==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-APR-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PHOTOSYNTHESIS 12-FEB-10 3LS0 . COMPND 2 MOLECULE: SLL1638 PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: SYNECHOCYSTIS SP.; . AUTHOR S.A.JACKSON,R.D.FAGERLUND,S.M.WILBANKS,J.J.EATON-RYE . 115 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6630.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 102 88.7 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 . 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 2.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 10.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 82 71.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 4.3 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 1 0 0 1 0 1 0 0 0 0 0 0 0 0 0 1 0 1 0 0 1 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 32 A T 0 0 154 0, 0.0 2,-0.7 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 162.9 31.0 -11.1 -0.3 2 33 A Y - 0 0 46 4,-0.0 60,-0.0 61,-0.0 0, 0.0 -0.846 360.0-155.4 -88.9 107.4 30.4 -7.5 -1.5 3 34 A S > - 0 0 48 -2,-0.7 4,-2.5 1,-0.1 5,-0.2 -0.266 30.9-106.2 -69.0 164.6 31.6 -7.0 -5.1 4 35 A P H > S+ 0 0 97 0, 0.0 4,-2.1 0, 0.0 5,-0.1 0.893 123.2 52.8 -62.1 -38.2 32.6 -3.5 -6.2 5 36 A E H > S+ 0 0 136 1,-0.2 4,-1.4 2,-0.2 5,-0.1 0.871 109.8 49.0 -65.6 -37.5 29.4 -3.3 -8.3 6 37 A K H > S+ 0 0 52 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.893 108.6 51.8 -65.6 -49.0 27.4 -4.2 -5.2 7 38 A I H X S+ 0 0 58 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.898 106.7 54.3 -53.6 -38.9 29.1 -1.7 -3.1 8 39 A A H X S+ 0 0 59 -4,-2.1 4,-0.8 2,-0.2 -1,-0.2 0.890 107.8 50.9 -62.6 -37.0 28.3 1.0 -5.7 9 40 A Q H >X S+ 0 0 116 -4,-1.4 3,-0.9 1,-0.2 4,-0.6 0.926 109.1 50.4 -65.1 -45.1 24.6 -0.0 -5.5 10 41 A L H >X S+ 0 0 6 -4,-2.3 4,-2.1 1,-0.2 3,-1.3 0.888 102.0 63.8 -59.5 -36.6 24.7 0.3 -1.7 11 42 A Q H 3X S+ 0 0 82 -4,-2.2 4,-2.6 1,-0.3 -1,-0.2 0.765 87.3 68.5 -60.2 -27.4 26.3 3.8 -2.1 12 43 A V H << S+ 0 0 100 -3,-0.9 -1,-0.3 -4,-0.8 -2,-0.2 0.890 111.5 34.0 -62.0 -32.5 23.2 5.2 -3.8 13 44 A Y H S+ 0 0 55 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.837 116.9 56.6 -74.6 -25.5 21.8 10.7 1.6 17 48 A I H X S+ 0 0 0 -4,-1.4 4,-2.1 2,-0.2 -2,-0.2 0.892 107.6 48.2 -68.2 -37.3 22.1 8.7 4.8 18 49 A A H X S+ 0 0 47 -4,-2.9 4,-2.0 2,-0.2 -1,-0.2 0.870 110.9 50.2 -69.8 -39.8 25.6 