==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 28-OCT-02 1J02 . COMPND 2 MOLECULE: HEME OXYGENASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS; . AUTHOR M.SUGISHIMA,K.FUKUYAMA . 212 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10390.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 160 75.5 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 . 3 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 24 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 126 59.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 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 1 0 0 0 1 0 0 0 3 1 0 0 1 1 0 0 0 0 0 0 1 0 0 0 0 1 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 11 A Q 0 0 136 0, 0.0 5,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 124.5 -81.0 -0.8 -72.4 2 12 A D > - 0 0 85 1,-0.1 4,-2.3 4,-0.0 3,-0.3 -0.251 360.0-120.2 -60.1 147.5 -84.2 0.4 -74.2 3 13 A L H > S+ 0 0 3 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.889 111.9 57.4 -56.1 -42.5 -87.2 -2.0 -74.1 4 14 A S H > S+ 0 0 15 169,-0.3 4,-1.9 1,-0.2 -1,-0.2 0.907 110.9 42.1 -57.5 -43.2 -87.3 -2.2 -77.9 5 15 A E H > S+ 0 0 110 -3,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.873 112.5 54.4 -72.0 -35.8 -83.7 -3.4 -78.1 6 16 A A H X S+ 0 0 5 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.891 110.2 47.4 -64.5 -39.1 -84.2 -5.8 -75.2 7 17 A L H X S+ 0 0 0 -4,-2.7 4,-2.0 2,-0.2 -2,-0.2 0.913 111.9 47.9 -69.5 -43.7 -87.1 -7.4 -77.0 8 18 A K H X S+ 0 0 140 -4,-1.9 4,-1.0 -5,-0.2 -2,-0.2 0.929 115.7 46.1 -62.6 -42.3 -85.3 -7.7 -80.3 9 19 A E H < S+ 0 0 95 -4,-2.4 3,-0.4 1,-0.2 4,-0.4 0.909 113.1 49.4 -65.6 -43.8 -82.3 -9.2 -78.5 10 20 A A H < S+ 0 0 22 -4,-2.4 4,-0.3 1,-0.2 -1,-0.2 0.807 119.7 35.4 -67.5 -31.0 -84.5 -11.6 -76.4 11 21 A T H X S+ 0 0 4 -4,-2.0 4,-2.1 1,-0.1 -1,-0.2 0.408 87.1 95.4-106.3 3.1 -86.5 -12.9 -79.3 12 22 A K H X S+ 0 0 102 -4,-1.0 4,-1.2 -3,-0.4 -1,-0.1 0.859 89.1 45.8 -63.7 -33.4 -84.0 -13.0 -82.1 13 23 A E H > S+ 0 0 128 -4,-0.4 4,-1.6 2,-0.2 3,-0.4 0.955 115.4 43.9 -74.7 -49.6 -83.1 -16.7 -81.5 14 24 A V H > S+ 0 0 8 -4,-0.3 4,-2.5 1,-0.2 -2,-0.2 0.795 107.6 61.5 -66.4 -26.0 -86.7 -18.0 -81.2 15 25 A H H X S+ 0 0 78 -4,-2.1 4,-2.9 2,-0.2 -1,-0.2 0.910 102.1 52.0 -65.8 -38.5 -87.7 -15.9 -84.2 16 26 A I H X S+ 0 0 97 -4,-1.2 4,-0.9 -3,-0.4 -2,-0.2 0.927 111.2 46.7 -61.5 -44.0 -85.2 -17.9 -86.3 17 27 A R H < S+ 0 0 146 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.886 113.3 50.1 -65.6 -37.4 -86.9 -21.1 -85.0 18 28 A A H >< S+ 0 0 10 -4,-2.5 3,-1.6 1,-0.2 6,-0.2 0.928 109.4 47.9 -67.4 -46.9 -90.3 -19.7 -85.7 19 29 A E H 3< S+ 0 0 74 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.679 112.2 52.8 -70.4 -14.1 -89.6 -18.6 -89.3 20 30 A N T 3< S+ 0 0 82 -4,-0.9 -1,-0.3 -5,-0.2 -2,-0.2 