==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER APOPTOSIS 26-JUN-09 3I1H . COMPND 2 MOLECULE: PROTEIN BFL-1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR R.GUAN,R.XIAO,L.ZHAO,T.ACTON,E.WHITE,C.GELINAS, . 158 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8374.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 125 79.1 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 . 5 3.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 9 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 103 65.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 3.8 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 2 0 0 0 0 0 0 0 0 1 0 2 0 0 0 1 1 1 0 0 0 0 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 4 A C > 0 0 157 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -8.2 23.1 -9.5 -5.5 2 5 A E H > + 0 0 124 1,-0.2 4,-1.7 2,-0.2 3,-0.4 0.919 360.0 35.9 -43.9 -72.3 22.5 -10.9 -2.0 3 6 A F H > S+ 0 0 66 1,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.893 116.7 53.6 -53.3 -48.3 20.8 -8.0 -0.1 4 7 A G H > S+ 0 0 42 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.846 107.0 52.1 -57.3 -38.0 18.8 -6.8 -3.1 5 8 A Y H X S+ 0 0 74 -4,-2.2 4,-1.8 -3,-0.4 -1,-0.2 0.890 112.7 43.9 -66.9 -42.6 17.4 -10.3 -3.7 6 9 A I H X S+ 0 0 4 -4,-1.7 4,-3.3 2,-0.2 5,-0.3 0.921 112.3 53.8 -68.7 -41.8 16.2 -10.6 -0.1 7 10 A Y H X S+ 0 0 57 -4,-2.9 4,-2.6 1,-0.2 -2,-0.2 0.913 107.6 51.0 -56.3 -45.9 14.9 -7.0 -0.3 8 11 A R H X S+ 0 0 119 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.892 112.0 47.5 -61.4 -38.5 12.9 -8.0 -3.4 9 12 A L H X S+ 0 0 2 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.934 112.2 47.5 -69.0 -45.9 11.5 -10.9 -1.5 10 13 A A H X S+ 0 0 0 -4,-3.3 4,-1.7 1,-0.2 -2,-0.2 0.882 114.2 49.4 -62.1 -35.7 10.6 -8.9 1.6 11 14 A Q H X S+ 0 0 32 -4,-2.6 4,-1.5 -5,-0.3 -1,-0.2 0.874 109.6 49.4 -72.8 -36.1 9.0 -6.3 -0.7 12 15 A D H X S+ 0 0 9 -4,-2.1 4,-1.7 1,-0.2 -2,-0.2 0.885 109.4 53.9 -67.8 -39.1 7.0 -8.8 -2.7 13 16 A Y H X S+ 0 0 0 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.908 110.1 44.3 -64.4 -42.3 5.7 -10.4 0.5 14 17 A L H X S+ 0 0 2 -4,-1.7 4,-2.6 2,-0.2 -1,-0.2 0.791 110.5 54.1 -73.5 -27.0 4.3 -7.1 1.9 15 18 A Q H <>S+ 0 0 44 -4,-1.5 5,-3.2 2,-0.2 -1,-0.2 0.830 109.7 50.5 -72.2 -29.5 2.8 -6.0 -1.4 16 19 A X H ><5S+ 0 0 68 -4,-1.7 3,-1.4 3,-0.2 -2,-0.2 