2 0.683 95.8-135.1 -91.4 -20.2 27.8 22.1 33.3 295 392 B G S < S+ 0 0 43 -4,-1.8 2,-0.3 -5,-0.3 -3,-0.2 0.572 81.4 57.4 75.9 6.0 30.9 19.9 33.5 296 393 B S S S- 0 0 7 -5,-0.4 3,-0.4 -6,-0.3 -2,-0.2 -0.967 83.8-119.9-158.1 160.7 29.9 19.0 37.1 297 394 B S S > S+ 0 0 5 -2,-0.3 3,-1.8 1,-0.2 4,-0.1 0.526 88.4 97.5 -80.1 -8.7 27.0 17.5 39.2 298 395 B E G > + 0 0 86 1,-0.3 3,-1.8 2,-0.2 4,-0.3 0.558 54.7 84.2 -69.8 -14.2 26.7 20.7 41.2 299 396 B W G >> S+ 0 0 0 -3,-0.4 4,-2.0 1,-0.2 3,-1.8 0.816 79.0 73.0 -51.2 -26.2 23.8 22.2 39.1 300 397 B R G <4 S+ 0 0 15 -3,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.747 94.5 50.8 -61.7 -26.4 21.7 20.0 41.5 301 398 B S G <4 S+ 0 0 23 -3,-1.8 -1,-0.3 -4,-0.1 -2,-0.2 0.455 115.8 40.5 -86.0 -6.0 22.4 22.5 44.3 302 399 B R T <4 S+ 0 0 135 -3,-1.8 -2,-0.2 -4,-0.3 -3,-0.1 0.690 89.1 101.5-113.2 -30.1 21.3 25.6 42.2 303 400 B I < + 0 0 7 -4,-2.0 2,-0.3 207,-0.1 210,-0.1 -0.123 39.6 171.7 -69.1 140.7 18.2 24.5 40.2 304 401 B T - 0 0 81 208,-0.1 2,-0.1 0, 0.0 207,-0.1 -0.984 37.1-101.5-146.2 147.1 14.7 25.4 41.2 305 402 B A - 0 0 12 -2,-0.3 -54,-0.0 203,-0.2 206,-0.0 -0.442 35.8-127.3 -58.4 128.7 11.2 25.1 39.5 306 403 B S > - 0 0 6 -2,-0.1 4,-2.6 112,-0.1 5,-0.2 -0.253 36.1 -96.1 -62.2 163.5 9.9 28.2 37.9 307 404 B P H > S+ 0 0 67 0, 0.0 4,-1.8 0, 0.0 5,-0.2 0.900 128.1 51.2 -52.0 -42.4 6.4 29.2 38.9 308 405 B A H > S+ 0 0 3 101,-0.2 4,-2.3 1,-0.2 102,-0.2 0.887 110.6 48.4 -61.8 -39.7 4.9 27.5 35.9 309 406 B V H > S+ 0 0 0 2,-0.2 4,-3.6 1,-0.2 5,-0.3 0.860 105.7 58.1 -72.4 -34.6 6.9 24.3 36.6 310 407 B I H X S+ 0 0 81 -4,-2.6 4,-2.3 2,-0.2 -1,-0.2 0.935 111.4 42.1 -52.3 -48.3 5.7 24.4 40.3 311 408 B D H X S+ 0 0 84 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.897 115.7 49.8 -70.8 -38.8 2.1 24.3 38.9 312 409 B Y H X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.948 112.2 46.0 -65.1 -51.0 3.0 21.7 36.4 313 410 B V H X S+ 0 0 11 -4,-3.6 4,-2.6 1,-0.2 -2,-0.2 0.899 109.3 56.8 -60.0 -40.5 4.7 19.4 38.9 314 411 B N H X S+ 0 0 94 -4,-2.3 4,-1.9 -5,-0.3 -1,-0.2 0.924 109.1 46.4 -54.6 -45.7 1.8 19.9 41.3 315 412 B R H X S+ 0 0 40 -4,-2.0 4,-2.6 1,-0.2 -2,-0.2 0.923 111.3 50.4 -67.1 -43.1 -0.6 18.6 38.6 316 413 B L H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.885 110.6 50.7 -64.5 -36.0 1.6 15.6 37.8 317 414 B E H X S+ 0 0 14 -4,-2.6 4,-2.6 2,-0.2 -1,-0.2 0.851 108.0 51.7 -69.8 -32.2 1.8 14.7 41.4 318 415 B E H X S+ 0 0 95 -4,-1.9 4,-2.9 2,-0.2 -2,-0.2 0.920 108.8 51.4 -67.8 -40.6 -1.9 14.9 41.7 319 416 B I H X>S+ 0 0 0 -4,-2.6 5,-2.1 1,-0.2 4,-0.9 0.916 112.5 47.8 -61.3 -42.7 -2.2 12.5 38.7 320 417 B R H <5S+ 0 0 39 -4,-2.1 3,-0.5 3,-0.2 -2,-0.2 0.937 113.7 44.5 -57.9 -52.9 0.2 10.2 40.5 321 418 B D H <5S+ 0 0 107 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.853 120.4 40.8 -67.3 -37.8 -1.6 10.3 43.8 322 419 B N H <5S- 0 0 104 -4,-2.9 -1,-0.3 -5,-0.2 -2,-0.2 0.563 102.3-133.9 -83.9 -8.6 -4.9 9.8 42.3 323 420 B V T <5 - 0 0 64 -4,-0.9 2,-1.4 -3,-0.5 -3,-0.2 0.940 32.9-177.5 47.5 59.5 -3.7 7.3 39.8 324 421 B D >< - 0 0 27 -5,-2.1 4,-2.4 1,-0.2 -1,-0.2 -0.652 7.5-176.9 -92.3 91.3 -5.5 9.1 37.1 325 422 B G H > S+ 0 0 6 -2,-1.4 4,-2.4 1,-0.2 -1,-0.2 0.926 77.5 47.0 -59.0 -54.3 -4.8 6.9 34.1 326 423 B P H > S+ 0 0 9 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.919 113.7 49.7 -55.5 -46.6 -6.5 8.9 31.3 327 424 B A H > S+ 0 0 0 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.915 109.4 51.6 -56.7 -44.0 -4.9 12.2 32.5 328 425 B L H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.915 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