0.197 78.3 129.4-105.3 15.4 -88.1 -22.0 -89.9 21 31 A S S <> S- 0 0 12 -3,-1.6 4,-3.3 1,-0.1 5,-0.2 -0.336 73.2-110.4 -65.7 153.0 -91.1 -24.0 -88.7 22 32 A E H > S+ 0 0 100 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.895 117.7 48.5 -53.8 -44.9 -92.2 -26.6 -91.2 23 33 A F H > S+ 0 0 13 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.934 117.1 41.4 -62.9 -46.5 -95.5 -24.8 -92.0 24 34 A M H > S+ 0 0 19 -6,-0.2 4,-3.0 2,-0.2 -2,-0.2 0.852 111.5 56.6 -68.6 -35.4 -93.7 -21.5 -92.5 25 35 A R H X S+ 0 0 103 -4,-3.3 4,-1.0 2,-0.2 -2,-0.2 0.921 112.2 42.2 -61.5 -43.9 -90.9 -23.2 -94.4 26 36 A N H X>S+ 0 0 32 -4,-2.4 5,-2.4 -5,-0.2 4,-0.6 0.913 112.6 53.6 -68.0 -44.3 -93.5 -24.6 -96.8 27 37 A F H ><5S+ 0 0 5 -4,-2.5 3,-1.4 1,-0.3 -2,-0.2 0.926 108.8 49.7 -55.9 -46.6 -95.4 -21.4 -96.9 28 38 A Q H 3<5S+ 0 0 89 -4,-3.0 -1,-0.3 1,-0.3 -2,-0.2 0.744 104.6 58.0 -65.6 -25.0 -92.1 -19.6 -97.9 29 39 A K H 3<5S- 0 0 136 -4,-1.0 -1,-0.3 -3,-0.5 -2,-0.2 0.565 123.5-106.4 -80.5 -8.9 -91.4 -22.2 -100.6 30 40 A G T <<5S+ 0 0 32 -3,-1.4 2,-1.4 -4,-0.6 -3,-0.2 0.432 83.2 132.5 95.4 1.5 -94.8 -21.2 -102.1 31 41 A Q < + 0 0 124 -5,-2.4 2,-0.3 -6,-0.2 -1,-0.2 -0.655 27.6 123.2 -89.9 83.1 -96.2 -24.5 -100.9 32 42 A V - 0 0 19 -2,-1.4 2,-0.2 -5,-0.1 -9,-0.0 -0.988 38.7-165.0-143.6 130.6 -99.4 -23.2 -99.3 33 43 A S > - 0 0 81 -2,-0.3 4,-3.2 1,-0.1 5,-0.3 -0.744 36.1-103.7-116.3 165.1 -102.9 -24.4 -100.2 34 44 A R H > S+ 0 0 168 -2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.879 119.1 53.5 -52.3 -43.6 -106.5 -23.2 -99.5 35 45 A E H > S+ 0 0 129 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.943 114.7 39.0 -59.0 -50.7 -107.0 -25.8 -96.8 36 46 A G H > S+ 0 0 5 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.908 115.5 52.3 -67.4 -42.3 -103.9 -24.9 -94.9 37 47 A F H X S+ 0 0 0 -4,-3.2 4,-2.5 1,-0.2 5,-0.2 0.902 108.3 51.1 -61.8 -41.3 -104.3 -21.2 -95.4 38 48 A K H X S+ 0 0 52 -4,-2.6 4,-2.2 -5,-0.3 -1,-0.2 0.889 108.6 53.1 -63.3 -38.7 -107.9 -21.2 -94.1 39 49 A L H X S+ 0 0 30 -4,-1.6 4,-1.7 -5,-0.2 -2,-0.2 0.918 112.2 43.0 -63.4 -44.8 -106.8 -23.1 -91.0 40 50 A V H X S+ 0 0 7 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.924 114.8 48.3 -71.1 -42.2 -104.1 -20.6 -90.1 41 51 A M H X S+ 0 0 2 -4,-2.5 4,-2.0 2,-0.2 -1,-0.2 0.870 111.0 51.2 -66.3 -34.7 -106.2 -17.5 -90.8 42 52 A A H X S+ 0 0 0 -4,-2.2 4,-1.5 -5,-0.2 -1,-0.2 0.892 110.8 49.7 -66.9 -38.2 -109.2 -18.9 -88.8 43 53 A S H X S+ 0 0 0 -4,-1.7 4,-2.2 1,-0.2 -2,-0.2 0.908 109.8 50.3 -66.5 -40.9 -106.8 -19.5 -86.0 44 54 A L H X S+ 0 0 8 -4,-2.4 4,-3.1 1,-0.2 5,-0.4 0.848 102.7 61.8 -66.1 -33.3 -105.5 -15.9 -86.2 45 55 A Y H X S+ 0 0 30 -4,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.949 108.6 42.0 -56.0 -47.9 -109.0 -14.7 -86.2 46 56 A H H X S+ 0 0 33 -4,-1.5 