0.940 112.6 45.1 -68.6 -49.9 1.0 -9.4 -1.2 17 20 A V H 3<5S+ 0 0 24 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.906 114.6 47.4 -60.6 -43.4 -0.2 -8.7 2.3 18 21 A L T 3<5S- 0 0 28 -4,-2.6 -1,-0.3 -5,-0.1 -2,-0.2 0.271 112.1-125.6 -82.0 11.1 -1.3 -5.1 1.5 19 22 A Q T < 5 + 0 0 180 -3,-1.4 -3,-0.2 1,-0.2 -2,-0.1 0.888 59.4 142.1 44.3 55.6 -3.0 -6.6 -1.5 20 23 A I < 0 0 83 -5,-3.2 -1,-0.2 1,-0.2 -2,-0.1 -0.984 360.0 360.0-127.4 137.7 -1.3 -4.3 -4.1 21 24 A P 0 0 170 0, 0.0 -1,-0.2 0, 0.0 -6,-0.1 0.999 360.0 360.0 -60.4 360.0 -0.1 -5.3 -7.6 22 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 23 30 A P 0 0 77 0, 0.0 -14,-0.0 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0 155.1 7.1 -12.4 -8.9 24 31 A S > - 0 0 50 1,-0.1 4,-2.4 4,-0.0 5,-0.2 -0.179 360.0-103.0 -70.1 166.8 9.7 -15.2 -9.2 25 32 A K H > S+ 0 0 117 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.927 123.4 53.7 -55.7 -47.3 9.1 -18.9 -8.4 26 33 A T H > S+ 0 0 2 1,-0.2 4,-3.0 2,-0.2 -1,-0.2 0.946 110.4 46.5 -51.3 -53.8 10.9 -18.5 -5.1 27 34 A S H > S+ 0 0 1 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.853 111.7 50.0 -60.3 -39.4 8.8 -15.5 -4.1 28 35 A R H X S+ 0 0 151 -4,-2.4 4,-1.8 2,-0.2 -1,-0.2 0.932 112.8 47.7 -66.3 -44.8 5.5 -17.3 -5.1 29 36 A V H X S+ 0 0 14 -4,-3.0 4,-2.1 -5,-0.2 5,-0.2 0.944 114.9 46.4 -60.4 -45.2 6.6 -20.3 -3.0 30 37 A L H X S+ 0 0 1 -4,-3.0 4,-4.2 -5,-0.2 5,-0.4 0.941 108.4 53.7 -62.0 -50.0 7.5 -18.0 -0.0 31 38 A Q H X S+ 0 0 29 -4,-2.8 4,-2.3 1,-0.2 5,-0.2 0.904 110.7 48.5 -52.4 -45.3 4.3 -15.9 -0.1 32 39 A N H X S+ 0 0 127 -4,-1.8 4,-1.3 -5,-0.2 -1,-0.2 0.947 119.4 35.5 -64.0 -49.5 2.3 -19.0 0.1 33 40 A V H X S+ 0 0 21 -4,-2.1 4,-2.0 -5,-0.2 -2,-0.2 0.924 118.8 50.2 -74.0 -40.4 4.2 -20.7 3.0 34 41 A A H X S+ 0 0 0 -4,-4.2 4,-2.4 -5,-0.2 -3,-0.2 0.905 109.9 50.7 -64.6 -39.0 4.9 -17.4 4.8 35 42 A F H X S+ 0 0 78 -4,-2.3 4,-2.1 -5,-0.4 -1,-0.2 0.865 107.4 54.1 -65.8 -36.5 1.2 -16.3 4.7 36 43 A S H X S+ 0 0 65 -4,-1.3 4,-1.5 -5,-0.2 -1,-0.2 0.920 111.4 45.3 -62.2 -43.3 0.2 -19.7 6.0 37 44 A V H X S+ 0 0 2 -4,-2.0 4,-2.6 1,-0.2 -2,-0.2 0.879 108.2 57.8 -66.7 -38.3 2.5 -19.2 9.0 38 45 A Q H X S+ 0 0 1 -4,-2.4 4,-3.0 1,-0.2 -2,-0.2 0.922 105.1 49.9 -58.5 -46.7 1.3 -15.6 9.4 39 46 A K H X S+ 0 0 103 -4,-2.1 4,-1.5 1,-0.2 -1,-0.2 0.912 112.4 48.1 -60.2 -41.2 -2.3 -16.7 9.9 40 47 A E H X