==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-FEB-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER APOPTOSIS 05-OCT-12 4BD8 . COMPND 2 MOLECULE: APOPTOSIS REGULATOR BAX; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR P.E.CZABOTAR,D.WESTPHAL,J.M.ADAMS,P.M.COLMAN . 566 10 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27723.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 429 75.8 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 . 10 1.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 66 11.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 340 60.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 13 2.3 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 2 2 2 1 2 0 1 1 1 0 0 0 1 3 1 2 0 1 0 0 0 0 0 0 0 0 4 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 G 0 0 99 0, 0.0 5,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 -11.3 -24.8 -5.6 38.3 2 12 A G > - 0 0 23 3,-0.2 3,-2.3 1,-0.1 6,-0.4 -0.277 360.0-115.7 143.4 129.8 -22.4 -7.9 36.4 3 13 A P T 3 S+ 0 0 92 0, 0.0 285,-0.3 0, 0.0 286,-0.1 0.786 121.9 41.4 -54.8 -31.3 -19.8 -7.3 33.7 4 14 A T T 3 S+ 0 0 65 283,-0.1 2,-0.3 -3,-0.1 283,-0.1 0.337 89.7 113.4 -98.2 4.0 -21.9 -9.4 31.3 5 15 A S S <> S- 0 0 24 -3,-2.3 4,-2.6 1,-0.1 5,-0.2 -0.594 71.7-131.8 -77.6 138.8 -25.2 -7.9 32.5 6 16 A S H > S+ 0 0 46 -2,-0.3 4,-2.3 1,-0.2 5,-0.2 0.789 106.5 59.3 -60.8 -29.9 -26.9 -5.8 29.7 7 17 A E H > S+ 0 0 93 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.986 110.3 39.9 -59.1 -57.5 -27.4 -3.0 32.3 8 18 A Q H > S+ 0 0 56 -6,-0.4 4,-2.6 1,-0.2 -2,-0.2 0.874 114.8 53.7 -63.5 -37.0 -23.7 -2.7 32.9 9 19 A I H X S+ 0 0 0 -4,-2.6 4,-2.8 -7,-0.2 -1,-0.2 0.922 113.2 41.4 -65.1 -42.6 -22.8 -3.1 29.3 10 20 A M H X S+ 0 0 15 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.875 113.7 52.5 -74.6 -37.2 -25.1 -0.4 28.1 11 21 A K H X S+ 0 0 87 -4,-2.7 4,-1.7 -5,-0.2 -2,-0.2 0.947 114.1 43.5 -62.0 -43.6 -24.2 1.9 31.0 12 22 A T H X S+ 0 0 11 -4,-2.6 4,-2.7 -5,-0.2 5,-0.3 0.930 111.6 53.5 -68.4 -44.2 -20.5 1.4 30.1 13 23 A G H X S+ 0 0 0 -4,-2.8 4,-2.6 1,-0.2 5,-0.2 0.900 107.8 52.0 -54.2 -44.5 -21.2 1.8 26.3 14 24 A A H X S+ 0 0 36 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.885 112.2 44.6 -60.2 -43.4 -22.9 5.1 27.0 15 25 A L H X S+ 0 0 89 -4,-1.7 4,-2.6 2,-0.2 -2,-0.2 0.910 114.8 47.7 -67.7 -47.5 -20.0 6.6 29.0 16 26 A L H X S+ 0 0 1 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.932 114.2 47.6 -56.8 -47.4 -17.4 5.4 