4,-2.1 2,-0.2 -2,-0.2 0.909 115.6 49.7 -64.5 -44.3 -109.4 -16.2 -82.7 47 57 A I H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.931 114.2 42.4 -62.7 -49.7 -106.0 -15.0 -81.5 48 58 A Y H X S+ 0 0 0 -4,-3.1 4,-2.9 2,-0.2 5,-0.2 0.847 110.3 58.1 -69.3 -30.9 -106.4 -11.4 -82.6 49 59 A T H X S+ 0 0 14 -4,-1.9 4,-1.5 -5,-0.4 -1,-0.2 0.954 112.2 40.9 -61.6 -46.2 -110.0 -11.3 -81.3 50 60 A A H X S+ 0 0 2 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.926 115.4 50.5 -66.0 -46.4 -108.6 -12.2 -77.9 51 61 A L H X S+ 0 0 0 -4,-2.6 4,-1.7 1,-0.2 -2,-0.2 0.934 113.5 44.8 -57.6 -48.1 -105.6 -9.9 -78.1 52 62 A E H X S+ 0 0 11 -4,-2.9 4,-2.2 2,-0.2 -1,-0.2 0.760 107.9 57.4 -71.3 -24.1 -107.7 -6.9 -79.1 53 63 A E H X S+ 0 0 82 -4,-1.5 4,-2.0 -5,-0.2 -1,-0.2 0.908 111.1 44.2 -69.7 -40.4 -110.4 -7.6 -76.5 54 64 A E H X S+ 0 0 2 -4,-2.0 4,-1.5 2,-0.2 -2,-0.2 0.800 110.0 55.3 -73.3 -30.4 -107.6 -7.4 -73.9 55 65 A I H < S+ 0 0 0 -4,-1.7 4,-0.4 2,-0.2 -2,-0.2 0.939 109.5 47.0 -67.2 -44.2 -106.2 -4.3 -75.6 56 66 A E H >< S+ 0 0 74 -4,-2.2 3,-1.1 1,-0.2 4,-0.3 0.912 109.3 54.3 -62.3 -41.6 -109.6 -2.6 -75.3 57 67 A R H 3< S+ 0 0 151 -4,-2.0 -1,-0.2 1,-0.2 3,-0.2 0.843 120.6 32.5 -60.1 -33.5 -109.9 -3.7 -71.7 58 68 A N T >< S+ 0 0 13 -4,-1.5 3,-1.7 -3,-0.2 7,-0.4 0.182 80.0 116.1-110.3 15.8 -106.5 -2.0 -71.0 59 69 A K T < S+ 0 0 89 -3,-1.1 9,-0.2 -4,-0.4 -1,-0.1 0.829 84.7 42.0 -55.6 -33.8 -106.5 0.9 -73.4 60 70 A Q T 3 S+ 0 0 169 -4,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.398 88.8 109.7 -93.8 1.3 -106.4 3.4 -70.5 61 71 A N X> - 0 0 48 -3,-1.7 4,-3.3 1,-0.1 3,-2.7 -0.693 68.3-139.2 -83.1 121.8 -103.9 1.5 -68.5 62 72 A P T 34 S+ 0 0 99 0, 0.0 118,-0.3 0, 0.0 -1,-0.1 0.710 99.2 67.1 -50.0 -26.8 -100.5 3.3 -68.4 63 73 A V T 34 S+ 0 0 50 1,-0.1 57,-0.3 116,-0.1 116,-0.1 0.573 124.3 10.2 -75.3 -6.8 -98.6 0.0 -68.8 64 74 A Y T X4 S+ 0 0 2 -3,-2.7 3,-3.2 -6,-0.2 4,-0.1 0.578 99.4 95.8-135.6 -38.1 -100.1 -0.3 -72.3 65 75 A A G >< S+ 0 0 33 -4,-3.3 3,-2.4 -7,-0.4 -2,-0.1 0.688 76.6 64.4 -31.7 -46.5 -101.8 3.0 -73.4 66 76 A P G 3 S+ 0 0 46 0, 0.0 -1,-0.3 0, 0.0 110,-0.1 0.744 105.0 49.4 -57.6 -19.4 -98.8 4.5 -75.3 67 77 A L G < S+ 0 0 0 -3,-3.2 2,-1.2 108,-0.1 -2,-0.2 0.224 75.6 126.6-103.5 13.7 -99.2 1.5 -77.7 68 78 A Y < + 0 0 72 -3,-2.4 -3,-0.0 -9,-0.2 -4,-0.0 -0.606 21.7 150.2 -77.4 97.6 -102.9 1.9 -78.3 69 79 A F >> + 0 0 23 -2,-1.2 4,-2.8 1,-0.1 5,-0.7 -0.509 1.6 154.4-126.9 63.0 -103.1 2.0 -82.1 70 80 A P H >5S+ 0 0 43 0, 0.0 4,-0.7 0, 0.0 -1,-0.1 0.916 74.2 49.7 -59.2 -44.4 -106.5 0.5 -83.1 71 81 A E H 45S+ 0 0 142 1,-0.2 90,-0.2 2,-0.1 -2,-0.1 0.899 120.4 35.5 -61.4 -42.9 -106.9 2.4 -86.4 72 82 A E H 45S+ 0 0 45 89,-0.1 89,-0.3 88,-0.1 -1,-0.2 0.897 132.7 17.4 -79.3 -42.7 -103.4 1.5 -87.6 73 83 A L H <5S+ 0 0 2 -4,-2.8 -2,-0.1 