S+ 0 0 75 -4,-1.5 4,-1.8 2,-0.2 -1,-0.2 0.886 113.3 46.5 -66.8 -39.9 -1.2 -19.3 12.5 41 48 A V H X S+ 0 0 0 -4,-2.6 4,-2.9 1,-0.2 -2,-0.2 0.921 108.2 58.3 -67.2 -43.5 0.9 -16.7 14.4 42 49 A E H < S+ 0 0 50 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.859 111.3 38.8 -55.6 -41.8 -1.9 -14.2 14.3 43 50 A K H < S+ 0 0 147 -4,-1.5 3,-0.4 -5,-0.2 4,-0.3 0.886 119.8 44.4 -79.6 -38.3 -4.4 -16.4 16.1 44 51 A N H < S+ 0 0 95 -4,-1.8 -2,-0.2 1,-0.2 -3,-0.2 0.852 122.1 35.8 -74.9 -36.6 -2.0 -18.0 18.6 45 52 A L S X S+ 0 0 16 -4,-2.9 4,-1.8 -5,-0.2 3,-0.4 0.203 88.7 120.6-100.6 14.4 -0.1 -14.8 19.6 46 53 A K H >> + 0 0 139 -3,-0.4 4,-1.5 1,-0.2 3,-1.0 0.908 69.9 41.8 -39.4 -79.0 -3.3 -12.7 19.3 47 54 A S H 3> S+ 0 0 96 -4,-0.3 4,-0.6 1,-0.3 -1,-0.2 0.757 114.3 55.9 -47.9 -30.9 -3.9 -11.3 22.8 48 55 A C H 34 S+ 0 0 29 -3,-0.4 3,-0.4 1,-0.2 -1,-0.3 0.870 105.8 47.4 -73.4 -38.9 -0.1 -10.5 23.1 49 56 A L H X< S+ 0 0 16 -4,-1.8 3,-1.3 -3,-1.0 -2,-0.2 0.771 98.9 70.0 -74.6 -26.1 0.2 -8.4 19.9 50 57 A D H 3< S+ 0 0 104 -4,-1.5 -1,-0.2 1,-0.3 -2,-0.2 0.851 90.6 61.5 -58.7 -36.7 -2.9 -6.3 20.7 51 58 A N T 3< S+ 0 0 108 -4,-0.6 2,-0.4 -3,-0.4 -1,-0.3 0.058 93.6 76.4 -82.0 25.8 -1.0 -4.6 23.6 52 59 A V < - 0 0 47 -3,-1.3 2,-0.7 2,-0.0 -1,-0.0 -0.983 66.4-154.6-137.8 124.4 1.6 -3.2 21.2 53 60 A N - 0 0 101 -2,-0.4 2,-1.5 46,-0.0 3,-0.1 -0.882 3.2-160.0-106.2 113.6 1.0 -0.2 19.0 54 61 A V + 0 0 0 -2,-0.7 45,-0.3 1,-0.2 44,-0.1 -0.704 30.3 156.1 -90.4 85.4 3.1 0.1 15.9 55 62 A V + 0 0 47 -2,-1.5 46,-2.1 45,-0.2 47,-0.5 0.510 60.3 18.8 -91.7 -8.2 2.5 3.8 15.4 56 63 A S S > S- 0 0 32 44,-0.2 4,-2.0 -3,-0.1 5,-0.1 -0.964 77.4-108.2-154.9 166.3 5.6 4.5 13.4 57 64 A V H > S+ 0 0 17 -2,-0.3 4,-3.0 2,-0.2 5,-0.2 0.810 117.2 60.4 -67.3 -30.9 8.3 2.8 11.3 58 65 A D H > S+ 0 0 96 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.924 108.0 43.1 -61.7 -46.8 10.8 3.4 14.2 59 66 A T H > S+ 0 0 50 2,-0.2 4,-2.9 1,-0.2 5,-0.3 0.893 113.2 52.7 -64.6 -42.6 8.7 1.4 16.5 60 67 A A H X S+ 0 0 0 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.918 111.7 45.9 -59.7 -45.0 8.2 -1.3 13.8 61 68 A R H X S+ 0 0 65 -4,-3.0 4,-2.4 2,-0.2 -1,-0.2 0.879 114.5 47.8 -65.6 -40.1 11.9 -1.5 13.2 62 69 A T H X S+ 0 0 74 -4,-2.1 4,-2.3 -5,-0.2 -2,-0.2 0.915 113.9 46.3 -66.9 -45.1 12.6 -1.7 17.0 63 70 A L H X S+ 0 0 25 -4,-2.9 4,-2.4 2,-0.2 5,-0.2 