==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER APOPTOSIS 26-SEP-03 1R2I . COMPND 2 MOLECULE: APOPTOSIS REGULATOR BCL-X; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.W.O'NEILL,M.K.MANION,C.D.GIEDT,K.M.KIM,K.Y.ZHANG, . 143 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7421.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 111 77.6 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 18 12.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 87 60.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 4.2 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 1 1 1 0 0 0 0 0 0 1 0 2 0 1 0 0 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 1 A M >> 0 0 50 0, 0.0 4,-2.4 0, 0.0 5,-0.5 0.000 360.0 360.0 360.0 -61.8 34.9 -3.9 74.6 2 2 A S H >5 + 0 0 44 2,-0.2 4,-1.4 1,-0.2 5,-0.1 0.942 360.0 7.5 -45.4 -85.2 36.4 -0.5 75.5 3 3 A Q H >5S+ 0 0 75 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.848 130.3 62.1 -68.6 -36.5 37.3 0.8 72.0 4 4 A S H >5S+ 0 0 42 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.953 107.3 41.1 -54.6 -56.4 35.6 -2.1 70.3 5 5 A N H X5S+ 0 0 1 -4,-2.4 4,-2.7 1,-0.2 -1,-0.2 0.840 112.4 56.8 -63.2 -33.6 32.2 -1.3 71.7 6 6 A R H XS+ 0 0 0 -4,-2.4 5,-3.0 2,-0.2 4,-0.2 0.961 115.5 45.0 -59.7 -47.9 22.1 9.1 60.5 18 18 A S H ><5S+ 0 0 61 -4,-2.8 3,-1.9 1,-0.2 -2,-0.2 0.948 111.4 52.4 -57.5 -53.5 23.2 8.4 57.0 19 19 A Q H 3<5S+ 0 0 80 -4,-3.2 -1,-0.2 1,-0.3 -2,-0.2 0.829 111.4 47.2 -52.9 -37.5 20.2 6.2 56.2 20 20 A K T 3<5S- 0 0 102 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.296 123.4 -97.1 -94.1 10.5 17.8 8.9 57.3 21 21 A G T < 5S+ 0 0 68 -3,-1.9 -3,-0.2 1,-0.3 2,-0.2 0.579 81.9 122.2 90.4 10.7 19.3 11.8 55.4 22 22 A Y < - 0 0 62 -5,-3.0 -1,-0.3 -6,-0.2 2,-0.2 -0.572 64.6 -99.0-104.9 167.7 21.5 13.3 58.2 23 23 A S - 0 0 59 -2,-0.2 3,-0.1 1,-0.1 -1,-0.1 -0.561 19.2-168.4 -81.0 147.6 25.2 14.1 58.6 24 24 A W > + 0 0 138 -2,-0.2 3,-1.1 1,-0.1 -1,-0.1 0.142 59.2 110.1-115.3 12.4 27.4 11.7 60.6 25 25 A S T 3 + 0 0 85 1,-0.3 -1,-0.1 -11,-0.1 -11,-0.0 0.714 52.3 79.8 -64.2 -25.5 30.2 14.2 60.6 26 26 A Q T 3 0 0 51 -3,-0.1 -1,-0.3 81,-0.0 85,-0.1 0.455 360.0 360.0 -64.8 4.4 30.1 15.1 64.3 27 27 A F < 0 0 84 -3,-1.1 -3,-0.1 83,-0.0 