==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER APOPTOSIS 08-FEB-05 1YSI . COMPND 2 MOLECULE: APOPTOSIS REGULATOR BCL-X; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR T.OLTERSDORF,S.W.ELMORE,A.R.SHOEMAKER,R.C.ARMSTRONG, . 181 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13899.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 112 61.9 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 . 1 0.6 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 . 11 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 77 42.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 3.9 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 1 1 1 0 0 0 1 0 1 0 2 0 0 0 0 0 1 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 0 207 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-163.2 3.6 17.6 19.7 2 2 A S - 0 0 105 2,-0.0 0, 0.0 0, 0.0 0, 0.0 0.742 360.0-174.8-105.8 -31.5 3.5 15.8 16.3 3 3 A M - 0 0 103 2,-0.1 3,-0.4 1,-0.1 0, 0.0 0.865 20.1-174.3 34.7 55.8 1.2 12.9 17.2 4 4 A A + 0 0 54 1,-0.2 -1,-0.1 2,-0.1 -2,-0.0 -0.091 60.5 42.0 -68.3 176.6 1.8 11.3 13.7 5 5 A M S S+ 0 0 37 1,-0.1 -1,-0.2 3,-0.0 -2,-0.1 0.840 76.1 131.4 54.1 29.7 -0.2 8.3 12.6 6 6 A S S S- 0 0 90 -3,-0.4 -1,-0.1 1,-0.1 -2,-0.1 0.845 92.4 -20.1 -81.7 -32.8 -3.2 9.9 14.2 7 7 A Q S > S+ 0 0 149 2,-0.0 4,-0.6 3,-0.0 -1,-0.1 0.079 99.5 115.0-164.8 34.0 -5.5 9.4 11.1 8 8 A S T 4 S+ 0 0 34 1,-0.1 -3,-0.0 2,-0.1 -2,-0.0 -0.016 74.3 59.3-100.3 31.8 -3.2 8.8 8.1 9 9 A N T >> S+ 0 0 6 3,-0.1 3,-1.3 2,-0.0 4,-1.3 0.673 97.6 48.1-122.2 -52.9 -4.4 5.2 7.6 10 10 A R H 3> S+ 0 0 183 1,-0.3 4,-0.7 2,-0.2 3,-0.2 0.945 124.2 35.7 -58.4 -45.4 -8.2 5.2 7.0 11 11 A E H 3X S+ 0 0 116 -4,-0.6 4,-1.1 1,-0.2 -1,-0.3 0.326 103.3 78.8 -90.5 11.1 -7.9 8.0 4.4 12 12 A L H <> S+ 0 0 4 -3,-1.3 4,-1.8 2,-0.2 5,-0.2 0.900 97.9 40.0 -83.5 -41.7 -4.5 6.5 3.2 13 13 A V H X S+ 0 0 4 -4,-1.3 4,-2.0 -3,-0.2 -2,-0.2 0.837 117.1 50.9 -74.8 -30.7 -6.1 3.8 1.1 14 14 A V H X S+ 0 0 26 -4,-0.7 4,-2.7 -5,-0.2 5,-0.3 0.882 107.3 53.6 -74.8 -35.5 -8.9 6.2 -0.0 15 15 A D H X S+ 0 0 48 -4,-1.1 4,-1.6 2,-0.2 -2,-0.2 0.978 117.2 35.8 -63.2 -52.5 -6.4 8.8 -1.1 16 16 A F H X S+ 0 0 8 -4,-1.8 4,-1.5 2,-0.2 5,-0.2 0.896 115.0 59.2 -68.4 -36.3 -4.4 6.4 -3.3 17 17 A L H >X S+ 0 0 0 -4,-2.0 4,-2.7 -5,-0.2 3,-1.2 0.981 106.6 44.8 -56.2 -58.0 -7.7 4.6 -4.3 18 18 A S H 3X S+ 0 0 43 -4,-2.7 4,-3.1 1,-0.3 5,-0.4 0.894 106.0 62.9 -55.0 -37.4 -9.2 7.8 -5.8 19 19 A Y H 3< S+ 0 0 93 -4,-1.6 4,-0.3 -5,-0.3 -1,-0.3 0.882 113.4 34.5 -56.9 -34.7 -5.8 8.5 -7.5 20 20 A K H X>S+ 0 0 1 -4,-2.7 4,-2.5 -5,-0.2 3,-1.8 0.956 102.7 55.4 -72.4 -48.9 -10.2 5.6 -9.7 22 22 A S H 3<5S+ 0 0 84 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.1 0.828 100.3 63.7 -54.1 -27.4 -10.1 9.1 -11.2 23 23 A Q H 345S+ 0 0 146 -5,-0.4 -1,-0.3 -4,-0.3 -2,-0.2 0.853 110.9 35.8 -66.9 -30.7 -7.9 7.6 -13.9 24 24 A K H <<5S- 0 0 129 -3,-1.8 -2,-0.2 -4,-0.6 -1,-0.2 0.766 117.6-110.7 -92.2 -27.9 -10.8 5.3 -15.0 25 25 A G T <5S+ 0 0 66 -4,-2.5 -3,-0.2 2,-0.0 -2,-0.1 0.755 84.7 115.0 103.0 32.6 -13.5 7.9 -14.3 26 26 A Y < - 0 0 64 -5,-1.4 4,-0.2 -8,-0.1 -4,-0.2 0.695 50.3-169.0-104.6 -25.3 -15.2 6.3 -11.3 27 27 A S - 0 0 68 -6,-0.2 -1,-0.1 -9,-0.2 -3,-0.1 -0.272 21.8-121.2 66.2-158.1 -14.4 9.0 -8.7 28 28 A W S >> S+ 0 0 56 -7,-0.1 3,-2.5 3,-0.0 4,-0.6 0.403 94.8 71.2-150.5 -45.3 -15.1 8.1 -5.0 29 29 A S T 34 S+ 0 0 75 1,-0.3 -2,-0.1 2,-0.2 4,-0.1 0.837 104.7 49.9 -52.8 -29.4 -17.6 10.5 -3.4 30 30 A Q T 34 S+ 0 0 149 -4,-0.2 -1,-0.3 2,-0.1 3,-0.1 0.575 90.2 86.1 -86.8 -7.7 -20.3 8.8 -5.6 31 31 A F T <4 S+ 0 0 14 -3,-2.5 -2,-0.2 1,-0.2 93,-0.1 0.989 113.7 4.6 -55.8 -72.3 -19.2 5.3 -4.6 32 32 A S S < S- 0 0 60 -4,-0.6 2,-0.2 1,-0.3 -1,-0.2 0.104 98.4-133.6-101.3 24.4 -21.3 5.0 -1.4 33 33 A D + 0 0 119 -5,-0.2 -1,-0.3 -3,-0.1 -2,-0.1 -0.451 41.0 160.1 62.7-124.3 -23.1 8.3 -1.9 34 34 A V - 0 0 85 -2,-0.2 -1,-0.1 -3,-0.1 -3,-0.0 0.397 53.7 -64.0 79.5 140.8 -23.1 10.1 1.6 35 35 A E - 0 0 183 1,-0.1 2,-0.5 2,-0.0 0, 0.0 -0.081 48.3-138.1 -51.4 155.8 -23.6 13.8 2.1 36 36 A E - 0 0 132 1,-0.2 -1,-0.1 0, 0.0 -2,-0.1 -0.888 14.8-170.6-124.5 103.2 -20.9 16.1 0.5 37 37 A N - 0 0 125 -2,-0.5 -1,-0.2 1,-0.1 -2,-0.0 0.976 38.9-115.8 -54.4 -79.2 -19.8 19.0 2.6 38 38 A R - 0 0 195 2,-0.0 -1,-0.1 1,-0.0 0, 0.0 -0.213 22.1-159.4 174.1 -71.2 -17.7 20.9 0.1 39 39 A T + 0 0 100 2,-0.1 4,-0.1 3,-0.0 -2,-0.0 0.996 26.8 161.6 65.2 61.9 -13.9 21.3 0.8 40 40 A E S S- 0 0 156 1,-0.1 3,-0.1 2,-0.0 -2,-0.0 0.978 75.5 -20.8 -78.1 -65.5 -13.3 24.3 -1.5 41 41 A A S S+ 0 0 92 1,-0.1 3,-0.2 3,-0.0 -1,-0.1 -0.377 78.3 143.6-145.8 63.2 -9.9 25.6 -0.1 42 42 A P - 0 0 87 0, 0.0 2,-1.9 0, 0.0 -1,-0.1 0.754 26.3-179.0 -73.0 -27.6 -9.5 24.2 3.4 43 43 A E + 0 0 151 1,-0.1 2,-2.5 -3,-0.1 3,-0.4 -0.353 11.3 164.2 61.0 -84.8 -5.7 23.8 2.9 44 44 A G S S- 0 0 60 -2,-1.9 -1,-0.1 1,-0.2 -3,-0.0 -0.418 73.6 -56.5 73.5 -76.9 -5.0 22.4 6.4 45 45 A T - 0 0 97 -2,-2.5 -1,-0.2 3,-0.0 -2,-0.1 0.280 55.6-175.9-165.1 -43.1 -1.6 21.0 5.5 46 46 A E + 0 0 149 -3,-0.4 -2,-0.1 1,-0.2 -3,-0.0 0.790 42.5 131.4 32.8 39.8 -1.8 18.6 2.5 47 47 A S + 0 0 97 2,-0.0 2,-0.3 0, 0.0 -1,-0.2 -0.278 24.0 142.2-111.3 48.2 2.0 18.0 3.0 48 48 A E - 0 0 86 1,-0.1 4,-0.1 2,-0.0 -3,-0.0 -0.680 27.8-177.9 -89.9 142.1 2.0 14.2 3.0 49 89 A A S >> S+ 0 0 39 -2,-0.3 4,-1.8 2,-0.1 3,-0.9 0.688 72.8 72.8-109.1 -27.5 4.9 12.4 1.3 50 90 A V H 3> S+ 0 0 17 1,-0.3 4,-2.8 2,-0.2 5,-0.4 0.940 93.2 57.4 -54.3 -46.5 3.8 8.8 1.7 51 91 A K H 3> S+ 0 0 58 1,-0.2 4,-1.1 2,-0.2 -1,-0.3 0.859 105.5 53.8 -54.6 -31.6 1.1 9.3 -1.0 52 92 A Q H <> S+ 0 0 102 -3,-0.9 4,-2.0 2,-0.2 3,-0.5 0.990 112.5 39.1 -68.2 -58.6 4.0 10.3 -3.3 53 93 A A H X S+ 0 0 13 -4,-1.8 4,-3.2 1,-0.3 5,-0.3 0.970 115.3 52.7 -56.1 -53.5 6.1 7.2 -2.8 54 94 A L H X S+ 0 0 2 -4,-2.8 4,-1.6 -5,-0.2 -1,-0.3 0.827 108.1 56.2 -53.4 -28.0 3.1 4.9 -2.8 55 95 A R H X S+ 0 0 99 -4,-1.1 4,-0.9 -3,-0.5 3,-0.3 0.995 112.7 35.4 -69.4 -62.7 2.1 6.6 -6.1 56 96 A E H >X S+ 0 0 129 -4,-2.0 4,-3.8 1,-0.2 3,-1.0 0.887 112.6 63.7 -59.4 -35.4 5.4 5.9 -8.1 57 97 A A H 3X>S+ 0 0 15 -4,-3.2 4,-2.3 -5,-0.3 5,-0.6 0.949 95.4 57.2 -55.0 -47.6 5.5 2.5 -6.3 58 98 A G H 3<5S+ 0 0 1 -4,-1.6 -1,-0.3 -3,-0.3 -2,-0.2 0.833 119.1 33.9 -54.3 -28.2 2.3 1.4 -7.9 59 99 A D H <<5S+ 0 0 108 -3,-1.0 3,-0.4 -4,-0.9 -2,-0.2 0.909 122.7 41.7 -92.5 -57.1 4.1 2.1 -11.2 60 100 A E H >X5S+ 0 0 116 -4,-3.8 4,-1.3 1,-0.3 3,-0.8 0.967 116.1 50.3 -55.4 -52.5 7.7 1.1 -10.5 61 101 A F H 3X5S+ 0 0 41 -4,-2.3 4,-0.8 -5,-0.4 2,-0.7 0.826 104.2 62.9 -57.0 -27.2 6.6 -2.0 -8.5 62 102 A E H 34 S+ 0 0 35 1,-0.2 4,-2.5 2,-0.1 5,-0.4 -0.092 82.5 133.4-116.3 35.8 0.5 -11.3 -6.9 70 110 A S H > S+ 0 0 80 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.852 85.0 39.2 -54.8 -30.2 -1.0 -12.7 -10.1 71 111 A D H > S+ 0 0 130 -3,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.841 110.6 58.2 -88.4 -35.8 -2.1 -15.7 -8.0 72 112 A L H >4 S+ 0 0 38 2,-0.2 3,-1.0 1,-0.2 -2,-0.2 0.979 109.0 44.3 -58.5 -55.0 -3.1 -13.6 -4.9 73 113 A T H >< S+ 0 0 57 -4,-2.5 3,-2.5 1,-0.3 -1,-0.2 0.954 111.2 54.1 -55.7 -47.8 -5.7 -11.5 -6.9 74 114 A S H 3< S+ 0 0 86 -4,-0.9 3,-0.4 -5,-0.4 -1,-0.3 0.797 105.6 55.8 -58.1 -23.2 -6.9 -14.7 -8.6 75 115 A Q T << S+ 0 0 118 -4,-1.4 -1,-0.3 -3,-1.0 -2,-0.2 0.193 97.8 65.9 -94.2 19.1 -7.4 -16.0 -5.0 76 116 A L < + 0 0 8 -3,-2.5 -1,-0.2 -5,-0.1 -2,-0.1 -0.191 67.2 174.7-131.0 43.4 -9.7 -13.0 -4.1 77 117 A H - 0 0 147 -3,-0.4 2,-0.3 1,-0.1 5,-0.2 -0.284 33.4-124.7 -53.0 124.3 -12.7 -13.6 -6.4 78 118 A I + 0 0 51 2,-0.1 -1,-0.1 3,-0.1 5,-0.1 -0.544 53.1 130.6 -74.7 134.0 -15.2 -10.9 -5.4 79 119 A T - 0 0 83 3,-0.3 2,-2.7 -2,-0.3 0, 0.0 -0.972 70.0 -81.3-174.1 163.4 -18.6 -12.3 -4.5 80 120 A P S S+ 0 0 139 0, 0.0 3,-0.1 0, 0.0 -2,-0.1 -0.382 112.8 52.4 -73.0 65.0 -21.4 -12.2 -1.9 81 121 A G S S+ 0 0 72 -2,-2.7 -3,-0.1 1,-0.7 2,-0.0 0.072 100.1 31.9-158.1 -79.6 -19.6 -14.7 0.5 82 122 A T + 0 0 50 -5,-0.2 -1,-0.7 1,-0.1 -3,-0.3 -0.216 53.8 140.7 -84.4-178.2 -16.0 -14.0 1.6 83 123 A A S > S+ 0 0 32 -3,-0.1 4,-0.6 -5,-0.1 -1,-0.1 -0.218 76.8 17.7 179.5 -77.8 -14.4 -10.5 2.1 84 124 A Y H > S+ 0 0 120 3,-0.2 4,-2.6 2,-0.1 5,-0.3 0.766 120.9 60.2 -89.2 -26.2 -12.0 -9.9 5.0 85 125 A Q H > S+ 0 0 132 2,-0.2 4,-2.9 1,-0.2 5,-0.2 1.000 115.3 30.1 -64.6 -65.4 -11.3 -13.6 5.6 86 126 A S H > S+ 0 0 32 1,-0.2 4,-2.4 2,-0.2 5,-0.4 0.880 121.2 56.0 -62.9 -34.5 -9.9 -14.5 2.2 87 127 A F H X S+ 0 0 3 -4,-0.6 4,-2.0 2,-0.2 -1,-0.2 0.960 113.9 37.7 -63.7 -48.6 -8.5 -10.9 1.9 88 128 A E H X S+ 0 0 60 -4,-2.6 4,-3.9 2,-0.2 5,-0.3 0.902 113.8 57.7 -70.5 -38.4 -6.6 -11.2 5.2 89 129 A Q H X S+ 0 0 130 -4,-2.9 4,-1.2 -5,-0.3 -2,-0.2 0.973 116.8 32.6 -56.7 -54.5 -5.6 -14.8 4.6 90 130 A V H X S+ 0 0 16 -4,-2.4 4,-0.8 -5,-0.2 -1,-0.2 0.848 120.2 54.0 -72.7 -30.8 -3.9 -14.0 1.2 91 131 A V H >X S+ 0 0 0 -4,-2.0 4,-1.7 -5,-0.4 3,-1.6 0.961 105.0 51.8 -68.5 -48.2 -2.9 -10.5 2.6 92 132 A N H 3< S+ 0 0 76 -4,-3.9 -1,-0.2 1,-0.3 -2,-0.2 0.884 99.9 65.9 -56.0 -34.0 -1.2 -12.0 5.7 93 133 A E H >< S+ 0 0 116 -4,-1.2 3,-0.6 -5,-0.3 4,-0.4 0.864 102.5 47.9 -57.0 -31.8 0.7 -14.3 3.2 94 134 A L H << S+ 0 0 30 -3,-1.6 2,-1.2 -4,-0.8 3,-0.4 0.926 110.2 50.2 -75.8 -44.0 2.4 -11.1 1.9 95 135 A F T 3< S+ 0 0 12 -4,-1.7 -1,-0.2 1,-0.2 4,-0.2 -0.288 93.0 84.5 -89.2 53.6 3.3 -9.8 5.4 96 136 A R S < S+ 0 0 189 -2,-1.2 -1,-0.2 -3,-0.6 3,-0.2 0.707 76.0 57.1-118.7 -48.9 4.9 -13.1 6.5 97 137 A D S S- 0 0 146 -4,-0.4 -2,-0.1 -3,-0.4 2,-0.1 0.847 132.2 -58.1 -55.5 -29.8 8.5 -13.0 5.2 98 138 A G - 0 0 29 -4,-0.3 -1,-0.2 2,-0.1 -2,-0.2 -0.291 56.1 -93.0 149.6 122.5 8.9 -9.8 7.2 99 139 A V + 0 0 36 -4,-0.2 2,-0.3 -3,-0.2 -4,-0.1 -0.326 59.4 164.2 -55.1 120.4 7.1 -6.4 7.2 100 140 A N > - 0 0 78 -2,-0.1 4,-1.9 1,-0.1 5,-0.2 -0.862 52.1-103.0-134.8 170.4 9.2 -4.3 4.8 101 141 A W H > S+ 0 0 10 -2,-0.3 4,-1.3 2,-0.2 5,-0.2 0.956 122.9 45.9 -61.4 -48.0 8.8 -1.0 2.9 102 142 A G H >> S+ 0 0 47 1,-0.2 4,-2.5 2,-0.2 3,-0.7 0.942 108.6 56.4 -61.5 -43.7 8.2 -2.8 -0.4 103 143 A R H 3> S+ 0 0 90 1,-0.3 4,-2.4 2,-0.2 5,-0.2 0.905 106.1 51.5 -55.1 -37.9 5.8 -5.2 1.3 104 144 A I H 3X S+ 0 0 0 -4,-1.9 4,-1.1 1,-0.2 -1,-0.3 0.818 110.1 49.3 -69.7 -27.1 3.8 -2.1 2.4 105 145 A V H X S+ 0 0 0 -4,-1.7 