88,-0.1 -1,-0.1 0.835 80.6 113.7-105.5 -37.7 -102.9 -2.0 -86.2 74 84 A H << - 0 0 30 -5,-0.7 4,-0.2 -4,-0.7 -26,-0.0 -0.094 35.3-174.2 -49.3 133.0 -106.0 -3.9 -85.1 75 85 A R > + 0 0 12 2,-0.1 4,-2.9 -27,-0.1 5,-0.2 0.519 56.4 95.3-106.0 -13.1 -106.8 -6.9 -87.3 76 86 A R H > S+ 0 0 79 -28,-0.2 4,-2.1 1,-0.2 5,-0.2 0.917 89.5 46.2 -46.3 -55.7 -110.1 -8.2 -86.0 77 87 A A H > S+ 0 0 67 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.924 113.9 48.5 -56.7 -46.9 -112.2 -6.3 -88.7 78 88 A A H > S+ 0 0 15 -4,-0.2 4,-2.1 1,-0.2 78,-0.3 0.904 110.5 51.4 -61.1 -42.5 -109.9 -7.4 -91.5 79 89 A L H X S+ 0 0 0 -4,-2.9 4,-2.6 1,-0.2 -1,-0.2 0.837 105.1 56.0 -65.9 -33.0 -110.0 -11.0 -90.3 80 90 A E H X S+ 0 0 63 -4,-2.1 4,-1.9 -5,-0.2 -1,-0.2 0.900 108.2 48.8 -64.9 -38.5 -113.8 -11.0 -90.3 81 91 A Q H X S+ 0 0 134 -4,-1.6 4,-1.7 1,-0.2 -2,-0.2 0.906 112.6 47.7 -65.9 -42.0 -113.7 -9.9 -93.9 82 92 A D H X S+ 0 0 1 -4,-2.1 4,-2.8 2,-0.2 5,-0.3 0.869 109.2 53.5 -67.6 -36.7 -111.2 -12.7 -94.7 83 93 A M H X S+ 0 0 0 -4,-2.6 4,-3.0 1,-0.2 5,-0.5 0.898 108.8 48.7 -65.7 -38.8 -113.3 -15.3 -92.9 84 94 A A H X S+ 0 0 40 -4,-1.9 4,-1.2 3,-0.2 -1,-0.2 0.875 113.1 49.8 -67.0 -35.7 -116.4 -14.3 -94.9 85 95 A F H < S+ 0 0 95 -4,-1.7 -2,-0.2 2,-0.2 -1,-0.2 0.941 122.0 30.1 -67.2 -49.9 -114.3 -14.6 -98.0 86 96 A W H < S+ 0 0 35 -4,-2.8 -2,-0.2 1,-0.1 -3,-0.2 0.858 134.2 27.8 -81.4 -36.3 -112.8 -18.0 -97.3 87 97 A Y H < S- 0 0 43 -4,-3.0 3,-0.3 -5,-0.3 -3,-0.2 0.505 104.1-127.8-105.3 -7.4 -115.6 -19.6 -95.2 88 98 A G >< - 0 0 20 -4,-1.2 3,-1.2 -5,-0.5 -1,-0.3 -0.303 48.2 -38.3 93.0-177.5 -118.7 -17.8 -96.6 89 99 A P T 3 S+ 0 0 109 0, 0.0 3,-0.3 0, 0.0 -1,-0.2 0.795 136.7 45.3 -54.9 -36.4 -121.6 -15.9 -95.1 90 100 A H T > + 0 0 126 -3,-0.3 3,-0.8 1,-0.2 4,-0.1 -0.238 68.0 134.2-106.1 44.8 -121.9 -18.3 -92.1 91 101 A W G X> + 0 0 31 -3,-1.2 4,-2.4 1,-0.2 3,-1.7 0.782 58.0 78.1 -62.3 -26.3 -118.2 -18.5 -91.3 92 102 A Q G 34 S+ 0 0 109 -3,-0.3 -1,-0.2 1,-0.3 -2,-0.1 0.896 104.8 30.0 -50.2 -48.6 -119.1 -18.0 -87.6 93 103 A E G <4 S+ 0 0 137 -3,-0.8 -1,-0.3 1,-0.1 -2,-0.2 0.182 120.4 56.1 -99.9 19.1 -120.2 -21.6 -87.2 94 104 A A T <4 S+ 0 0 58 -3,-1.7 -2,-0.2 -4,-0.1 -3,-0.1 0.663 80.8 95.3-116.9 -30.1 -117.9 -23.0 -89.8 95 105 A I S < S- 0 0 24 -4,-2.4 2,-0.1 1,-0.1 -56,-0.1 -0.341 72.0-119.7 -70.1 144.9 -114.4 -21.9 -88.6 96 106 A P - 0 0 37 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.411 13.5-159.6 -80.7 157.2 -112.2 -24.2 -86.5 97 107 A Y - 0 0 103 -2,-0.1 5,-0.1 -51,-0.0 -54,-0.0 -0.753 22.8-158.9-137.1 82.6 -110.9 -23.4 -83.0 98 108 A T > - 0 0 9 -2,-0.3 4,-2.6 -59,-0.2 3,-0.2 -0.174 26.9-112.5 -66.2 156.7 -107.9 -25.7 -82.5 99 109 A P H > S+ 0 0 89 0, 0.0 4,-2.1 0, 0.0 5,-0.1 0.888 118.9 49.9 -55.1 -43.5 -106.5 -26.7 -79.1 100 110 A A H > S+ 0 0 17 