26.5 17 27 A L H X S+ 0 0 0 -4,-2.6 4,-2.6 -5,-0.3 5,-0.2 0.897 112.0 48.8 -64.6 -42.9 -19.3 6.7 23.6 18 28 A Q H X S+ 0 0 83 -4,-2.0 4,-2.3 -5,-0.2 -1,-0.2 0.946 114.3 45.2 -64.9 -46.9 -19.9 10.1 25.2 19 29 A G H X S+ 0 0 31 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.865 111.7 53.5 -62.8 -37.7 -16.3 10.5 26.2 20 30 A F H X S+ 0 0 10 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.946 110.4 45.8 -60.6 -53.4 -15.2 9.4 22.7 21 31 A I H X S+ 0 0 5 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.890 110.7 55.2 -57.0 -39.7 -17.4 12.0 21.0 22 32 A Q H X S+ 0 0 127 -4,-2.3 4,-1.9 -5,-0.2 -2,-0.2 0.925 108.7 46.3 -62.7 -44.6 -16.1 14.6 23.5 23 33 A D H X S+ 0 0 53 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.950 112.9 49.2 -61.1 -50.1 -12.4 14.0 22.7 24 34 A R H < S+ 0 0 10 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.844 111.9 49.3 -59.2 -36.2 -13.0 14.0 18.9 25 35 A A H < S+ 0 0 45 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.847 105.7 58.3 -72.8 -33.6 -15.0 17.2 19.2 26 36 A G H < 0 0 69 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.919 360.0 360.0 -60.0 -46.5 -12.2 18.8 21.2 27 37 A R < 0 0 144 -4,-1.8 -3,-0.1 -5,-0.1 -4,-0.0 0.398 360.0 360.0 -82.9 360.0 -9.6 18.3 18.6 28 ! 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 29 53 A D > 0 0 143 0, 0.0 4,-1.3 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0-148.1 -13.5 5.5 37.4 30 54 A A H > + 0 0 79 2,-0.2 4,-1.8 3,-0.1 5,-0.2 0.909 360.0 44.7 -83.3 -48.4 -10.4 3.2 37.1 31 55 A S H > S+ 0 0 69 1,-0.2 4,-1.4 2,-0.2 -1,-0.1 0.891 118.9 46.3 -58.2 -41.1 -12.0 0.4 35.2 32 56 A T H > S+ 0 0 22 2,-0.2 4,-2.8 1,-0.2 -2,-0.2 0.855 106.8 55.1 -77.2 -36.6 -13.6 2.9 32.9 33 57 A K H X S+ 0 0 40 -4,-1.3 4,-1.8 2,-0.2 -1,-0.2 0.914 107.4 51.3 -63.1 -44.0 -10.6 5.1 32.3 34 58 A K H X S+ 0 0 128 -4,-1.8 4,-1.9 1,-0.2 -1,-0.2 0.898 111.4 47.6 -58.6 -42.5 -8.6 2.1 31.1 35 59 A L H X S+ 0 0 3 -4,-1.4 4,-2.7 1,-0.2 -2,-0.2 0.930 108.7 54.8 -64.0 -43.6 -11.4 1.3 28.7 36 60 A S H X S+ 0 0 49 -4,-2.8 4,-2.1 1,-0.2 -1,-0.2 0.817 107.9 50.8 -56.5 -37.4 -11.5 4.9 27.5 37 61 A E H X S+ 0 0 116 -4,-1.8 4,-2.6 2,-0.2 -1,-0.2 0.923 110.0 45.8 -70.7 -49.5 -7.8 4.7 26.7 38 62 A S H X S+ 0 0 15 -4,-1.9 4,-2.7 2,-0.2 5,-0.2 0.918 113.4 52.6 -58.0 -42.5 -7.9 1.5 24.6 39 63 A L H X S+ 0 0 3 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.925 108.3 49.5 -60.8 -44.9 -10.9 3.0 22.9 40 64 A K H X S+ 0 0 92 -4,-2.1 4,-2.9 2,-0.2 -1,-0.2 0.935 110.9 