83,-0.0 -0.867 360.0 360.0-100.9 360.0 32.0 11.9 64.9 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 82 A P >> 0 0 109 0, 0.0 4,-1.8 0, 0.0 3,-1.2 0.000 360.0 360.0 360.0 78.0 34.9 -10.2 62.9 30 83 A M H 3> + 0 0 57 1,-0.3 4,-2.8 2,-0.2 5,-0.2 0.848 360.0 54.1 -41.4 -52.3 34.2 -6.5 63.5 31 84 A A H 3> S+ 0 0 82 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.870 110.4 48.2 -54.2 -39.1 32.9 -6.0 60.0 32 85 A A H <> S+ 0 0 37 -3,-1.2 4,-2.1 2,-0.2 -1,-0.2 0.841 110.3 50.1 -72.7 -34.7 30.4 -8.9 60.4 33 86 A V H X S+ 0 0 5 -4,-1.8 4,-2.5 2,-0.2 5,-0.2 0.954 110.8 50.3 -67.7 -48.2 29.2 -7.6 63.8 34 87 A K H X S+ 0 0 40 -4,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.904 112.1 46.6 -55.2 -47.6 28.6 -4.2 62.4 35 88 A Q H X S+ 0 0 90 -4,-1.9 4,-2.3 -5,-0.2 -1,-0.2 0.905 111.9 50.1 -64.2 -42.9 26.6 -5.5 59.5 36 89 A A H X S+ 0 0 2 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.902 113.8 47.0 -63.1 -37.9 24.5 -7.8 61.6 37 90 A L H X S+ 0 0 1 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.893 109.5 51.3 -72.9 -39.5 23.7 -5.0 64.0 38 91 A R H X S+ 0 0 72 -4,-2.5 4,-1.9 -5,-0.2 -2,-0.2 0.957 116.0 43.6 -59.6 -47.7 22.8 -2.4 61.2 39 92 A E H X S+ 0 0 80 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.892 110.6 53.5 -65.2 -41.5 20.4 -5.0 59.7 40 93 A A H X S+ 0 0 7 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.885 108.9 51.2 -61.2 -38.5 19.0 -6.1 63.1 41 94 A G H X S+ 0 0 0 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.903 108.9 49.5 -66.6 -40.4 18.2 -2.4 63.8 42 95 A D H X S+ 0 0 38 -4,-1.9 4,-1.7 2,-0.2 -2,-0.2 0.932 110.9 50.2 -63.2 -45.3 16.4 -2.0 60.5 43 96 A E H X S+ 0 0 101 -4,-2.4 4,-1.9 2,-0.2 3,-0.3 0.953 111.8 48.4 -56.7 -50.9 14.3 -5.1 61.1 44 97 A F H X S+ 0 0 33 -4,-2.4 4,-1.1 1,-0.2 -2,-0.2 0.915 113.2 45.9 -55.3 -50.8 13.4 -3.9 64.6 45 98 A E H < S+ 0 0 45 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.743 108.4 58.3 -68.4 -23.1 12.4 -0.4 63.4 46 99 A L H < S+ 0 0 118 -4,-1.7 3,-0.3 -3,-0.3 -1,-0.2 0.919 118.4 29.5 -72.3 -42.8 10.4 -1.9 60.5 47 100 A R H < S+ 0 0 177 -4,-1.9 -2,-0.2 1,-0.2 2,-0.2 0.435 121.7 52.7 -99.1 1.8 8.2 -3.9 62.8 48 101 A Y S >< S- 0 0 147 -4,-1.1 3,-1.1 -5,-0.2 -1,-0.2 -0.646 75.7-172.7-135.8 