2,-0.2 4,-1.8 1,-0.2 103,-0.2 0.845 110.8 50.6 -66.1 -33.3 -103.2 -24.8 -79.8 101 111 A T H > S+ 0 0 0 -3,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.902 109.7 50.4 -69.6 -40.7 -105.3 -21.8 -80.8 102 112 A Q H X S+ 0 0 89 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.866 108.6 52.8 -64.2 -35.9 -107.3 -22.1 -77.5 103 113 A H H X S+ 0 0 95 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.903 109.8 47.7 -65.7 -42.8 -104.1 -22.3 -75.5 104 114 A Y H X S+ 0 0 1 -4,-1.8 4,-2.2 1,-0.2 -2,-0.2 0.944 112.7 48.8 -62.7 -49.4 -102.8 -19.1 -77.1 105 115 A V H X S+ 0 0 12 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.875 107.8 56.3 -58.7 -39.2 -106.1 -17.4 -76.4 106 116 A K H X S+ 0 0 118 -4,-2.2 4,-1.8 1,-0.2 -1,-0.2 0.934 108.3 45.9 -60.4 -47.2 -106.0 -18.6 -72.8 107 117 A R H X S+ 0 0 54 -4,-2.0 4,-2.7 1,-0.2 5,-0.2 0.894 109.1 56.6 -65.0 -37.8 -102.7 -17.0 -72.2 108 118 A L H X S+ 0 0 1 -4,-2.2 4,-2.8 1,-0.2 -1,-0.2 0.912 109.3 45.1 -60.2 -42.1 -103.8 -13.8 -73.8 109 119 A H H X S+ 0 0 63 -4,-2.2 4,-2.3 2,-0.2 5,-0.3 0.842 111.2 53.5 -71.2 -31.1 -106.8 -13.5 -71.5 110 120 A E H X>S+ 0 0 68 -4,-1.8 4,-2.7 -5,-0.2 5,-1.1 0.942 113.7 43.0 -66.5 -45.9 -104.5 -14.3 -68.5 111 121 A V H X5S+ 0 0 0 -4,-2.7 4,-0.8 3,-0.2 7,-0.3 0.953 116.4 46.6 -63.8 -51.3 -102.1 -11.5 -69.4 112 122 A G H <5S+ 0 0 1 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.858 123.2 33.2 -61.5 -37.8 -104.9 -9.0 -70.2 113 123 A G H <5S+ 0 0 50 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.819 136.8 16.4 -90.2 -30.1 -106.9 -9.7 -67.1 114 124 A T H <5S+ 0 0 100 -4,-2.7 -3,-0.2 -5,-0.3 -2,-0.1 0.753 133.2 29.6-113.2 -35.1 -104.1 -10.5 -64.6 115 125 A H ><< + 0 0 59 -5,-1.1 3,-2.6 -4,-0.8 4,-0.3 -0.402 62.2 157.8-126.1 57.1 -100.8 -9.3 -65.9 116 126 A P G > + 0 0 22 0, 0.0 3,-1.5 0, 0.0 4,-0.4 0.723 67.6 71.7 -54.5 -23.8 -101.5 -6.3 -68.1 117 127 A E G 3 S+ 0 0 44 1,-0.3 3,-0.2 2,-0.1 4,-0.1 0.676 98.6 51.4 -66.9 -13.6 -98.0 -5.0 -67.8 118 128 A L G X> S+ 0 0 6 -3,-2.6 3,-1.2 -7,-0.3 4,-0.8 0.473 80.4 93.7 -99.5 -4.0 -97.0 -7.9 -70.1 119 129 A L H X> S+ 0 0 0 -3,-1.5 4,-1.9 -4,-0.3 3,-1.0 0.868 75.0 66.4 -57.3 -37.8 -99.6 -7.2 -72.8 120 130 A V H 3> S+ 0 0 1 -4,-0.4 4,-2.8 -57,-0.3 -1,-0.3 0.843 93.5 61.0 -52.0 -35.3 -97.0 -5.2 -74.7 121 131 A A H <> S+ 0 0 0 -3,-1.2 4,-2.0 1,-0.2 -1,-0.3 0.887 107.5 43.7 -60.4 -39.3 -95.1 -8.4 -75.3 122 132 A H H S+ 0 0 0 -4,-1.9 4,-2.1 2,-0.2 5,-0.6 0.918 113.3 50.8 -70.4 -42.5 -98.8 -6.9 -79.2 124 134 A Y H X>S+ 0 0 25 -4,-2.8 4,-1.4 -5,-0.2 5,-0.5 0.946 110.0 49.0 -56.6 -52.9 -95.2 -6.5 -80.1 125 135 A T H <5S+ 0 0 11 -4,-2.0 4,-0.4 -5,-0.2 -1,-0.2 0.887 121.8 32.1 -57.5 -45.1 -94.8 -10.2 -81.2 126 136 A R H X5S+ 0 0 29 -4,-1.8 4,-2.2 3,-0.1 -2,-0.2 0.977 121.8 41.2 -81.0 -58.4 -97.9 -10.2 -83.4 127 