0.884 112.2 51.3 -66.6 -39.1 10.0 -4.3 17.6 64 71 A F H X S+ 0 0 0 -4,-2.4 4,-3.2 -5,-0.3 5,-0.2 0.971 111.8 46.1 -62.4 -53.7 11.2 -6.3 14.6 65 72 A N H X S+ 0 0 69 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.871 113.8 48.3 -58.7 -39.6 14.8 -6.3 15.8 66 73 A Q H X S+ 0 0 116 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.950 114.9 45.2 -66.2 -47.6 13.9 -7.2 19.4 67 74 A V H X S+ 0 0 9 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.932 114.5 48.1 -60.8 -46.6 11.6 -10.1 18.3 68 75 A M H X S+ 0 0 0 -4,-3.2 4,-2.3 -5,-0.2 -1,-0.2 0.871 109.6 53.4 -62.2 -39.3 14.2 -11.3 15.8 69 76 A E H X S+ 0 0 134 -4,-2.2 4,-1.1 -5,-0.2 -1,-0.2 0.947 110.7 45.9 -61.9 -48.1 17.0 -11.2 18.4 70 77 A K H < S+ 0 0 72 -4,-2.3 3,-0.3 1,-0.2 4,-0.2 0.886 113.1 51.1 -61.3 -39.7 14.9 -13.3 20.9 71 78 A E H < S+ 0 0 0 -4,-2.3 3,-0.4 1,-0.2 -1,-0.2 0.905 120.0 32.6 -65.8 -41.7 14.0 -15.8 18.2 72 79 A F H >< S+ 0 0 24 -4,-2.3 3,-2.0 1,-0.2 -1,-0.2 0.392 86.2 101.3 -99.5 4.6 17.5 -16.4 16.9 73 80 A E T 3< S+ 0 0 115 -4,-1.1 -1,-0.2 1,-0.3 -2,-0.1 0.697 73.9 66.5 -61.6 -21.1 19.5 -15.9 20.2 74 81 A D T 3 S- 0 0 63 -3,-0.4 -1,-0.3 -4,-0.2 3,-0.1 0.437 110.4-120.1 -81.4 2.3 19.8 -19.7 20.6 75 82 A G < + 0 0 61 -3,-2.0 2,-0.4 1,-0.2 -2,-0.1 0.402 68.8 134.2 78.1 -4.5 22.0 -19.8 17.5 76 83 A I + 0 0 80 -5,-0.2 2,-0.4 5,-0.0 -1,-0.2 -0.644 28.8 178.6 -85.8 133.6 19.7 -22.1 15.5 77 84 A I + 0 0 41 -2,-0.4 2,-0.3 -3,-0.1 3,-0.0 -0.995 11.4 147.6-134.3 128.1 18.9 -21.2 11.9 78 85 A N > - 0 0 11 -2,-0.4 4,-1.8 1,-0.0 3,-0.2 -0.945 57.7-100.4-150.6 165.6 16.6 -23.2 9.5 79 86 A W H > S+ 0 0 15 -2,-0.3 4,-2.0 1,-0.2 5,-0.2 0.830 119.1 60.5 -58.5 -35.8 14.2 -22.5 6.6 80 87 A G H > S+ 0 0 0 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.949 108.3 44.1 -58.0 -47.4 11.2 -22.9 8.9 81 88 A R H > S+ 0 0 2 1,-0.2 4,-0.8 2,-0.2 -2,-0.2 0.847 109.0 55.0 -66.2 -37.5 12.5 -20.0 11.0 82 89 A I H >X S+ 0 0 0 -4,-1.8 4,-1.0 1,-0.2 3,-0.6 0.859 105.0 55.8 -65.4 -33.2 13.5 -17.8 8.0 83 90 A V H 3X S+ 0 0 0 -4,-2.0 4,-2.0 1,-0.2 3,-0.4 0.876 101.1 57.1 -66.0 -36.7 9.9 -18.2 6.9 84 91 A T H 3X S+ 0 0 0 -4,-1.3 4,-2.7 1,-0.2 -1,-0.2 0.725 96.6 64.8 -67.5 -19.5 8.6 -16.8 10.2 85 92 A I H - 0 0 87 -2,-1.4 2,-1.4 1,-0.1 3,-0.8 -0.770 21.2-156.7 -95.9 95.0 3.4 7.6 4.8 105 112 A V T 3 S+ 0 0 111 -2,-1.1 -1,-0.1 1,-0.3 -8,-0.0 0.214 88.2 