10.0 5.4 19 50 A V H X S+ 0 0 105 -4,-1.9 4,-2.8 -5,-0.3 -1,-0.2 0.897 109.5 53.3 -64.8 -43.0 24.5 13.6 4.7 20 51 A A H X S+ 0 0 9 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.905 107.9 49.8 -56.2 -47.8 21.6 13.0 7.2 21 52 A R H X S+ 0 0 37 -4,-2.1 4,-1.4 2,-0.2 -1,-0.2 0.896 112.2 47.4 -55.3 -45.6 24.1 11.9 9.9 22 53 A D H X S+ 0 0 82 -4,-2.0 4,-2.5 1,-0.2 5,-0.2 0.913 111.6 51.2 -61.9 -46.9 26.2 15.0 9.3 23 54 A G H X>S+ 0 0 11 -4,-2.8 4,-2.7 1,-0.2 5,-1.9 0.851 103.0 59.6 -65.8 -33.8 23.1 17.3 9.4 24 55 A M H <>S+ 0 0 0 -4,-2.4 5,-2.1 3,-0.2 -1,-0.2 0.943 114.6 34.9 -58.6 -45.2 21.9 15.8 12.7 25 56 A E H <5S+ 0 0 91 -4,-1.4 -2,-0.2 -3,-0.2 -1,-0.2 0.876 124.0 42.5 -78.2 -36.8 25.1 16.8 14.5 26 57 A K H <5S+ 0 0 149 -4,-2.5 -3,-0.2 -5,-0.1 -2,-0.2 0.799 134.8 7.7 -80.7 -31.0 25.7 20.1 12.6 27 58 A R T X5S+ 0 0 137 -4,-2.7 4,-1.9 -5,-0.2 -3,-0.2 0.755 124.5 49.8-118.7 -52.0 22.1 21.4 12.6 28 59 A L H > S+ 0 0 32 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.852 108.8 56.0 -73.9 -33.0 21.9 23.2 17.8 31 62 A L H <>S+ 0 0 9 -4,-1.9 5,-2.4 2,-0.2 -1,-0.2 0.909 110.5 45.6 -64.3 -39.8 18.1 23.5 17.2 32 63 A I H ><5S+ 0 0 15 -4,-2.4 3,-1.8 1,-0.2 -2,-0.2 0.919 111.1 51.5 -67.0 -42.8 17.5 21.3 20.2 33 64 A A H 3<5S+ 0 0 74 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.834 108.0 55.1 -59.1 -35.0 20.0 23.4 22.3 34 65 A D T 3<5S- 0 0 115 -4,-2.0 -1,-0.3 -5,-0.1 -2,-0.2 0.447 109.9-124.6 -76.9 -3.4 18.1 26.5 21.2 35 66 A Q T < 5 + 0 0 143 -3,-1.8 2,-1.4 1,-0.2 3,-0.2 0.777 58.8 153.7 58.0 34.5 14.8 25.1 22.5 36 67 A N >< + 0 0 49 -5,-2.4 4,-1.9 -6,-0.2 -1,-0.2 -0.647 11.0 167.0 -95.0 85.2 13.6 25.7 18.9 37 68 A W H > + 0 0 18 -2,-1.4 4,-2.0 2,-0.2 -1,-0.2 0.829 68.7 56.6 -77.2 -29.8 10.8 23.0 18.9 38 69 A V H > S+ 0 0 102 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.958 114.0 38.4 -65.5 -47.8 9.1 24.1 15.7 39 70 A D H > S+ 0 0 71 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.807 110.5 60.1 -79.2 -23.3 12.2 23.8 13.6 40 71 A T H X S+ 0 0 0 -4,-1.9 4,-1.7 2,-0.2 -1,-0.2 0.927 108.0 46.5 -58.7 -47.8 13.3 20.7 15.4 41 72 A Q H X S+ 0 0 53 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.944 112.4 49.8 -64.2 -42.1 10.0 19.0 14.2 42 73 A T H X S+ 0 0 83 -4,-2.1 4,-2.7 1,-0.2 6,-0.2 0.894 106.6 56.2 -65.6 -34.8 10.6 20.3 10.7 43 74 A Y H <>S+ 0 0 16 -4,-2.2 5,-2.3 1,-0.2 6,-0.2 0.899 108.0 47.7 -61.4 -42.5 14.1 