137 A Y H X5S+ 0 0 1 -4,-2.1 4,-1.5 -5,-0.3 -3,-0.2 0.886 114.6 48.3 -60.4 -45.0 -98.2 -6.6 -84.9 128 138 A L H <4XS+ 0 0 31 -5,-0.5 5,-2.4 -4,-0.4 3,-1.9 0.911 105.4 55.3 -70.8 -41.1 -94.3 -9.3 -87.3 130 140 A D H 3<5S+ 0 0 5 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.835 108.4 49.7 -59.0 -32.7 -97.3 -8.6 -89.4 131 141 A L T 3<5S+ 0 0 4 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.396 123.6 29.8 -87.3 2.9 -95.5 -5.4 -90.6 132 142 A S T X>5S+ 0 0 46 -3,-1.9 3,-1.4 -5,-0.1 4,-0.8 0.433 133.1 9.2-122.3 -98.1 -92.4 -7.4 -91.4 133 143 A G H >>5S+ 0 0 39 1,-0.3 4,-2.5 2,-0.2 3,-0.9 0.841 120.0 69.0 -59.1 -33.7 -92.4 -11.0 -92.5 134 144 A G H 3> S+ 0 0 61 -3,-1.4 4,-1.3 -6,-0.4 -1,-0.3 0.818 107.4 47.8 -73.5 -30.1 -95.7 -8.6 -95.8 136 146 A V H S+ 0 0 49 -4,-2.2 5,-1.6 -5,-0.2 4,-0.8 0.922 114.8 41.8 -58.8 -46.4 -101.1 -14.0 -103.7 143 153 A K H <5S+ 0 0 186 -4,-1.8 3,-0.3 3,-0.2 -2,-0.2 0.936 117.0 46.6 -67.6 -48.8 -98.9 -15.8 -106.2 144 154 A A H <5S+ 0 0 46 -4,-2.7 -2,-0.2 1,-0.2 -3,-0.2 0.920 124.7 28.3 -62.1 -48.8 -99.5 -19.3 -104.8 145 155 A M H <5S- 0 0 37 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.346 105.6-115.2 -99.6 7.0 -103.3 -19.2 -104.5 146 156 A A T <5 + 0 0 85 -4,-0.8 -3,-0.2 -3,-0.3 -4,-0.2 0.941 49.3 173.9 60.8 50.1 -104.0 -16.6 -107.3 147 157 A L < - 0 0 16 -5,-1.6 -1,-0.2 -6,-0.3 6,-0.1 -0.747 33.5-106.4 -90.9 137.8 -105.4 -14.0 -105.0 148 158 A P > - 0 0 51 0, 0.0 3,-1.9 0, 0.0 -1,-0.1 -0.217 13.9-124.9 -63.3 147.9 -106.3 -10.6 -106.6 149 159 A S T 3 S+ 0 0 116 1,-0.3 -2,-0.0 2,-0.1 -7,-0.0 0.720 105.2 79.4 -63.7 -19.7 -104.2 -7.5 -106.2 150 160 A S T 3 S- 0 0 91 1,-0.1 -1,-0.3 2,-0.0 -3,-0.0 0.629 108.8-117.7 -64.8 -14.0 -107.4 -5.9 -105.0 151 161 A G X + 0 0 14 -3,-1.9 3,-2.4 1,-0.3 6,-0.1 0.273 56.7 153.1 100.2 -14.0 -106.9 -7.5 -101.6 152 162 A E T 3 S+ 0 0 98 1,-0.3 -1,-0.3 2,-0.2 -70,-0.1 -0.267 75.8 15.3 -54.0 134.6 -109.9 -9.9 -101.2 153 163 A G T 3 S+ 0 0 2 -72,-0.1 -1,-0.3 -6,-0.1 3,-0.1 0.266 120.9 67.0 85.2 -11.0 -108.9 -12.8 -98.9 154 164 A L X + 0 0 0 -3,-2.4 3,-1.0 1,-0.1 4,-0.3 -0.020 52.6 124.7-130.0 28.3 -105.8 -11.0 -97.6 155 165 A A G > S+ 0 0 25 -77,-0.3 3,-1.8 1,-0.3 -76,-0.2 0.855 70.1 65.4 -56.8 -35.6 -107.3 -8.1 -95.7 156 166 A F G 3 S+ 0 0 1 -78,-0.3 -1,-0.3 1,-0.3 -77,-0.1 0.860 102.2 47.0 -55.1 -38.3 -105.3 -9.3 -92.6 157 167 A F G < S+ 0 0 11 -3,-1.0 2,-0.5 -6,-0.1 -1,-0.3 0.396 98.2 88.5 -86.8 3.1 -102.0 -8.5 -94.4 158 168 A T < - 0 0 44 -3,-1.8 3,-0.1 -4,-0.3 -80,-0.1 -0.896 52.0-172.2-109.5 129.4 -103.2 -5.1 -95.5 159 169 A F > + 0 0 16 -2,-0.5 3,-1.8 3,-0.2 -3,-0.1 -0.753 7.1 175.1-119.9 82.9 -102.8 -2.0 -93.4 160 170 A P T 3 S+ 0 0 108 0, 0.0 -1,-0.1 0, 0.0 -88,-0.1 0.620 80.4 54.8 -61.9 -14.8 -104.7 0.9 -95.2 161 171 A S T 3 S+ 0 0 51 -89,-0.3 2,-0.5 -90,-0.2 -89,-0.1 0.374 96.2 72.6-101.2 3.0 -103.9 3.2 -92.3 162 172 A I < - 0 0 16 -3,-1.8 -3,-0.2 1,-0.1 -1,-0.1 -0.941 54.8-177.2-121.3 107.7 -100.2 2.8 -92.4 163 173 A D S S+ 0 0 165 -2,-0.5 -1,-0.1 1,-0.3 -4,-0.0 0.899 80.9 23.7 -69.8 -41.5 -98.5 4.4 -95.3 164 174 A N > - 0 0 84 1,-0.1 4,-2.6 2,-0.0 3,-0.4 -0.856 61.8-167.3-132.9 99.1 -95.0 3.2 -94.5 165 175 A P H > S+ 0 0 38 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.838 91.7 55.3 -50.1 -38.9 -94.6 0.0 -92.3 166 176 A T H > S+ 0 0 80 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.920 110.7 43.2 -63.2 -45.3 -90.9 0.7 -91.8 167 177 A K H > S+ 0 0 45 -3,-0.4 4,-2.0 1,-0.2 -1,-0.2 0.895 113.6 52.0 -68.5 -40.3 -91.5 4.2 -90.4 168 178 A F H X S+ 0 0 19 -4,-2.6 4,-2.9 1,-0.2 -2,-0.2 0.886 106.4 53.3 -64.6 -38.9 -94.5 3.0 -88.3 169 179 A K H X S+ 0 0 28 -4,-2.4 4,-2.7 -5,-0.2 -1,-0.2 0.897 108.3 50.7 -63.5 -37.3 -92.4 0.3 -86.7 170 180 A Q H X S+ 0 0 120 -4,-1.5 4,-2.2 2,-0.2 -1,-0.2 0.904 111.4 48.3 -64.8 -40.0 -89.7 2.8 -85.8 171 181 A L H X S+ 0 0 68 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.931 112.4 48.9 -64.7 -44.8 -92.5 5.0 -84.2 172 182 A Y H X S+ 0 0 0 -4,-2.9 4,-2.3 2,-0.2 -2,-0.2 0.904 110.4 49.9 -63.1 -43.8 -93.8 1.9 -82.3 173 183 A R H X S+ 0 0 81 -4,-2.7 4,-1.3 1,-0.2 -169,-0.3 0.925 110.9 50.2 -61.4 -44.2 -90.4 0.9 -81.0 174 184 A A H < S+ 0 0 51 -4,-2.2 3,-0.3 1,-0.2 -2,-0.2 0.920 110.4 50.3 -59.8 -42.9 -89.8 4.5 -79.8 175 185 A R H >< S+ 0 0 103 -4,-2.4 3,-1.9 1,-0.2 4,-0.4 0.877 104.2 56.6 -65.9 -37.3 -93.2 4.5 -78.1 176 186 A M H >< S+ 0 0 0 -4,-2.3 3,-1.1 1,-0.3 -1,-0.2 0.847 101.7 60.2 -61.0 -30.5 -92.5 1.1 -76.3 177 187 A N T 3< S+ 0 0 51 -4,-1.3 -1,-0.3 -3,-0.3 -2,-0.2 0.520 95.9 60.6 -75.9 -4.4 -89.4 2.9 -74.9 178 188 A T T < S+ 0 0 92 -3,-1.9 -1,-0.2 -4,-0.2 -2,-0.2 0.533 79.8 110.9 -97.2 -9.4 -91.5 5.5 -73.2 179 189 A L S < S- 0 0 13 -3,-1.1 2,-0.3 -4,-0.4 -176,-0.1 -0.323 87.9 -92.7 -63.6 148.1 -93.3 2.9 -71.1 180 190 A E - 0 0 88 -118,-0.3 2,-0.4 1,-0.0 -1,-0.1 -0.485 55.7-166.2 -62.8 121.5 -92.6 3.0 -67.4 181 191 A M + 0 0 59 -2,-0.3 3,-0.0 -4,-0.1 -1,-0.0 -0.956 22.1 164.7-124.6 136.5 -89.7 0.5 -67.0 182 192 A T > - 0 0 66 -2,-0.4 4,-2.8 1,-0.1 5,-0.3 -0.884 52.5-101.8-134.3 161.9 -88.1 -1.2 -64.1 183 193 A P H > S+ 0 0 104 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.908 122.2 52.4 -54.5 -40.4 -85.8 -4.2 -64.1 184 194 A E H > S+ 0 0 95 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.935 112.7 41.9 -61.6 -49.4 -88.7 -6.4 -63.0 185 195 A V H > S+ 0 0 24 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.937 115.2 50.3 -66.6 -43.4 -91.1 -5.3 -65.8 186 196 A K H X S+ 0 0 55 -4,-2.8 4,-1.9 1,-0.2 5,-0.2 0.919 110.9 49.7 -60.1 -44.5 -88.4 -5.4 -68.5 187 197 A H H X S+ 0 0 132 -4,-2.5 4,-1.5 -5,-0.3 -1,-0.2 