74.4 8.3 -1.6 65.8 49 102 A R T 3 S+ 0 0 211 -3,-0.3 -3,-0.1 1,-0.2 -4,-0.0 -0.377 71.5 2.9 -70.4 148.1 7.3 1.9 64.5 50 103 A R T > S+ 0 0 217 -5,-0.1 3,-1.6 1,-0.1 -1,-0.2 0.764 86.2 162.5 46.8 29.2 7.5 4.9 66.9 51 104 A A T < + 0 0 44 -3,-1.1 3,-0.3 1,-0.3 4,-0.2 0.828 63.6 38.1 -45.2 -50.5 8.9 2.4 69.3 52 105 A F T 3> S+ 0 0 22 1,-0.2 4,-2.4 2,-0.1 5,-0.5 -0.024 71.5 120.9-101.6 34.3 10.5 4.8 71.8 53 106 A S H <> S+ 0 0 35 -3,-1.6 4,-1.9 2,-0.2 -1,-0.2 0.958 82.8 44.8 -55.7 -51.5 8.0 7.7 71.9 54 107 A D H > S+ 0 0 116 -3,-0.3 4,-2.7 2,-0.2 5,-0.2 0.973 116.5 43.6 -54.3 -64.7 7.6 7.1 75.6 55 108 A L H > S+ 0 0 23 2,-0.2 4,-1.3 1,-0.2 -2,-0.2 0.922 115.6 44.1 -50.7 -60.1 11.3 6.8 76.5 56 109 A T H X S+ 0 0 16 -4,-2.4 4,-4.8 1,-0.3 3,-0.5 0.902 116.0 51.3 -55.1 -39.2 12.7 9.6 74.4 57 110 A S H < S+ 0 0 82 -4,-1.9 -1,-0.3 -5,-0.5 -2,-0.2 0.890 107.7 51.5 -63.2 -40.4 9.8 11.7 75.7 58 111 A Q H < S+ 0 0 105 -4,-2.7 -1,-0.3 -5,-0.2 -2,-0.2 0.672 121.0 36.0 -69.7 -17.3 10.7 10.7 79.2 59 112 A L H < S+ 0 0 9 -4,-1.3 -2,-0.2 -3,-0.5 -3,-0.2 0.843 72.5 178.9-102.3 -46.5 14.3 11.8 78.4 60 113 A H < - 0 0 115 -4,-4.8 -3,-0.1 -5,-0.2 -4,-0.1 0.920 34.1-139.2 35.9 72.0 13.9 14.9 76.1 61 114 A I + 0 0 2 -5,-0.2 -1,-0.1 2,-0.1 48,-0.1 -0.242 31.5 169.1 -64.8 144.0 17.7 15.4 75.9 62 115 A T > - 0 0 56 -3,-0.1 3,-1.8 47,-0.0 39,-0.0 -0.883 53.4 -90.9-142.4 170.3 19.4 18.8 76.1 63 116 A P T 3 S+ 0 0 69 0, 0.0 -2,-0.1 0, 0.0 43,-0.0 0.663 126.4 54.3 -63.9 -11.5 23.0 19.8 76.4 64 117 A G T 3 S+ 0 0 68 2,-0.1 2,-0.1 0, 0.0 -3,-0.0 0.541 79.2 117.8 -97.2 -7.6 22.5 19.9 80.2 65 118 A T < - 0 0 23 -3,-1.8 2,-0.2 1,-0.1 -4,-0.0 -0.362 57.8-139.0 -61.8 135.8 21.2 16.3 80.5 66 119 A A >> - 0 0 43 1,-0.1 4,-1.3 -2,-0.1 3,-1.2 -0.660 19.0-113.5 -98.3 154.5 23.4 14.1 82.6 67 120 A Y H 3> S+ 0 0 35 1,-0.3 4,-3.4 -2,-0.2 3,-0.4 0.874 113.5 63.8 -49.6 -44.5 24.4 10.4 82.0 68 121 A Q H 3> S+ 0 0 117 1,-0.3 4,-2.6 2,-0.2 -1,-0.3 0.844 101.1 50.3 -52.4 -37.4 22.4 9.3 85.0 69 122 A S H <> S+ 0 0 48 -3,-1.2 4,-1.7 2,-0.2 -1,-0.3 0.875 112.3 47.0 -70.2 -37.5 19.2 10.5 83.4 70 123 A F H X S+ 0 0 1 -4,-1.3 4,-2.9 -3,-0.4 5,-0.3 0.966 113.6 48.8 -64.5 -51.8 20.0 8.6 80.2 71 124 A E H X S+ 0 0 48 -4,-3.4 4,-2.2 1,-0.2 -2,-0.2 