19.0 10.6 44 75 A I H <5S+ 0 0 16 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.848 119.0 39.7 -64.1 -38.5 12.9 15.5 11.4 45 76 A H H <5S+ 0 0 118 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.741 127.7 27.3 -88.5 -23.9 10.2 15.6 8.7 46 77 A G T ><5S+ 0 0 45 -4,-2.7 3,-1.9 -5,-0.2 4,-0.4 0.779 129.8 27.2 -99.7 -81.9 12.1 17.4 6.0 47 78 A P T 3 5S+ 0 0 76 0, 0.0 3,-0.2 0, 0.0 -3,-0.2 0.783 138.8 30.2 -53.5 -34.4 15.9 16.9 6.1 48 79 A L T > S+ 0 0 111 -4,-0.4 4,-3.0 -3,-0.2 5,-0.3 0.313 82.1 99.2 -93.9 4.4 13.5 10.0 3.9 51 82 A L H <> S+ 0 0 7 -3,-1.7 4,-2.8 2,-0.2 5,-0.4 0.913 80.1 52.3 -59.6 -40.3 15.6 8.2 6.4 52 83 A R H > S+ 0 0 120 -4,-0.4 4,-2.3 -3,-0.2 5,-0.3 0.981 114.2 42.6 -59.4 -53.8 13.1 5.4 6.9 53 84 A R H > S+ 0 0 176 -4,-0.3 4,-2.1 1,-0.2 -2,-0.2 0.922 119.3 43.5 -56.1 -45.9 12.9 4.7 3.2 54 85 A D H X S+ 0 0 21 -4,-3.0 4,-2.5 2,-0.2 -1,-0.2 0.910 115.4 45.1 -73.5 -44.3 16.7 5.0 2.6 55 86 A M H X S+ 0 0 0 -4,-2.8 4,-2.8 -5,-0.3 -1,-0.2 0.894 116.4 46.8 -69.9 -31.9 17.9 3.1 5.7 56 87 A L H X S+ 0 0 62 -4,-2.3 4,-2.3 -5,-0.4 -2,-0.2 0.879 112.0 50.5 -73.6 -37.3 15.4 0.3 5.1 57 88 A G H X S+ 0 0 18 -4,-2.1 4,-0.5 -5,-0.3 -2,-0.2 0.938 113.6 46.9 -64.7 -40.5 16.3 0.2 1.4 58 89 A L H >X S+ 0 0 0 -4,-2.5 3,-1.8 1,-0.2 4,-0.6 0.964 112.1 47.6 -62.6 -53.2 19.9 -0.1 2.4 59 90 A A H >< S+ 0 0 0 -4,-2.8 3,-0.9 1,-0.3 -1,-0.2 0.846 110.4 53.6 -58.3 -39.2 19.4 -2.7 5.0 60 91 A S H 3< S+ 0 0 66 -4,-2.3 -1,-0.3 1,-0.2 -2,-0.2 0.550 105.6 54.9 -68.5 -10.5 17.3 -4.8 2.5 61 92 A S H << S+ 0 0 29 -3,-1.8 -1,-0.2 -4,-0.5 -2,-0.2 0.466 88.9 103.2 -99.9 -6.8 20.1 -4.6 -0.1 62 93 A L S << S- 0 0 4 -3,-0.9 5,-0.1 -4,-0.6 52,-0.0 -0.326 87.2 -82.6 -77.9 161.6 22.7 -6.1 2.3 63 94 A L >> - 0 0 31 1,-0.1 3,-1.9 3,-0.1 4,-1.2 -0.132 50.5-105.3 -55.6 152.2 24.1 -9.7 2.2 64 95 A P H >> S+ 0 0 111 0, 0.0 4,-0.7 0, 0.0 3,-0.6 0.890 117.8 61.9 -59.2 -27.5 21.7 -11.9 4.0 65 96 A K H 34 S+ 0 0 156 1,-0.2 4,-0.2 2,-0.1 -2,-0.1 0.648 112.9 35.8 -70.9 -16.0 24.0 -12.3 7.1 66 97 A D H <> S+ 0 0 40 -3,-1.9 4,-2.3 2,-0.1 -1,-0.2 0.444 92.8 86.3-112.2 -13.1 23.8 -8.4 7.8 67 98 A Q H S+ 0 0 116 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.927 115.1 49.7 -62.9 -42.0 21.2 -6.4 12.3 70 101 A A H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.921 111.3 47.2 -64.8 -42.7 20.9 -3.5 10.0 71 102 A K H X S+ 0 0 67 -4,-3.1 4,-2.4 -5,-0.2 -1,-0.2 0.895 