==== 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 10-DEC-08 2W5J . COMPND 2 MOLECULE: ATP SYNTHASE C CHAIN, CHLOROPLASTIC; . SOURCE 2 ORGANISM_SCIENTIFIC: SPINACIA OLERACEA; . AUTHOR M.VOLLMAR,D.SCHLIEPER,M.WINN,C.BUECHNER,G.GROTH . 1092 14 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 32678.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 912 83.5 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 . 14 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 116 10.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 706 64.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 76 7.0 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 1 0 0 0 0 0 14 0 0 1 0 0 0 0 0 13 0 0 0 0 0 14 0 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 N >> 0 0 48 0, 0.0 4,-2.5 0, 0.0 5,-1.0 0.000 360.0 360.0 360.0 -67.7 25.2 16.9 59.5 2 3 A P T 4> + 0 0 97 0, 0.0 5,-0.5 0, 0.0 1030,-0.1 0.794 360.0 53.9 -62.0 -24.8 26.3 20.1 57.6 3 4 A L T >5S+ 0 0 31 3,-0.2 4,-1.1 2,-0.1 5,-0.1 0.965 127.1 18.8 -61.7 -52.1 28.8 17.7 56.2 4 5 A I H >5S+ 0 0 69 2,-0.2 4,-4.3 3,-0.2 5,-0.2 0.975 124.5 49.0 -87.6 -63.6 26.0 15.3 55.1 5 6 A A H X5S+ 0 0 26 -4,-2.5 4,-1.7 2,-0.2 -1,-0.1 0.773 117.6 48.4 -54.7 -28.8 22.7 17.3 55.0 6 7 A A H >> S+ 0 0 43 2,-0.2 4,-0.8 1,-0.1 3,-0.2 0.622 71.7 75.6 -88.7 -24.9 15.7 13.7 35.4 19 20 A A T 4 S+ 0 0 5 1,-0.2 5,-0.3 44,-0.2 -1,-0.1 0.712 93.6 55.1 -57.3 -20.9 12.9 16.1 35.0 20 21 A S T > S+ 0 0 3 3,-0.1 4,-2.2 2,-0.1 5,-0.3 0.887 99.4 61.5 -73.3 -46.4 14.6 16.7 31.6 21 22 A I H > S+ 0 0 40 -4,-0.4 4,-2.0 -3,-0.2 5,-0.2 0.943 104.0 39.1 -49.5 -80.4 14.5 13.1 30.5 22 23 A G H X S+ 0 0 4 -4,-0.8 4,-2.0 1,-0.2 3,-0.4 0.821 125.8 34.0 -40.9 -68.9 10.8 12.1 30.4 23 24 A P H 4>S+ 0 0 0 0, 0.0 5,-0.6 0, 0.0 4,-0.3 0.934 108.7 66.9 -52.5 -55.6 9.4 15.3 28.9 24 25 A G H X5S+ 0 0 5 -4,-2.2 4,-0.6 -5,-0.3 1030,-0.3 0.846 109.5 38.8 -32.7 -54.3 12.5 16.0 26.8 25 26 A V H X5S+ 0 0 47 -4,-2.0 4,-0.5 -3,-0.4 -1,-0.2 0.973 120.7 47.7 -60.8 -55.4 11.6 12.9 24.8 26 27 A G H >X5S+ 0 0 0 -4,-2.0 3,-5.5 -5,-0.2 4,-1.1 0.955 108.0 41.2 -53.9 -95.9 7.8 13.6 24.9 27 28 A Q H 3>5S+ 0 0 20 76,-0.3 4,-3.4 1,-0.3 5,-0.2 0.775 110.6 64.6 -22.1 -49.1 6.7 17.2 24.0 28 29 A G H 3XX S+ 0 0 3 -4,-3.4 4,-2.9 1,-0.2 3,-0.7 0.960 116.3 46.7 -46.9 -59.7 5.9 19.0 18.3 32 33 A G H 3X S+ 0 0 3 -4,-1.7 4,-1.6 1,-0.2 -2,-0.2 0.909 112.5 47.8 -50.6 -50.9 7.2 16.6 15.7 33 34 A Q H 3X S+ 0 0 34 -4,-4.5 4,-1.2 1,-0.2 -1,-0.2 0.748 115.4 47.0 -68.0 -22.1 3.8 14.9 15.1 34 35 A A H < + 0 0 75 -4,-1.8 3,-1.5 1,-0.1 -1,-0.3 -0.820 66.5 179.1-113.9 90.4 -3.3 20.5 5.7 42 43 A P T 3 S+ 0 0 50 0, 0.0 3,-0.5 0, 0.0 -1,-0.1 0.612 79.0 63.9 -67.7 -15.0 -1.9 24.0 6.4 43 44 A E T 3 S+ 0 0 111 1,-0.2 4,-0.1 -5,-0.1 -5,-0.1 0.546 97.7 59.2 -81.8 -8.8 -5.4 25.6 6.8 44 45 A A S <> S+ 0 0 7 -3,-1.5 4,-0.7 -6,-0.2 3,-0.3 0.464 80.5 120.6 -90.9 -9.8 -5.7 23.3 9.8 45 46 A E T 4 S+ 0 0 68 -3,-0.5 2,-1.7 1,-0.2 1030,-0.1 -0.156 72.2 27.7 -47.6 150.2 -2.6 25.0 11.4 46 47 A G T > S+ 0 0 34 1,-0.2 4,-3.8 0, 0.0 5,-0.3 -0.473 108.3 72.3 85.9 -64.3 -3.4 26.6 14.8 47 48 A K T 4 S+ 0 0 21 -2,-1.7 -2,-0.2 -3,-0.3 4,-0.2 0.764 107.6 41.5 -47.6 -26.5 -6.2 24.1 15.3 48 49 A I T >X S+ 0 0 1 -4,-0.7 3,-3.1 2,-0.1 4,-1.5 0.919 113.7 47.8 -78.1 -71.8 -3.0 22.1 15.7 49 50 A R H 3>>S+ 0 0 53 1,-0.3 4,-2.9 2,-0.2 5,-0.6 0.786 98.1 70.3 -40.7 -46.2 -0.9 24.5 17.8 50 51 A G H 3X5S+ 0 0 35 -4,-3.8 4,-1.0 1,-0.2 -1,-0.3 0.805 111.8 31.8 -43.8 -35.7 -3.7 25.2 20.2 51 52 A T H <>5S+ 0 0 2 -3,-3.1 4,-4.7 -5,-0.3 5,-0.3 0.868 114.1 58.8 -89.8 -45.9 -3.2 21.7 21.5 52 53 A L H X5S+ 0 0 2 -4,-1.5 4,-4.3 2,-0.2 5,-0.4 0.963 114.3 39.6 -43.6 -61.6 0.5 21.4 20.9 53 54 A L H X5S+ 0 0 69 -4,-2.9 4,-2.3 1,-0.2 -1,-0.2 0.922 114.1 54.2 -54.9 -50.4 1.0 24.4 23.1 54 55 A L H X4 S+ 0 0 12 -4,-0.5 3,-0.5 -2,-0.4 4,-0.3 0.725 109.8 42.3 -83.9 -57.7 5.2 18.5 29.6 60 61 A E H 3X S+ 0 0 17 -4,-1.1 4,-1.4 -3,-0.5 3,-0.4 