0.900 109.1 52.4 -54.2 -47.5 21.0 5.5 82.3 72 125 A Q H < S+ 0 0 131 -4,-2.6 4,-0.4 -5,-0.2 -1,-0.2 0.897 114.0 42.9 -57.9 -44.2 17.7 5.6 84.3 73 126 A V H >< S+ 0 0 14 -4,-1.7 3,-1.6 1,-0.2 4,-0.4 0.932 112.9 50.2 -69.7 -48.8 15.6 5.8 81.2 74 127 A V H >X S+ 0 0 0 -4,-2.9 3,-1.9 1,-0.3 4,-0.5 0.854 97.9 69.9 -59.5 -33.8 17.5 3.1 79.2 75 128 A N G >< S+ 0 0 52 -4,-2.2 3,-1.1 1,-0.3 -1,-0.3 0.768 85.8 70.6 -53.7 -27.5 17.2 0.8 82.3 76 129 A E G X4 S+ 0 0 79 -3,-1.6 3,-1.3 -4,-0.4 -1,-0.3 0.831 90.0 57.9 -59.4 -36.8 13.5 0.6 81.4 77 130 A L G <4 S+ 0 0 33 -3,-1.9 -1,-0.3 -4,-0.4 3,-0.3 0.725 110.0 46.8 -65.1 -22.9 14.3 -1.5 78.4 78 131 A F G X< + 0 0 24 -3,-1.1 3,-2.0 -4,-0.5 -1,-0.3 -0.023 67.7 123.2-112.8 29.5 15.9 -3.9 80.7 79 132 A R T < S+ 0 0 150 -3,-1.3 -1,-0.2 1,-0.3 -2,-0.1 0.843 88.4 38.1 -54.3 -37.3 13.3 -4.2 83.5 80 133 A D T 3 S- 0 0 140 1,-0.4 -1,-0.3 -3,-0.3 -2,-0.1 0.035 126.4 -97.9-104.9 25.1 13.3 -7.9 82.8 81 134 A G < - 0 0 32 -3,-2.0 -1,-0.4 5,-0.0 2,-0.2 -0.237 55.5 -45.8 88.5 179.1 17.0 -8.2 82.2 82 135 A V + 0 0 27 42,-0.1 2,-0.3 -3,-0.1 -4,-0.1 -0.574 53.0 155.3 -90.9 149.2 19.0 -8.3 79.0 83 136 A N > - 0 0 58 -2,-0.2 4,-1.8 1,-0.1 3,-0.2 -0.926 54.7 -96.3-157.8 166.6 18.4 -10.3 75.8 84 137 A W H > S+ 0 0 28 -2,-0.3 4,-2.4 1,-0.2 5,-0.2 0.905 121.3 53.1 -57.8 -44.5 19.5 -9.8 72.2 85 138 A G H > S+ 0 0 33 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.864 110.2 48.9 -59.7 -36.8 16.3 -8.1 71.1 86 139 A R H > S+ 0 0 67 2,-0.2 4,-2.1 -3,-0.2 -1,-0.2 0.822 108.2 53.0 -72.4 -32.9 16.6 -5.6 73.9 87 140 A I H X S+ 0 0 0 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.921 109.7 49.3 -67.2 -41.2 20.2 -4.9 73.0 88 141 A V H X S+ 0 0 5 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.904 109.9 51.0 -62.6 -40.6 19.0 -4.1 69.4 89 142 A A H X S+ 0 0 7 -4,-1.9 4,-2.8 1,-0.2 -1,-0.2 0.901 106.4 56.0 -62.6 -40.6 16.3 -1.9 70.9 90 143 A F H X S+ 0 0 2 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.904 109.1 45.8 -58.1 -44.0 19.0 -0.1 72.9 91 144 A F H X S+ 0 0 0 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.945 113.5 48.7 -67.0 -44.1 21.0 0.6 69.7 92 145 A S H X S+ 0 0 2 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.868 108.5 54.9 -61.3 -39.2 