112.0 51.6 -60.2 -44.6 17.0 -3.5 10.0 72 103 A T H X S+ 0 0 43 -4,-2.4 4,-1.6 -5,-0.2 -2,-0.2 0.925 112.2 45.8 -56.9 -47.9 17.0 -3.8 13.8 73 104 A L H X S+ 0 0 17 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.877 110.6 53.0 -66.6 -39.4 19.4 -0.8 14.2 74 105 A A H X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.931 107.6 51.1 -58.9 -44.0 17.4 1.2 11.7 75 106 A K H X S+ 0 0 124 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.850 108.6 53.1 -64.7 -32.0 14.1 0.6 13.7 76 107 A E H X S+ 0 0 92 -4,-1.6 4,-2.3 2,-0.2 -1,-0.2 0.910 109.2 48.0 -67.5 -44.2 16.0 1.8 16.8 77 108 A V H X S+ 0 0 0 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.948 112.3 49.6 -59.0 -47.3 17.0 5.0 15.1 78 109 A F H X S+ 0 0 10 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.876 109.7 51.7 -62.5 -39.7 13.4 5.5 13.9 79 110 A G H X S+ 0 0 19 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.929 111.3 45.5 -68.1 -39.6 12.0 5.0 17.4 80 111 A H H X S+ 0 0 29 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.889 113.3 50.5 -70.3 -34.1 14.3 7.5 19.0 81 112 A L H X S+ 0 0 12 -4,-2.7 4,-2.7 2,-0.2 -1,-0.2 0.875 109.8 51.3 -67.1 -37.1 13.6 10.0 16.2 82 113 A E H X S+ 0 0 102 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.895 112.0 46.2 -58.7 -44.0 9.9 9.5 16.7 83 114 A R H X S+ 0 0 143 -4,-2.1 4,-2.8 2,-0.2 -2,-0.2 0.856 110.2 53.6 -72.0 -33.1 10.3 10.1 20.5 84 115 A L H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.934 109.4 48.5 -64.5 -43.4 12.4 13.2 19.7 85 116 A D H X S+ 0 0 16 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.947 112.9 47.8 -59.8 -42.1 9.6 14.5 17.5 86 117 A A H X S+ 0 0 44 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.897 110.6 52.7 -63.9 -46.1 7.1 13.8 20.3 87 118 A A H <>S+ 0 0 4 -4,-2.8 5,-3.1 2,-0.2 -1,-0.2 0.919 109.6 48.3 -55.3 -41.9 9.5 15.5 22.8 88 119 A A H ><5S+ 0 0 1 -4,-2.6 3,-1.6 1,-0.2 -2,-0.2 0.913 108.8 52.1 -68.3 -42.0 9.6 18.6 20.7 89 120 A K H 3<5S+ 0 0 128 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.863 114.1 45.8 -59.0 -33.2 5.8 18.7 20.3 90 121 A D T 3<5S- 0 0 120 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.379 111.1-123.7 -88.1 -0.9 5.7 18.5 24.1 91 122 A R T < 5 + 0 0 193 -3,-1.6 2,-1.0 1,-0.2 -3,-0.2 0.859 58.2 154.2 56.4 38.1 8.4 21.2 24.5 92 123 A N >< + 0 0 61 -5,-3.1 4,-2.2 1,-0.2 -1,-0.2 -0.777 18.8 173.6 -99.9 92.9 10.3 18.6 26.6 93 124 A G H > S+ 0 0 29 -2,-1.0 4,-2.4 1,-0.2 5,-0.2 0.779 75.4 61.9 -73.3 -30.6 13.9 19.6 26.2 94 125 A S H > S+ 0 0 82 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.967 113.0 35.3 -57.9 -52.8 15.0 16.9 28.7 95 126 A Q H > S+ 0 0 71 2,-0.2 4,-3.1 1,-0.2 5,-0.3 0.824 111.9 60.7 -69.1 -32.8 13.7 14.1 26.5 96 127 A A H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.956 108.9 44.2 -62.1 -45.2 14.7 15.9 23.2 97 128 A K H X S+ 0 0 129 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.931 116.1 47.3 -61.0 -45.5 18.4 15.9 24.4 98 129 A I H X S+ 0 0 63 -4,-1.9 4,-2.6 -5,-0.2 -2,-0.2 0.939 113.9 46.5 -61.9 -47.5 18.1 12.2 25.5 99 130 A Q H X S+ 0 0 15 -4,-3.1 4,-2.8 1,-0.3 -1,-0.2 0.841 109.2 54.4 -72.0 -33.0 16.4 11.0 22.4 100 131 A Y H X S+ 0 0 17 -4,-2.2 4,-2.5 -5,-0.3 -1,-0.3 0.932 111.9 44.7 -57.1 -52.3 18.9 12.9 20.1 101 132 A Q H X S+ 0 0 95 -4,-2.1 4,-1.7 2,-0.2 -2,-0.2 0.891 114.1 48.8 -62.2 -42.2 21.8 11.2 21.8 102 133 A E H X S+ 0 0 86 -4,-2.6 4,-2.0 2,-0.2 5,-0.2 0.907 111.3 50.1 -64.7 -45.5 20.1 7.7 21.7 103 134 A A H X S+ 0 0 0 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.935 111.2 49.6 -58.3 -47.8 19.2 8.2 17.9 104 135 A L H X S+ 0 0 21 -4,-2.5 4,-2.9 2,-0.2 -1,-0.2 0.847 106.6 54.9 -58.3 -38.9 22.8 9.1 17.1 105 136 A A H X S+ 0 0 50 -4,-1.7 4,-1.8 2,-0.2 -1,-0.2 0.947 113.9 40.0 -63.6 -46.4 24.3 6.1 19.0 106 137 A D H X S+ 0 0 33 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.855 112.5 56.9 -73.8 -26.9 22.2 3.6 17.0 107 138 A F H X S+ 0 0 0 -4,-2.4 4,-2.8 -5,-0.2 5,-0.2 0.955 108.1 47.9 -68.2 -45.8 22.8 5.6 13.8 108 139 A D H X S+ 0 0 52 -4,-2.9 4,-2.3 1,-0.2 -1,-0.2 0.885 109.6 52.2 -58.4 -39.1 26.5 5.3 14.3 109 140 A S H X S+ 0 0 55 -4,-1.8 4,-0.8 2,-0.2 -1,-0.2 0.909 109.2 51.0 -58.9 -44.9 26.1 1.5 15.0 110 141 A F H >X S+ 0 0 0 -4,-2.3 3,-1.1 1,-0.2 4,-0.6 0.958 112.2 45.7 -59.4 -50.2 24.2 1.2 11.7 111 142 A L H >< S+ 0 0 40 -4,-2.8 3,-1.1 1,-0.2 -1,-0.2 0.869 107.1 59.1 -58.9 -40.3 26.9 3.1 9.7 112 143 A N H 3< S+ 0 0 134 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.681 100.6 56.2 -65.7 -17.6 29.7 1.0 11.3 113 144 A L H << S+ 0 0 44 -3,-1.1 -1,-0.2 -4,-0.8 -2,-0.2 0.644 83.6 107.5 -89.1 -9.6 28.2 -2.2 10.1 114 145 A L << 0 0 34 -3,-1.1 -3,-0.0 -4,-0.6 -52,-0.0 -0.303 360.0 360.0 -71.5 146.2 28.3 -1.1 6.4 115 146 A P 0 0 93 0, 0.0 -1,-0.1 0, 0.0 -108,-0.1 0.790 360.0 360.0 -64.9 360.0 30.8 -2.7 4.2