62.2 -57.8 21.0 2.5 5.2 2.0 106 113 A D T 3 S+ 0 0 105 -2,-1.4 -1,-0.3 2,-0.1 4,-0.0 -0.179 74.4 86.0-140.6 40.7 6.2 4.9 1.3 107 114 A T <> + 0 0 12 -3,-0.8 4,-1.3 2,-0.1 3,-0.4 0.409 69.8 80.8-114.9 -10.6 7.5 3.5 4.6 108 115 A Y H > S+ 0 0 23 1,-0.2 4,-1.5 -4,-0.2 -94,-0.1 0.667 87.3 57.3 -70.9 -18.0 6.8 -0.0 3.5 109 116 A K H > S+ 0 0 80 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.778 103.3 53.2 -81.8 -27.7 10.1 0.1 1.5 110 117 A E H > S+ 0 0 70 -3,-0.4 4,-2.2 2,-0.2 -2,-0.2 0.810 106.8 52.8 -74.6 -31.5 11.9 0.9 4.8 111 118 A I H X S+ 0 0 0 -4,-1.3 4,-2.1 2,-0.2 5,-0.2 0.943 108.0 49.1 -68.6 -46.7 10.3 -2.2 6.4 112 119 A S H X S+ 0 0 0 -4,-1.5 4,-2.3 1,-0.2 -1,-0.2 0.838 109.5 57.3 -60.8 -32.1 11.5 -4.4 3.5 113 120 A Y H X S+ 0 0 105 -4,-1.2 4,-2.9 2,-0.2 -2,-0.2 0.955 108.5 41.2 -66.3 -50.2 14.9 -2.8 4.1 114 121 A F H X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.809 113.1 54.6 -74.7 -19.8 15.3 -3.7 7.7 115 122 A V H X S+ 0 0 0 -4,-2.1 4,-2.4 2,-0.2 5,-0.2 0.956 112.1 44.0 -70.8 -48.2 13.9 -7.2 7.1 116 123 A A H X S+ 0 0 0 -4,-2.3 4,-3.3 1,-0.2 5,-0.3 0.944 111.9 54.5 -58.7 -49.0 16.5 -7.8 4.4 117 124 A E H X S+ 0 0 79 -4,-2.9 4,-2.2 1,-0.2 5,-0.2 0.913 110.9 44.6 -51.2 -48.0 19.2 -6.2 6.6 118 125 A F H X S+ 0 0 18 -4,-2.1 4,-2.2 2,-0.2 5,-0.3 0.962 116.3 45.1 -63.3 -52.3 18.4 -8.6 9.5 119 126 A I H X>S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 5,-0.8 0.916 114.9 48.5 -55.4 -50.8 18.2 -11.7 7.3 120 127 A M H X5S+ 0 0 30 -4,-3.3 4,-1.2 -5,-0.2 5,-0.3 0.969 117.9 38.3 -56.1 -58.1 21.4 -10.8 5.4 121 128 A N H <5S+ 0 0 114 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.731 127.5 33.4 -70.2 -22.3 23.6 -10.1 8.4 122 129 A N H <5S+ 0 0 88 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.649 135.7 13.9-111.3 -16.6 22.2 -12.9 10.6 123 130 A T H X5S+ 0 0 1 -4,-2.5 4,-3.0 -5,-0.3 -3,-0.2 0.378 91.9 103.1-136.9 -1.6 21.4 -15.8 8.4 124 131 A G H X S+ 0 0 137 -5,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.921 113.4 47.2 -70.5 -43.2 25.9 -17.4 5.6 126 133 A W H > S+ 0 0 50 2,-0.2 4,-1.5 1,-0.2 -2,-0.2 0.911 110.6 53.8 -62.8 -42.0 23.7 -20.2 6.7 127 134 A I H ><>S+ 0 0 10 -4,-3.0 5,-2.8 2,-0.2 3,-0.5 0.961 110.8 45.9 -56.2 -51.8 21.4 -19.6 3.7 128 135 A R H ><5S+ 0 0 131 -4,-2.1 3,-1.8 1,-0.2 -2,-0.2 0.936 112.8 49.2 -56.3 -52.1 24.3 -19.8 1.2 129 136 A Q H 