51.2 -57.8 -45.8 -9.0 6.2 22.1 41 65 A R H X S+ 0 0 64 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.962 112.4 44.1 -55.9 -52.2 -6.1 4.1 20.7 42 66 A I H X S+ 0 0 1 -4,-2.7 4,-1.9 1,-0.2 -1,-0.2 0.878 113.3 51.7 -65.8 -37.4 -8.4 2.1 18.4 43 67 A G H X S+ 0 0 0 -4,-2.7 4,-0.9 -5,-0.2 -1,-0.2 0.909 110.0 49.7 -61.2 -44.1 -10.2 5.2 17.3 44 68 A D H >< S+ 0 0 62 -4,-2.9 3,-0.7 1,-0.2 4,-0.4 0.908 109.6 51.1 -59.8 -45.1 -6.8 6.9 16.5 45 69 A E H >< S+ 0 0 72 -4,-2.6 3,-1.4 1,-0.2 -1,-0.2 0.870 103.3 60.1 -59.9 -38.2 -5.7 3.8 14.5 46 70 A L H >< S+ 0 0 3 -4,-1.9 3,-2.5 1,-0.2 -1,-0.2 0.791 86.1 75.9 -63.2 -28.2 -9.0 3.9 12.5 47 71 A D T << S+ 0 0 58 -4,-0.9 -1,-0.2 -3,-0.7 -2,-0.2 0.775 105.0 37.0 -51.3 -29.9 -8.1 7.5 11.2 48 72 A S T < S+ 0 0 84 -3,-1.4 2,-1.1 -4,-0.4 -1,-0.3 0.092 85.0 114.9-112.1 20.3 -5.7 5.8 8.9 49 73 A N <> - 0 0 17 -3,-2.5 4,-3.0 1,-0.2 5,-0.1 -0.779 48.8-170.1 -88.3 97.9 -7.9 2.7 8.2 50 74 A M H > S+ 0 0 108 -2,-1.1 4,-3.5 1,-0.2 5,-0.2 0.829 79.8 56.1 -69.8 -33.4 -8.4 3.5 4.5 51 75 A E H > S+ 0 0 50 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.968 113.4 42.2 -57.6 -52.0 -11.1 0.9 4.0 52 76 A L H > S+ 0 0 1 246,-0.2 4,-2.4 1,-0.2 5,-0.2 0.940 114.2 53.6 -57.9 -46.1 -13.1 2.5 6.8 53 77 A Q H X S+ 0 0 54 -4,-3.0 4,-2.0 -7,-0.2 -2,-0.2 0.907 110.3 45.2 -58.5 -46.6 -12.2 5.9 5.4 54 78 A R H X S+ 0 0 162 -4,-3.5 4,-2.4 2,-0.2 -1,-0.2 0.944 110.4 55.2 -58.5 -49.4 -13.5 5.0 1.9 55 79 A M H < S+ 0 0 37 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.884 112.4 42.1 -53.1 -43.8 -16.7 3.5 3.3 56 80 A I H >< S+ 0 0 16 -4,-2.4 3,-1.2 1,-0.2 -1,-0.2 0.865 112.1 56.0 -69.9 -36.4 -17.4 6.8 5.2 57 81 A A H 3< S+ 0 0 81 -4,-2.0 -2,-0.2 1,-0.3 -1,-0.2 0.841 101.2 56.4 -66.2 -35.8 -16.4 8.9 2.1 58 82 A A T 3< S+ 0 0 95 -4,-2.4 2,-0.4 -5,-0.1 -1,-0.3 0.465 98.6 82.7 -76.2 -2.3 -18.9 7.1 -0.2 59 83 A V S < S- 0 0 21 -3,-1.2 2,-1.3 -5,-0.2 3,-0.1 -0.836 86.4-117.9-110.6 140.2 -21.7 8.1 2.2 60 84 A D > + 0 0 93 -2,-0.4 3,-0.8 1,-0.2 7,-0.1 -0.633 32.7 178.7 -72.0 95.2 -23.6 11.3 2.5 61 85 A T T 3 + 0 0 25 -2,-1.3 -1,-0.2 1,-0.2 39,-0.1 0.632 69.6 74.0 -75.0 -12.6 -22.7 12.4 6.0 62 86 A D T 3 S+ 0 0 64 1,-0.3 -1,-0.2 2,-0.1 3,-0.1 0.673 95.8 50.0 -78.0 -18.9 -24.7 15.6 5.8 63 87 A S X> + 0 0 45 -3,-0.8 4,-0.7 1,-0.1 3,-0.6 -0.648 69.0 166.6-115.2 75.2 -28.0 13.7 6.1 64 88 A P H >> + 0 0 29 0, 0.0 4,-2.3 0, 0.0 3,-0.7 0.831 69.8 59.8 -60.7 -38.0 -27.2 11.6 9.2 65 89 A R H 34 S+ 0 0 164 1,-0.2 4,-0.4 2,-0.2 -2,-0.0 0.883 108.3 43.7 -58.2 -41.3 -30.8 10.5 9.8 66 90 A E H <4 S+ 0 0 76 -3,-0.6 -1,-0.2 1,-0.2 4,-0.2 0.659 123.2 36.2 -76.9 -14.5 -31.1 8.8 6.4 67 91 A V H S+ 0 0 69 -4,-0.4 4,-2.8 1,-0.2 -1,-0.2 0.863 115.2 53.0 -66.0 -35.4 -28.8 2.7 10.5 70 94 A R H > S+ 0 0 140 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.941 114.7 40.1 -62.4 -51.4 -28.0 1.6 6.9 71 95 A V H X S+ 0 0 6 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.902 115.3 52.0 -65.9 -43.9 -24.3 2.0 7.2 72 96 A A H X S+ 0 0 0 -4,-2.8 4,-0.6 -5,-0.3 -2,-0.2 0.954 113.1 44.7 -56.1 -50.8 -24.2 0.6 10.7 73 97 A A H >< S+ 0 0 34 -4,-2.8 3,-1.2 1,-0.2 -2,-0.2 0.907 110.4 56.1 -58.3 -43.0 -26.1 -2.5 9.5 74 98 A D H >< S+ 0 0 90 -4,-2.5 3,-1.3 1,-0.2 4,-0.2 0.872 100.1 59.1 -57.2 -39.8 -23.8 -2.6 6.5 75 99 A M H 3< S+ 0 0 3 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.694 118.2 30.3 -62.9 -20.8 -20.7 -2.8 8.8 76 100 A F T X< S+ 0 0 0 -3,-1.2 3,-1.5 -4,-0.6 -1,-0.3 0.070 83.6 116.4-126.7 21.0 -22.0 -6.0 10.4 77 101 A S T < + 0 0 85 -3,-1.3 -2,-0.1 1,-0.3 -3,-0.1 0.686 68.4 63.3 -70.2 -17.8 -23.9 -7.4 7.4 78 102 A D T 3 S- 0 0 80 -4,-0.2 -1,-0.3 2,-0.2 3,-0.1 0.301 110.5-116.7 -89.8 11.0 -21.7 -10.5 7.2 79 103 A G S < S+ 0 0 47 -3,-1.5 2,-0.2 1,-0.2 -2,-0.1 0.306 75.5 124.3 75.6 -10.2 -22.8 -11.7 10.6 80 104 A N - 0 0 100 2,-0.0 2,-0.4 0, 0.0 -1,-0.2 -0.475 40.3-165.2 -84.7 154.8 -19.2 -11.3 12.0 81 105 A F + 0 0 64 -2,-0.2 2,-0.3 -3,-0.1 -5,-0.0 -0.996 16.1 154.9-138.3 143.0 -18.1 -9.3 15.1 82 106 A N >> - 0 0 46 -2,-0.4 4,-1.7 1,-0.0 3,-0.8 -0.957 52.7-104.0-154.8 163.5 -14.8 -8.0 16.5 83 107 A W H 3> S+ 0 0 13 -2,-0.3 4,-2.8 1,-0.3 5,-0.2 0.826 117.5 60.0 -58.5 -34.2 -13.8 -5.1 18.8 84 108 A G H 3> S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 -1,-0.3 0.886 106.5 46.5 -59.7 -39.3 -12.4 -3.1 15.8 85 109 A R H <> S+ 0 0 10 -3,-0.8 4,-1.5 2,-0.2 -1,-0.2 0.840 110.2 53.1 -74.8 -30.8 -15.8 -3.1 14.2 86 110 A V H X S+ 0 0 1 -4,-1.7 4,-1.5 2,-0.2 3,-0.5 0.958 111.9 45.0 -65.9 -49.1 -17.5 -2.1 17.4 87 111 A V H X S+ 0 0 1 -4,-2.8 4,-2.6 1,-0.2 3,-0.3 0.924 106.6 60.9 -58.4 -42.2 -15.1 0.8 17.7 88 112 A A H X S+ 0 0 0 -4,-2.5 4,-2.7 1,-0.2 -1,-0.2 0.820 101.6 53.7 -55.3 -35.2 -15.7 1.6 14.0 89 113 A L H X S+ 0 0 0 -4,-1.5 4,-2.5 -3,-0.5 -1,-0.2 0.908 110.3 45.2 -62.1 -45.8 -19.4 2.1 14.8 90 114 A F H X S+ 0 0 1 -4,-1.5 4,-2.1 -3,-0.3 -2,-0.2 0.871 113.0 52.9 -64.2 -35.8 -18.5 4.6 17.6 91 115 A Y H X S+ 0 0 2 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.931 