0.637 106.8 68.3 -54.9 -18.9 7.3 21.5 30.7 61 62 A A H >X S+ 0 0 20 -4,-0.7 4,-2.0 1,-0.2 3,-0.5 0.982 97.5 46.5 -67.7 -57.2 5.2 21.6 33.9 62 63 A L H <4 S+ 0 0 8 -3,-0.5 -1,-0.2 -4,-0.4 -2,-0.2 0.368 109.1 56.4 -76.4 8.4 6.4 18.3 35.4 63 64 A T H >> S+ 0 0 2 -3,-0.4 4,-2.1 -4,-0.3 3,-0.7 0.734 106.8 48.4 -94.8 -38.1 10.0 19.2 34.7 64 65 A I H S+ 0 0 8 -3,-0.7 4,-4.5 2,-0.2 5,-0.3 0.958 110.7 55.8 -73.6 -55.9 11.7 19.4 39.9 67 68 A L H X S+ 0 0 34 -4,-2.1 4,-1.9 1,-0.2 -2,-0.2 0.834 111.2 49.8 -46.7 -34.5 13.3 22.7 39.1 68 69 A V H X S+ 0 0 76 -4,-4.3 4,-2.9 2,-0.2 -1,-0.2 0.977 118.0 35.6 -63.2 -58.1 11.1 23.9 41.9 69 70 A V H X S+ 0 0 10 -4,-1.9 4,-1.1 -5,-0.3 -2,-0.2 0.668 112.6 64.5 -73.0 -17.5 12.1 21.2 44.3 70 71 A A H X S+ 0 0 3 -4,-4.5 4,-0.7 -6,-0.3 -1,-0.2 0.939 115.5 28.0 -65.3 -48.6 15.6 21.5 42.8 71 72 A L H X>S+ 0 0 58 -4,-1.9 4,-3.2 -5,-0.3 5,-0.9 0.786 115.0 64.1 -84.6 -29.7 15.9 25.0 44.1 72 73 A A H <5S+ 0 0 16 -4,-2.9 -3,-0.2 1,-0.2 -1,-0.2 0.756 108.8 41.3 -66.7 -27.0 13.6 24.4 47.1 73 74 A L H <5S+ 0 0 7 -4,-1.1 -1,-0.2 -5,-0.2 -2,-0.2 0.737 122.0 44.5 -83.8 -27.9 16.1 21.9 48.4 74 75 A L H <5S+ 0 0 14 -4,-0.7 -2,-0.2 -5,-0.1 -3,-0.2 0.971 132.9 10.5 -81.7 -61.5 19.0 24.2 47.4 75 76 A F T <5S+ 0 0 105 -4,-3.2 -3,-0.2 1,-0.1 -2,-0.1 0.371 136.9 42.9-107.1 0.6 18.1 27.7 48.5 76 77 A A S > 0 0 51 0, 0.0 4,-2.4 0, 0.0 5,-1.0 0.000 360.0 360.0 360.0 -67.2 20.1 10.8 62.7 81 3 B P T 45 + 0 0 99 0, 0.0 5,-0.5 0, 0.0 -76,-0.2 0.782 360.0 54.2 -63.3 -23.4 20.0 14.6 61.7 82 4 B L T >5S+ 0 0 26 3,-0.2 4,-1.1 -78,-0.1 5,-0.1 0.958 126.9 18.5 -62.0 -51.3 23.1 13.6 59.9 83 5 B I H >5S+ 0 0 69 2,-0.2 4,-4.1 3,-0.2 5,-0.2 0.973 124.5 49.1 -88.3 -63.7 21.3 10.7 58.2 84 6 B A H X5S+ 0 0 28 -4,-2.4 4,-1.5 2,-0.2 -1,-0.1 0.746 117.1 48.9 -55.3 -27.2 17.5 11.3 58.3 85 7 B A H > S+ 0 0 44 2,-0.2 4,-0.8 1,-0.1 3,-0.2 0.638 71.8 75.2 -88.5 -24.5 11.4 10.0 38.3 98 20 B A T 4 S+ 0 0 5 1,-0.2 5,-0.3 44,-0.2 -1,-0.1 0.708 93.5 