17.9 1.8 67.9 93 146 A L H X S+ 0 0 3 -4,-2.8 4,-2.4 2,-0.2 -1,-0.2 0.929 107.6 48.7 -60.7 -45.4 16.9 4.0 70.8 94 147 A G H X S+ 0 0 1 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.905 111.0 51.4 -61.5 -39.7 20.3 5.7 70.7 95 148 A G H X S+ 0 0 1 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.906 109.3 49.6 -62.1 -41.2 19.9 6.2 67.0 96 149 A A H X S+ 0 0 37 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.880 109.6 51.8 -65.5 -39.2 16.5 7.8 67.5 97 150 A L H X S+ 0 0 1 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.857 109.3 50.1 -65.8 -37.1 18.0 10.1 70.2 98 151 A C H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.935 111.7 47.2 -66.8 -45.3 20.7 11.2 67.7 99 152 A V H X S+ 0 0 21 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.948 113.0 49.8 -59.6 -47.6 18.1 11.9 65.0 100 153 A E H X S+ 0 0 48 -4,-2.6 4,-1.2 1,-0.2 -1,-0.2 0.893 109.6 51.9 -58.5 -40.9 16.0 13.8 67.5 101 154 A S H <>S+ 0 0 2 -4,-2.1 5,-2.6 2,-0.2 3,-0.5 0.924 109.6 47.8 -63.2 -46.1 19.0 15.8 68.6 102 155 A V H ><5S+ 0 0 19 -4,-2.5 3,-1.7 1,-0.2 5,-0.2 0.914 110.1 53.9 -62.5 -40.2 19.9 16.8 65.0 103 156 A D H 3<5S+ 0 0 97 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.745 107.4 50.7 -64.3 -25.0 16.2 17.8 64.5 104 157 A K T 3<5S- 0 0 76 -4,-1.2 -1,-0.3 -3,-0.5 -2,-0.2 0.295 119.9-110.6 -95.4 11.2 16.3 20.0 67.5 105 158 A E T < 5S+ 0 0 146 -3,-1.7 -3,-0.2 1,-0.1 -2,-0.1 0.924 87.3 119.2 59.1 45.8 19.5 21.7 66.2 106 159 A M > < + 0 0 48 -5,-2.6 3,-2.4 -6,-0.1 4,-0.3 -0.333 19.5 148.7-132.2 48.0 21.5 20.1 69.0 107 160 A Q T > + 0 0 68 1,-0.3 3,-1.8 -5,-0.2 4,-0.5 0.738 61.4 77.7 -58.5 -19.6 23.9 18.1 66.9 108 161 A V T 3> S+ 0 0 85 1,-0.3 4,-0.7 2,-0.2 3,-0.3 0.779 85.5 62.7 -61.1 -24.4 26.5 18.6 69.6 109 162 A L H <> S+ 0 0 0 -3,-2.4 4,-3.1 1,-0.2 -1,-0.3 0.690 82.5 80.6 -74.9 -17.6 24.7 15.8 71.6 110 163 A V H <> S+ 0 0 0 -3,-1.8 4,-1.8 -4,-0.3 -1,-0.2 0.927 96.6 40.1 -56.6 -49.8 25.4 13.2 68.9 111 164 A S H > S+ 0 0 61 -4,-0.5 4,-1.8 -3,-0.3 -1,-0.2 0.844 116.0 53.9 -69.4 -30.1 29.0 12.5 70.1 112 165 A R H X S+ 0 0 95 -4,-0.7 4,-2.4 2,-0.2 -2,-0.2 0.913 107.3 49.2 -68.7 -41.3 27.8 12.7 73.7 113 166 A I H X S+ 0 0 0 -4,-3.1 4,-2.4 1,-0.2 -1,-0.2 0.884 108.9 54.7 -64.2 -36.2 