0.930 115.8 41.5 -59.1 -49.9 -87.3 -8.9 -67.5 188 198 A R H X S+ 0 0 84 -4,-2.1 4,-2.6 -5,-0.2 -1,-0.2 0.825 110.0 56.9 -72.4 -32.1 -90.8 -10.3 -67.5 189 199 A V H X S+ 0 0 0 -4,-2.6 4,-1.7 2,-0.2 -1,-0.2 0.922 109.8 45.7 -65.4 -41.5 -91.9 -8.5 -70.7 190 200 A T H X S+ 0 0 15 -4,-1.9 4,-1.7 -5,-0.2 -1,-0.2 0.867 112.9 51.0 -70.0 -33.0 -89.0 -10.1 -72.7 191 201 A E H X S+ 0 0 96 -4,-1.5 4,-1.9 1,-0.2 -2,-0.2 0.915 109.4 49.9 -68.4 -41.3 -89.8 -13.4 -71.2 192 202 A E H X S+ 0 0 10 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.842 106.3 56.2 -66.6 -30.7 -93.4 -13.1 -72.2 193 203 A A H X S+ 0 0 0 -4,-1.7 4,-2.3 2,-0.2 -1,-0.2 0.907 106.0 50.8 -66.7 -39.4 -92.4 -12.2 -75.7 194 204 A K H X S+ 0 0 85 -4,-1.7 4,-2.1 1,-0.2 -2,-0.2 0.911 110.5 50.0 -62.4 -40.0 -90.4 -15.5 -75.9 195 205 A T H X S+ 0 0 54 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.896 106.9 54.4 -64.3 -41.3 -93.5 -17.2 -74.7 196 206 A A H X S+ 0 0 0 -4,-2.5 4,-1.6 1,-0.2 -1,-0.2 0.926 108.4 49.3 -59.0 -44.6 -95.6 -15.5 -77.4 197 207 A F H X S+ 0 0 20 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.917 110.2 51.0 -61.8 -41.8 -93.2 -16.7 -80.0 198 208 A L H X S+ 0 0 83 -4,-2.1 4,-2.9 1,-0.2 -1,-0.2 0.887 105.6 55.3 -64.0 -38.6 -93.4 -20.3 -78.6 199 209 A L H X S+ 0 0 9 -4,-2.5 4,-1.6 1,-0.2 -1,-0.2 0.866 110.0 47.5 -61.2 -35.5 -97.3 -20.1 -78.7 200 210 A N H X S+ 0 0 8 -4,-1.6 4,-2.6 2,-0.2 -2,-0.2 0.936 110.7 50.3 -70.9 -44.9 -97.0 -19.3 -82.4 201 211 A I H X S+ 0 0 14 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.928 110.9 49.5 -58.2 -45.9 -94.5 -22.1 -83.1 202 212 A E H X S+ 0 0 70 -4,-2.9 4,-2.0 1,-0.2 -1,-0.2 0.853 109.3 52.7 -62.5 -35.1 -96.8 -24.6 -81.3 203 213 A L H X S+ 0 0 0 -4,-1.6 4,-2.7 -5,-0.2 -1,-0.2 0.949 111.1 46.0 -64.5 -48.4 -99.8 -23.4 -83.3 204 214 A F H X S+ 0 0 18 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.896 111.2 51.7 -62.3 -40.8 -97.9 -23.9 -86.6 205 215 A E H X S+ 0 0 117 -4,-2.6 4,-1.6 -5,-0.2 -1,-0.2 0.903 112.2 48.1 -63.0 -38.2 -96.6 -27.3 -85.5 206 216 A E H X S+ 0 0 39 -4,-2.0 4,-2.2 -5,-0.2 -2,-0.2 0.916 111.9 47.3 -67.6 -45.0 -100.2 -28.2 -84.7 207 217 A L H X S+ 0 0 0 -4,-2.7 4,-1.8 1,-0.2 -2,-0.2 0.890 109.9 53.5 -65.3 -37.9 -101.6 -26.9 -88.0 208 218 A Q H X S+ 0 0 19 -4,-2.5 4,-1.4 1,-0.2 -1,-0.2 0.887 109.6 48.8 -63.2 -39.2 -98.9 -28.7 -90.0 209 219 A A H < S+ 0 0 64 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.903 108.2 53.5 -67.2 -42.1 -99.8 -32.0 -88.3 210 220 A L H < S+ 0 0 107 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.851 110.2 47.6 -61.3 -35.4 -103.6 -31.5 -89.0 211 221 A L H < 0 0 48 -4,-1.8 -1,-0.2 -5,-0.1 -2,-0.2 0.791 360.0 360.0 -75.4 -28.7 -102.8 -31.0 -92.6 212 222 A T < 0 0 136 -4,-1.4 -2,-0.2 -5,-0.2 -3,-0.2 0.894 360.0 360.0 -91.9 360.0 -100.6 -34.1 -92.6