54.9 -58.8 -20.5 7.9 11.2 38.3 99 21 B S T > S+ 0 0 2 3,-0.1 4,-2.2 2,-0.1 5,-0.3 0.896 99.1 62.2 -72.3 -46.6 9.0 13.2 35.2 100 22 B I H > S+ 0 0 39 -4,-0.5 4,-1.9 -78,-0.2 5,-0.2 0.930 103.7 39.2 -48.5 -79.7 10.3 10.1 33.3 101 23 B G H X S+ 0 0 4 -4,-0.8 4,-2.1 1,-0.2 3,-0.4 0.825 125.4 33.9 -42.7 -67.7 7.2 7.9 32.7 102 24 B P H 4>S+ 0 0 0 0, 0.0 5,-0.6 0, 0.0 -1,-0.2 0.958 108.4 67.2 -52.5 -58.1 4.6 10.6 32.0 103 25 B G H X5S+ 0 0 4 -4,-2.2 4,-0.6 -5,-0.3 -76,-0.3 0.816 109.6 38.7 -30.4 -53.5 7.1 12.9 30.2 104 26 B V H X5S+ 0 0 46 -4,-1.9 4,-0.6 -3,-0.4 -1,-0.3 0.975 120.3 47.8 -62.3 -55.7 7.3 10.2 27.5 105 27 B G H >X5S+ 0 0 0 -4,-2.1 3,-5.5 -5,-0.2 4,-1.0 0.947 108.6 41.4 -53.2 -95.4 3.6 9.3 27.6 106 28 B Q H 3>5S+ 0 0 15 1,-0.3 4,-3.4 76,-0.3 5,-0.2 0.766 110.2 64.4 -21.8 -49.5 1.3 12.4 27.5 107 29 B G H 3XX S+ 0 0 3 -4,-3.4 4,-2.9 1,-0.2 3,-0.8 0.965 115.9 46.1 -47.0 -61.9 -0.5 15.1 22.4 111 33 B G H 3X S+ 0 0 2 -4,-1.8 4,-1.6 1,-0.3 -2,-0.2 0.900 112.8 47.9 -49.1 -51.2 1.5 14.0 19.3 112 34 B Q H 3X S+ 0 0 36 -4,-4.4 4,-1.2 1,-0.2 -1,-0.3 0.752 115.3 47.3 -68.0 -22.5 -1.1 11.4 18.3 113 35 B A H < + 0 0 77 -4,-1.9 3,-1.8 1,-0.1 4,-0.2 -0.804 66.5 179.4-114.5 89.5 -10.2 15.9 10.2 121 43 B P T 3 S+ 0 0 50 0, 0.0 3,-0.5 0, 0.0 -1,-0.1 0.613 79.1 63.5 -68.0 -14.3 -10.2 19.5 11.7 122 44 B E T 3 S+ 0 0 112 1,-0.2 4,-0.1 -5,-0.1 -5,-0.1 0.520 97.7 59.2 -82.9 -7.7 -14.0 19.6 12.3 123 45 B A S <> S+ 0 0 8 -3,-1.8 4,-0.7 -6,-0.2 3,-0.3 0.466 80.8 120.9 -91.7 -9.9 -13.3 16.6 14.7 124 46 B E T 4 S+ 0 0 68 -3,-0.5 2,-1.7 -4,-0.2 -76,-0.1 -0.148 72.2 27.4 -47.2 149.9 -11.0 19.0 16.7 125 47 B G T > S+ 0 0 33 1,-0.2 4,-3.6 0, 0.0 5,-0.3 -0.460 108.4 72.3 85.6 -64.1 -12.1 19.4 20.4 126 48 B K T 4 S+ 0 0 23 -2,-1.7 -2,-0.2 -3,-0.3 4,-0.2 0.763 107.6 41.7 -47.7 -26.4 -13.8 15.9 20.2 127 49 B I T >X S+ 0 0 2 -4,-0.7 3,-3.2 2,-0.1 4,-1.5 0.918 113.6 47.5 -77.6 -72.4 -10.0 15.2 20.3 128 50 B R H 3>>S+ 0 0 52 1,-0.3 4,-2.8 2,-0.2 5,-0.6 