109.5 47.4 -66.3 -47.5 -16.0 6.2 15.1 92 116 A F H X S+ 0 0 1 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.925 110.6 51.5 -57.0 -50.6 -18.8 6.6 12.5 93 117 A A H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.924 110.2 50.2 -51.6 -46.8 -21.2 8.1 15.0 94 118 A S H X S+ 0 0 2 -4,-2.1 4,-2.7 1,-0.2 -1,-0.2 0.861 106.9 54.5 -62.7 -40.2 -18.5 10.6 16.0 95 119 A K H X S+ 0 0 48 -4,-2.0 4,-2.7 2,-0.2 -1,-0.2 0.909 106.8 50.9 -58.6 -45.1 -17.9 11.5 12.3 96 120 A L H X S+ 0 0 1 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.912 110.8 49.3 -62.3 -41.2 -21.6 12.3 11.9 97 121 A V H X S+ 0 0 1 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.938 113.5 44.7 -60.2 -51.3 -21.5 14.5 15.0 98 122 A L H X S+ 0 0 52 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.881 112.3 53.0 -63.2 -37.3 -18.4 16.4 13.8 99 123 A K H X S+ 0 0 76 -4,-2.7 4,-1.2 -5,-0.2 -1,-0.2 0.919 111.0 46.5 -65.2 -40.3 -19.9 16.7 10.3 100 124 A A H X>S+ 0 0 9 -4,-2.3 4,-3.1 1,-0.2 5,-0.5 0.898 113.1 49.5 -67.2 -41.2 -23.0 18.2 11.7 101 125 A L H X5S+ 0 0 37 -4,-2.5 4,-1.3 1,-0.2 -2,-0.2 0.899 109.1 51.6 -61.3 -43.7 -21.1 20.6 14.0 102 126 A S H <5S+ 0 0 71 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.754 123.2 29.8 -73.7 -21.1 -18.9 21.8 11.1 103 127 A T H X5S+ 0 0 48 -4,-1.2 4,-1.8 -5,-0.2 -2,-0.2 0.873 122.9 42.3 -97.3 -53.0 -21.9 22.5 8.9 104 128 A K H X5S+ 0 0 85 -4,-3.1 4,-2.7 -5,-0.2 -3,-0.2 0.820 111.2 55.1 -69.3 -34.3 -24.8 23.5 11.3 105 129 A V H X S+ 0 0 5 0, 0.0 4,-2.5 0, 0.0 -2,-0.2 0.895 116.5 51.0 -57.9 -37.0 -21.4 28.0 10.9 107 131 A E H X S+ 0 0 110 -4,-1.8 4,-2.7 2,-0.2 -2,-0.2 0.905 109.4 49.6 -64.1 -44.8 -24.9 28.0 9.3 108 132 A L H X S+ 0 0 26 -4,-2.7 4,-1.9 1,-0.2 -1,-0.2 0.948 114.3 45.3 -58.8 -49.2 -26.5 28.9 12.6 109 133 A I H X S+ 0 0 8 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.899 112.6 50.3 -62.9 -43.2 -24.0 31.8 13.1 110 134 A R H X S+ 0 0 84 -4,-2.5 4,-2.4 -5,-0.2 -2,-0.2 0.920 108.2 52.9 -63.2 -46.2 -24.3 33.0 9.6 111 135 A T H X S+ 0 0 66 -4,-2.7 4,-1.9 2,-0.2 -1,-0.2 0.900 111.9 45.3 -51.1 -48.0 -28.1 33.1 9.7 112 136 A I H X S+ 0 0 1 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.877 111.8 51.3 -68.4 -38.1 -28.0 35.2 13.0 113 137 A M H X S+ 0 0 7 -4,-2.3 4,-2.7 1,-0.2 5,-0.3 0.886 106.9 57.8 -61.8 -37.3 -25.3 37.5 11.4 114 138 A G H X S+ 0 0 36 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.942 106.8 44.9 -56.9 -51.5 -27.7 37.8 8.5 115 139 A W H X S+ 0 0 