25.0 10.2 73.1 114 167 A A H X S+ 0 0 8 -4,-1.8 4,-2.0 -5,-0.2 -1,-0.2 0.901 109.2 46.6 -64.3 -40.4 27.6 7.9 71.5 115 168 A A H X S+ 0 0 42 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.924 111.9 50.7 -67.7 -43.8 29.9 8.1 74.6 116 169 A W H X S+ 0 0 26 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.895 110.1 50.5 -59.3 -43.8 26.9 7.4 76.9 117 170 A M H X S+ 0 0 0 -4,-2.4 4,-3.0 2,-0.2 -1,-0.2 0.899 109.8 49.5 -62.5 -42.3 25.9 4.4 74.9 118 171 A A H X S+ 0 0 3 -4,-2.0 4,-2.6 2,-0.2 -1,-0.2 0.886 112.7 48.0 -64.7 -38.9 29.5 3.0 75.0 119 172 A T H X S+ 0 0 71 -4,-2.3 4,-2.2 2,-0.2 5,-0.2 0.922 114.4 45.6 -66.6 -46.0 29.6 3.5 78.7 120 173 A Y H X>S+ 0 0 2 -4,-2.7 4,-2.6 2,-0.2 5,-1.0 0.920 114.4 48.7 -63.3 -44.5 26.2 1.9 79.2 121 174 A L H X>S+ 0 0 0 -4,-3.0 5,-2.8 1,-0.2 4,-0.9 0.954 114.5 44.9 -58.9 -53.4 27.1 -1.0 76.9 122 175 A N H <5S+ 0 0 54 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.849 122.4 37.4 -62.2 -35.0 30.4 -1.7 78.6 123 176 A D H <5S+ 0 0 87 -4,-2.2 -2,-0.2 -5,-0.2 -3,-0.2 0.959 132.1 15.4 -83.3 -55.4 28.9 -1.4 82.1 124 177 A H H <5S+ 0 0 67 -4,-2.6 4,-0.4 -5,-0.2 -3,-0.2 0.760 129.4 37.1 -94.6 -29.6 25.5 -3.0 81.9 125 178 A L T X S+ 0 0 76 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.923 112.0 36.7 -49.1 -49.2 28.3 -8.8 81.3 128 181 A W H > S+ 0 0 61 -3,-0.5 4,-1.5 -4,-0.4 6,-0.2 0.931 115.6 54.1 -70.4 -46.4 25.3 -10.6 79.7 129 182 A I H ><>S+ 0 0 0 -4,-2.6 5,-2.9 1,-0.2 3,-0.6 0.937 111.3 45.1 -54.0 -50.5 26.7 -10.5 76.2 130 183 A Q H ><5S+ 0 0 109 -4,-3.4 3,-1.1 1,-0.2 -1,-0.2 0.863 110.6 54.1 -62.4 -37.0 29.9 -12.2 77.3 131 184 A E H 3<5S+ 0 0 157 -4,-1.5 -1,-0.2 -5,-0.4 -2,-0.2 0.741 111.2 48.4 -69.2 -22.9 28.0 -14.8 79.4 132 185 A N T <<5S- 0 0 70 -4,-1.5 -1,-0.2 -3,-0.6 -2,-0.2 0.001 134.7 -70.1-111.2 29.9 26.0 -15.7 76.3 133 186 A G T <>5 - 0 0 41 -3,-1.1 4,-0.7 4,-0.1 3,-0.5 0.315 66.7-111.5 108.0 -10.8 28.5 -16.2 73.6 134 187 A G H >>< - 0 0 7 -5,-2.9 3,-1.1 -6,-0.2 4,-1.0 -0.150 63.5 -45.2 73.8-177.4 29.9 -12.7 72.9 135 188 A W H 3> S+ 0 0 25 1,-0.3 4,-2.8 2,-0.2 -1,-0.2 0.704 132.0 71.8 -63.2 -18.9 29.2 -10.9 69.7 136 189 A D H 3> S+ 0 0 106 -3,-0.5 4,-2.6 1,-0.2 -1,-0.3 0.913 98.9 47.7 -62.6 -40.2 30.0 -14.1 67.7 137 190 A T H