0.779 98.1 70.7 -40.3 -46.0 -8.8 17.7 22.9 129 51 B G H 3X5S+ 0 0 35 -4,-3.6 4,-0.8 1,-0.2 -1,-0.3 0.787 111.5 31.9 -44.2 -34.9 -11.6 16.7 25.3 130 52 B T H <>5S+ 0 0 2 -3,-3.2 4,-4.7 -5,-0.3 -1,-0.2 0.861 114.1 58.9 -90.0 -46.2 -9.8 13.5 25.8 131 53 B L H X5S+ 0 0 3 -4,-1.5 4,-3.6 2,-0.2 5,-0.4 0.967 114.1 39.4 -43.0 -63.8 -6.3 14.7 25.3 132 54 B L H X5S+ 0 0 69 -4,-2.8 4,-2.0 1,-0.2 -1,-0.2 0.916 114.1 54.8 -53.7 -49.4 -6.8 17.0 28.2 133 55 B L H XX S+ 0 0 20 -4,-0.5 4,-1.8 1,-0.2 3,-0.6 0.983 97.6 46.2 -68.7 -57.7 -1.3 13.5 38.1 141 63 B L H 34 S+ 0 0 8 -3,-0.5 -1,-0.2 -4,-0.4 -2,-0.2 0.359 109.1 56.8 -75.1 7.6 1.0 10.7 38.9 142 64 B T H >> S+ 0 0 3 -3,-0.4 4,-2.0 -4,-0.3 3,-0.6 0.705 106.9 48.1 -95.8 -35.4 4.0 13.0 38.5 143 65 B I H S+ 0 0 10 -3,-0.6 4,-4.5 2,-0.2 5,-0.3 0.950 110.4 56.2 -74.8 -55.5 5.8 12.6 43.8 146 68 B L H X S+ 0 0 30 -4,-2.0 4,-1.8 1,-0.2 -2,-0.2 0.831 111.4 49.5 -46.7 -34.5 6.0 16.3 43.8 147 69 B V H X S+ 0 0 77 -4,-4.4 4,-2.9 2,-0.2 -1,-0.2 0.970 117.8 35.6 -63.4 -58.4 3.6 16.0 46.7 148 70 B V H X S+ 0 0 11 -4,-1.8 4,-1.0 -5,-0.3 -2,-0.2 0.667 112.5 64.9 -73.0 -16.9 5.7 13.3 48.5 149 71 B A H X S+ 0 0 2 -4,-4.5 4,-0.7 -6,-0.3 -1,-0.2 0.935 115.4 27.6 -65.4 -48.9 8.8 15.2 47.2 150 72 B L H X>S+ 0 0 55 -4,-1.8 4,-3.3 -5,-0.3 5,-0.9 0.800 115.2 63.9 -84.6 -30.7 7.9 18.2 49.3 151 73 B A H <5S+ 0 0 17 -4,-2.9 -3,-0.2 1,-0.2 -1,-0.2 0.742 109.2 41.3 -66.1 -26.9 6.1 16.2 52.0 152 74 B L H <5S+ 0 0 7 -4,-1.0 -1,-0.2 -5,-0.2 -2,-0.2 0.744 122.3 44.2 -83.6 -28.8 9.4 14.5 52.8 153 75 B L H <5S+ 0 0 13 -4,-0.7 -2,-0.2 2,-0.1 -3,-0.2 0.971 133.3 10.1 -80.6 -62.4 11.2 17.9 52.5 154 76 B F T <5S+ 0 0 106 -4,-3.3 -3,-0.2 1,-0.1 -2,-0.1 0.361 137.0 43.2-107.6 1.5 9.1 20.4 54.3 155 77 B A S > 0 0 50 0, 0.0 4,-2.2 0, 0.0 5,-1.0 0.000 360.0 360.0 360.0 -66.2 17.6 2.6 64.4 160 3 C P T 45 + 0 0 101 0, 0.0 5,-0.5 0, 0.0 -76,-0.1 0.762 360.0 54.0 -64.4 -22.3 16.0 6.1 64.3 161 4 C L T >5S+ 0 0 28 3,-0.2 4,-1.2 2,-0.1 