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L G < S+ 0 0 64 -3,-2.1 2,-0.4 1,-0.3 -1,-0.3 0.719 101.4 54.7 -75.2 -20.2 -13.3 55.3 18.5 139 163 A S G < S+ 0 0 92 -3,-2.0 2,-0.3 -4,-0.4 -1,-0.3 -0.537 86.8 100.3-109.0 61.3 -14.8 58.4 20.0 140 164 A Y < + 0 0 31 -3,-0.6 56,-0.0 -2,-0.4 96,-0.0 -0.917 23.6 150.9-147.1 122.1 -17.4 56.8 22.2 141 165 A F + 0 0 163 -2,-0.3 2,-0.1 2,-0.1 -1,-0.1 -0.009 49.2 100.9-140.1 22.3 -16.9 56.3 25.9 142 166 A G - 0 0 38 0, 0.0 -2,-0.1 0, 0.0 0, 0.0 -0.239 63.9-128.5 -91.7-172.4 -20.5 56.4 27.0 143 167 A T - 0 0 87 -2,-0.1 2,-0.2 56,-0.0 96,-0.1 -0.992 25.9-111.0-140.7 141.8 -22.9 53.6 27.9 144 168 A P - 0 0 4 0, 0.0 2,-0.3 0, 0.0 62,-0.2 -0.462 30.4-176.5 -78.6 141.1 -26.4 53.1 26.5 145 169 A T 0 0 80 -2,-0.2 94,-0.1 60,-0.1 58,-0.0 -0.837 360.0 360.0-120.0 164.1 -29.5 53.5 28.5 146 170 A W 0 0 68 -2,-0.3 83,-0.1 84,-0.0 60,-0.0 -0.354 360.0 360.0-130.1 360.0 -33.1 52.8 27.4 147 !* 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 0.0 148 12 B G > 0 0 70 0, 0.0 3,-1.3 0, 0.0 6,-0.4 0.000 360.0 360.0 360.0 147.0 -15.9 56.2 0.7 149 13 B P T 3 + 0 0 90 0, 0.0 -15,-0.3 0, 0.0 -14,-0.1 0.747 360.0 44.4 -68.0 -19.8 -16.1 55.8 4.5 150 14 B T T 3 S+ 0 0 65 -17,-0.1 2,-0.2 4,-0.1 -17,-0.1 0.335 86.1 115.2-103.8 4.1 -19.7 56.9 4.4 151 15 B S S <> S- 0 0 42 -3,-1.3 4,-2.4 1,-0.1 3,-0.5 -0.570 73.0-127.2 -76.1 138.5 -20.8 54.7 1.4 152 16 B S H > S+ 0 0 41 -2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.742 108.3 60.5 -56.0 -24.2 -23.3 52.0 2.3 153 17 B E H > S+ 0 0 110 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.936 109.4 38.6 -71.4 -46.6 -20.9 49.5 0.6 154 18 B Q H > S+ 0 0 69 -3,-0.5 4,-2.9 -6,-0.4 5,-0.3 0.881 115.9 53.1 -70.7 -37.2 -18.0 50.1 3.0 155 19 B I H X S+ 0 0 1 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.945 114.3 42.0 -63.1 -45.2 -20.3 50.5 6.0 156 20 B M H X S+ 0 0 35 -4,-2.1 4,-2.2 -5,-0.2 -2,-0.2 0.887 116.4 48.0 -69.1 -39.9 -21.9 47.1 5.3 157 21 B K H X S+ 0 0 100 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.947 116.6 42.4 -67.2 -48.3 -18.7 45.4 4.4 158 22 B T H X S+ 0 0 29 -4,-2.9 4,-3.1 2,-0.2 5,-0.2 0.915 111.9 55.5 -63.6 -44.3 -16.9 46.7 7.5 159 23 B G H X S+ 0 0 0 -4,-2.7 4,-2.6 -5,-0.3 -2,-0.2 0.897 108.8 47.5 -55.5 -45.0 -20.0 46.0 9.7 160 24 B A H X S+ 0 0 30 -4,-2.2 4,-2.7 2,-0.2 -1,-0.2 0.918 112.3 49.0 -63.0 -43.9 -20.0 42.3 8.6 161 25 B L H X S+ 0 0 24 -4,-2.0 4,-2.3 1,-0.2 5,-0.2 0.953 114.7 45.8 -61.2 -46.8 -16.2 42.0 9.2 162 