3<5S+ 0 0 139 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.700 110.9 52.6 -63.5 -21.0 25.7 -23.0 2.8 130 137 A N T <<5S- 0 0 73 -4,-1.5 -1,-0.3 -3,-0.5 -2,-0.2 0.126 132.0 -82.0-105.1 22.4 22.3 -24.5 2.7 131 138 A G T <>> - 0 0 28 -3,-1.8 4,-1.4 5,-0.1 5,-0.5 0.548 57.9-111.8 98.9 7.8 21.6 -23.9 -1.0 132 139 A G H >X - 0 0 19 -5,-2.8 5,-1.8 3,-0.2 4,-1.0 -0.009 57.1 -54.5 58.8-169.5 20.4 -20.3 -1.2 133 140 A W H 4>S+ 0 0 20 3,-0.2 5,-3.0 2,-0.2 6,-0.3 0.950 136.7 41.9 -72.3 -47.1 16.9 -19.5 -2.2 134 141 A E H 45S+ 0 0 122 1,-0.2 5,-0.3 3,-0.2 -2,-0.2 0.916 128.4 28.2 -69.5 -41.0 16.7 -21.5 -5.4 135 142 A N H <5S+ 0 0 115 -4,-1.4 -3,-0.2 3,-0.1 -1,-0.2 0.446 134.4 28.7-101.0 0.5 18.5 -24.6 -4.3 136 143 A G T X> 0 0 69 0, 0.0 4,-1.1 0, 0.0 3,-0.6 0.000 360.0 360.0 360.0 12.5 10.4 -14.9 25.7 146 73 B Q H 3> - 0 0 129 1,-0.2 4,-1.4 2,-0.2 3,-0.1 -0.067 360.0 -10.1 48.3-139.6 7.2 -13.5 24.2 147 74 B V H 3> S+ 0 0 13 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.858 128.7 62.8 -57.5 -45.8 6.9 -13.4 20.4 148 75 B G H <> S+ 0 0 2 -3,-0.6 4,-1.9 1,-0.2 -1,-0.2 0.934 107.1 41.2 -48.1 -58.7 10.5 -14.3 19.6 149 76 B R H X S+ 0 0 67 -4,-1.1 4,-2.8 1,-0.2 -1,-0.2 0.861 112.8 55.7 -62.5 -35.7 10.4 -17.8 21.2 150 77 B Q H X S+ 0 0 77 -4,-1.4 4,-2.5 1,-0.2 -1,-0.2 0.898 107.4 49.0 -63.0 -40.0 7.0 -18.5 19.8 151 78 B L H X S+ 0 0 0 -4,-2.5 4,-3.0 2,-0.2 -1,-0.2 0.884 110.2 51.7 -66.9 -37.0 8.2 -17.8 16.3 152 79 B A H X S+ 0 0 0 -4,-1.9 4,-3.0 -5,-0.2 5,-0.3 0.959 110.4 48.5 -62.4 -50.8 11.2 -20.1 16.9 153 80 B I H X S+ 0 0 97 -4,-2.8 4,-1.6 2,-0.2 -2,-0.2 0.903 116.1 42.5 -53.6 -49.5 8.8 -22.9 18.1 154 81 B I H X S+ 0 0 9 -4,-2.5 4,-2.7 2,-0.2 5,-0.3 0.909 113.7 53.9 -66.3 -40.5 6.5 -22.4 15.0 155 82 B G H X S+ 0 0 0 -4,-3.0 4,-1.1 1,-0.2 -2,-0.2 0.925 110.8 43.5 -59.5 -47.5 9.6 -22.1 12.7 156 83 B D H X S+ 0 0 37 -4,-3.0 4,-1.5 1,-0.2 -1,-0.2 0.822 112.1 58.4 -67.0 -29.4 11.1 -25.4 14.0 157 84 B D H < S+ 0 0 105 -4,-1.6 -2,-0.2 -5,-0.3 -1,-0.2 0.961 111.6 36.0 -64.8 -52.6 7.6 -26.9 13.7 158 85 B I H < S+ 0 0 41 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.591 110.7 65.1 -78.6 -10.1 7.1 -26.1 9.9 159 86 B N H < 0 0 27 -4,-1.1 -1,-0.2 -5,-0.3 -2,-0.2 0.897 360.0 360.0 -76.4 -40.1 10.8 -26.8 9.2 160 87 B R < 0 0 218 -4,-1.5 -2,-0.2 -3,-0.2 -3,-0.1 0.995 360.0 360.0 -68.4 360.0 10.4 -30.5 10.2