5,-0.2 0.961 126.9 18.8 -62.0 -52.7 19.2 6.8 62.4 162 5 C I H >5S+ 0 0 70 2,-0.2 4,-3.9 3,-0.2 5,-0.2 0.978 124.4 49.0 -87.4 -64.6 18.5 3.9 60.0 163 6 C A H X5S+ 0 0 27 -4,-2.2 4,-1.7 2,-0.2 -1,-0.1 0.762 117.4 48.5 -53.7 -28.4 14.8 3.0 60.1 164 7 C A H > S+ 0 0 45 2,-0.2 4,-0.8 1,-0.1 3,-0.2 0.619 71.7 75.7 -88.8 -24.4 8.7 4.2 40.0 177 20 C A T 4 S+ 0 0 4 1,-0.2 5,-0.3 44,-0.2 -1,-0.1 0.720 93.5 54.4 -58.3 -21.0 4.9 4.0 40.2 178 21 C S T > S+ 0 0 3 3,-0.1 4,-2.2 2,-0.1 5,-0.3 0.890 99.3 62.5 -73.1 -45.8 5.2 6.9 37.6 179 22 C I H > S+ 0 0 39 -4,-0.4 4,-1.8 -3,-0.2 5,-0.2 0.937 103.8 38.5 -49.0 -81.3 7.4 5.0 35.1 180 23 C G H X S+ 0 0 3 -4,-0.8 4,-2.2 1,-0.2 3,-0.4 0.819 125.5 35.0 -41.0 -66.7 5.3 2.1 34.0 181 24 C P H 4>S+ 0 0 0 0, 0.0 5,-0.6 0, 0.0 4,-0.2 0.959 108.3 66.3 -53.3 -57.3 1.9 3.7 33.8 182 25 C G H X5S+ 0 0 4 -4,-2.2 4,-0.6 -5,-0.3 -76,-0.3 0.824 109.8 39.1 -31.5 -52.2 3.2 7.1 32.6 183 26 C V H X5S+ 0 0 46 -4,-1.8 4,-0.5 -3,-0.4 -1,-0.2 0.986 120.3 47.6 -62.2 -57.9 4.3 5.3 29.4 184 27 C G H >X5S+ 0 0 0 -4,-2.2 3,-5.3 -5,-0.2 4,-1.0 0.938 108.5 41.3 -51.6 -95.5 1.1 3.2 29.2 185 28 C Q H 3>5S+ 0 0 17 76,-0.3 4,-3.3 1,-0.3 5,-0.2 0.768 110.2 64.6 -21.7 -49.9 -2.1 5.2 29.7 186 29 C G H 3XX S+ 0 0 1 -4,-3.3 4,-2.9 1,-0.2 3,-0.9 0.970 115.8 46.5 -46.7 -62.5 -4.9 8.1 25.2 190 33 C G H 3X S+ 0 0 3 -4,-1.6 4,-1.6 1,-0.3 -2,-0.2 0.897 112.6 48.0 -48.8 -50.7 -2.9 8.5 22.1 191 34 C Q H 3X S+ 0 0 34 -4,-4.5 4,-1.2 1,-0.2 -1,-0.3 0.745 115.5 46.9 -67.6 -22.3 -4.3 5.5 20.3 192 35 C A H < + 0 0 75 -4,-1.9 3,-1.8 1,-0.1 4,-0.3 -0.796 66.6 179.2-113.9 89.1 -14.8 8.1 13.1 200 43 C P T 3 S+ 0 0 52 0, 0.0 3,-0.5 0, 0.0 -1,-0.1 0.618 79.2 63.6 -67.2 -14.6 -16.0 11.0 15.4 201 44 C E T 3 S+ 0 0 112 1,-0.2 4,-0.1 -5,-0.1 -5,-0.1 0.534 97.8 59.2 -82.5 -7.9 -19.6 9.6 15.8 202 45 C A S <> S+ 0 0 4 -3,-1.8 4,-0.7 -6,-0.2 3,-0.3 0.488 80.7 120.5 -90.8 -11.0 -17.8 6.6 17.5 203 46 C E 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