26 B L H X S+ 0 0 1 -4,-3.1 4,-1.9 2,-0.2 -2,-0.2 0.886 113.3 49.1 -60.7 -43.2 -16.6 43.6 12.7 163 27 B L H X S+ 0 0 0 -4,-2.6 4,-2.6 -5,-0.2 5,-0.3 0.948 111.5 49.4 -63.6 -47.5 -19.7 41.5 13.5 164 28 B Q H X S+ 0 0 14 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.930 113.5 44.6 -57.5 -49.1 -18.0 38.2 12.5 165 29 B G H X S+ 0 0 9 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.827 113.1 52.7 -67.9 -31.3 -14.8 39.0 14.5 166 30 B F H X S+ 0 0 14 -4,-1.9 4,-1.4 -5,-0.2 -1,-0.2 0.864 111.3 44.4 -73.5 -40.1 -16.9 40.1 17.5 167 31 B I H X S+ 0 0 1 -4,-2.6 4,-0.9 2,-0.2 -2,-0.2 0.887 112.2 53.9 -67.7 -37.8 -18.9 36.9 17.5 168 32 B Q H >< S+ 0 0 59 -4,-2.4 3,-0.8 -5,-0.3 -2,-0.2 0.932 107.6 49.1 -65.0 -44.6 -15.8 34.7 17.0 169 33 B D H 3< S+ 0 0 133 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.880 112.3 48.2 -60.7 -40.5 -14.0 36.3 20.0 170 34 B R H 3< 0 0 55 -4,-1.4 -1,-0.2 -5,-0.1 -2,-0.2 0.563 360.0 360.0 -78.3 -8.5 -17.1 35.8 22.3 171 35 B A << 0 0 77 -4,-0.9 -3,-0.2 -3,-0.8 -2,-0.1 0.420 360.0 360.0-126.8 360.0 -17.4 32.1 21.1 172 ! 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 0.0 173 43 B P 0 0 124 0, 0.0 2,-1.3 0, 0.0 -71,-0.0 0.000 360.0 360.0 360.0 54.5 -15.5 28.1 13.9 174 44 B E + 0 0 78 1,-0.2 -69,-0.0 2,-0.1 0, 0.0 -0.598 360.0 178.1 -85.0 92.6 -14.9 28.3 10.1 175 45 B L - 0 0 4 -2,-1.3 -1,-0.2 1,-0.1 3,-0.1 0.567 32.7-138.3 -73.1 -5.8 -17.6 30.6 8.8 176 46 B A + 0 0 91 1,-0.1 2,-0.1 -3,-0.0 -1,-0.1 0.787 63.5 118.7 49.5 34.0 -16.2 30.3 5.3 177 47 B L S S- 0 0 84 1,-0.2 -1,-0.1 -13,-0.0 3,-0.0 -0.260 79.8 -53.3-101.4-166.6 -16.7 34.1 4.7 178 48 B D - 0 0 114 -2,-0.1 -1,-0.2 -3,-0.1 2,-0.1 -0.570 67.8-110.1 -66.4 135.8 -14.1 36.8 3.9 179 49 B P - 0 0 109 0, 0.0 -1,-0.1 0, 0.0 -18,-0.1 -0.451 36.0 -97.8 -70.2 145.2 -11.4 36.6 6.5 180 50 B V - 0 0 34 -2,-0.1 2,-0.1 -19,-0.1 -18,-0.0 -0.464 44.3-116.4 -63.2 126.3 -11.2 39.5 9.0 181 51 B P - 0 0 37 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 -0.379 15.6-152.6 -68.0 143.0 -8.6 42.0 7.8 182 52 B Q + 0 0 176 4,-0.1 -2,-0.1 -2,-0.1 0, 0.0 0.273 52.3 123.6-103.1 9.5 -5.6 42.5 10.1 183 53 B D S > S- 0 0 82 1,-0.1 4,-2.0 4,-0.0 3,-0.2 -0.212 76.5-103.1 -68.2 163.3 -4.7 46.1 9.0 184 54 B A H > S+ 0 0 77 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.857 115.5 57.4 -56.6 -42.7 -4.6 48.9 11.6 185 55 B S H > S+ 0 0 66 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.922 110.9 41.4 -58.7 -47.2 -7.9 50.4 10.8 186 56 B T H > S+ 0 0 17 -3,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.890 112.4 55.9 -68.5 -41.7 -9.9 47.2 11.4 187 57 B K H X S+ 0 0 30 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.888 105.3 51.5 -56.6 -45.4 -7.9 46.4 14.5 188 58 B K H X S+ 0 0 102 -4,-2.4 4,-1.6 1,-0.2 -1,-0.2 0.900 112.4 46.4 -60.6 -41.9 -8.7 49.8 16.1 189 59 B L H X S+ 0 0 6 -4,-1.5 4,-2.3 -5,-0.2 -2,-0.2 0.924 110.0 52.6 -68.3 -43.7 -12.4 49.2 15.5 190 60 B S H X S+ 0 0 32 -4,-2.7 4,-1.5 1,-0.2 -1,-0.2 0.857 110.1 49.3 -59.1 -37.6 -12.3 45.6 16.8 191 61 B E H X S+ 0 0 101 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.847 109.3 51.0 -72.9 -34.7 -10.7 46.8 20.0 192 62 B S H X S+ 0 0 3 -4,-1.6 4,-2.2 1,-0.2 5,-0.2 0.887 109.7 52.0 -66.8 -39.3 -13.2 49.6 20.5 193 63 B L H X S+ 0 0 2 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.849 108.8 50.4 -60.4 -39.4 -16.0 47.0 20.0 194 64 B K H X S+ 0 0 124 -4,-1.5 4,-3.2 2,-0.2 5,-0.2 0.924 110.1 48.6 -71.1 -43.2 -14.4 44.8 22.7 195 65 B R H X S+ 0 0 94 -4,-1.9 4,-1.7 2,-0.2 -2,-0.2 0.921 116.4 41.8 -64.6 -46.4 -14.1 47.6 25.3 196 66 B I H X S+ 0 0 10 -4,-2.2 4,-1.3 1,-0.2 -1,-0.2 0.906 116.9 50.7 -67.6 -38.2 -17.7 48.8 24.8 197 67 B G H X S+ 0 0 0 -4,-2.3 4,-0.6 -5,-0.2 3,-0.4 0.911 106.9 51.9 -63.9 -44.8 -18.9 45.1 24.7 198 68 B D H >< S+ 0 0 74 -4,-3.2 3,-1.3 1,-0.3 4,-0.3 0.906 107.6 53.8 -62.5 -39.7 -17.1 44.1 27.8 199 69 B E H >< S+ 0 0 110 -4,-1.7 3,-1.3 1,-0.3 -1,-0.3 0.824 98.7 64.5 -63.2 -31.5 -18.8 47.0 29.6 200 70 B L H >< S+ 0 0 3 -4,-1.3 3,-1.4 -3,-0.4 -1,-0.3 0.661 81.6 78.6 -68.6 -18.7 -22.2 45.7 28.4 201 71 B D T << S+ 0 0 72 -3,-1.3 -1,-0.3 -4,-0.6 -2,-0.2 0.811 102.3 38.2 -55.2 -31.3 -21.7 42.5 30.5 202 72 B S T < S+ 0 0 82 -3,-1.3 2,-1.0 -4,-0.3 -1,-0.3 0.185 87.4 108.6-108.0 14.8 -22.7 44.7 33.5 203 73 B N <> - 0 0 21 -3,-1.4 4,-1.9 1,-0.2 3,-0.2 -0.806 46.1-177.0 -90.4 101.4 -25.4 46.7 31.7 204 74 B M H > S+ 0 0 114 -2,-1.0 4,-2.4 1,-0.2 -1,-0.2 0.724 75.9 63.0 -79.8 -21.8 -28.5 45.2 33.3 205 75 B E H > S+ 0 0 68 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.948 111.0 42.8 -57.6 -45.9 -31.1 47.2 31.2 206 76 B L H > S+ 0 0 0 2,-0.2 4,-1.6 1,-0.2 -2,-0.2 0.902 110.9 53.0 -70.1 -41.9 -29.6 45.4 28.3 207 77 B Q H X S+ 0 0 48 -4,-1.9 4,-1.2 1,-0.2 -1,-0.2 0.888 112.4 47.5 -60.4 -37.0 -29.4 42.0 30.1 208 78 B R H >< S+ 0 0 151 -4,-2.4 3,-0.5 1,-0.2 -2,-0.2 0.951 111.2 48.8 -66.1 -49.2 -33.1 42.5 30.8 209 79 B M H 3< S+ 0 0 11 -4,-2.6 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