4,-1.8 -3,-0.2 3,-0.9 0.989 114.3 47.5 -63.7 -57.6 -5.9 -3.3 -2.1 112 152 A G H 3X S+ 0 0 3 -4,-2.1 4,-3.1 1,-0.3 5,-0.3 0.853 108.5 58.7 -53.3 -31.3 -6.5 -0.4 -4.5 113 153 A A H 3X S+ 0 0 44 -4,-2.2 4,-1.5 -5,-0.3 -1,-0.3 0.899 103.9 50.0 -67.1 -36.8 -6.3 -3.0 -7.3 114 154 A L H S+ 0 0 6 -4,-2.2 5,-1.7 1,-0.2 4,-1.1 0.892 120.2 41.4 -55.4 -36.6 -14.6 -4.3 -8.4 119 159 A V H <5S+ 0 0 0 -4,-3.1 -1,-0.2 3,-0.2 -2,-0.2 0.807 102.9 68.5 -81.6 -28.4 -15.6 -0.8 -9.2 120 160 A D H <5S+ 0 0 61 -4,-1.1 -2,-0.2 -5,-0.4 -1,-0.2 0.892 108.6 38.3 -58.2 -36.3 -14.5 -1.1 -12.9 121 161 A K H <5S- 0 0 159 -4,-1.6 -2,-0.2 2,-0.1 -3,-0.1 0.963 132.0 -73.6 -78.2 -76.4 -17.3 -3.6 -13.4 122 162 A E T <5S+ 0 0 160 -4,-1.1 2,-0.4 1,-0.0 -3,-0.2 0.142 94.3 108.8-178.1 37.8 -20.3 -2.2 -11.4 123 163 A M < + 0 0 77 -5,-1.7 3,-0.3 -6,-0.2 -3,-0.1 -0.677 20.4 149.8-126.8 80.6 -19.7 -2.8 -7.7 124 164 A Q + 0 0 53 -2,-0.4 4,-0.1 1,-0.2 -1,-0.1 0.033 62.4 75.5 -98.4 29.0 -19.0 0.6 -6.0 125 165 A V S S+ 0 0 102 2,-0.1 3,-0.4 1,-0.1 4,-0.3 0.688 88.6 52.5-108.8 -27.4 -20.5 -0.6 -2.7 126 166 A L S > S+ 0 0 59 -3,-0.3 4,-1.8 1,-0.2 5,-0.2 0.204 82.9 94.7 -93.8 18.8 -17.7 -2.9 -1.4 127 167 A V H > S+ 0 0 1 2,-0.2 4,-2.6 1,-0.2 5,-0.3 0.926 85.3 46.4 -75.5 -42.7 -15.0 -0.2 -1.8 128 168 A S H > S+ 0 0 72 -3,-0.4 4,-1.7 2,-0.2 -1,-0.2 0.857 110.6 55.9 -67.7 -31.2 -15.3 1.0 1.8 129 169 A R H > S+ 0 0 156 -4,-0.3 4,-2.2 2,-0.2 -2,-0.2 0.977 113.2 38.0 -65.8 -53.1 -15.2 -2.6 3.0 130 170 A I H X S+ 0 0 2 -4,-1.8 4,-1.9 1,-0.2 5,-0.3 0.963 117.7 50.0 -63.7 -49.1 -11.9 -3.4 1.2 131 171 A A H X S+ 0 0 7 -4,-2.6 4,-1.8 1,-0.2 -1,-0.2 0.852 109.6 54.6 -59.0 -30.4 -10.4 0.0 1.9 132 172 A A H X S+ 0 0 38 -4,-1.7 4,-2.7 -5,-0.3 5,-0.3 0.947 103.2 53.3 -70.0 -46.1 -11.4 -0.6 5.6 133 173 A W H X S+ 0 0 49 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.929 114.0 43.1 -55.5 -43.1 -9.6 -3.9 5.8 134 174 A M H X S+ 0 0 2 -4,-1.9 4,-1.4 2,-0.2 -1,-0.2 0.851 110.5 57.1 -72.5 -31.2 -6.4 -2.2 4.6 135 175 A A H X S+ 0 0 7 -4,-1.8 4,-1.7 -5,-0.3 -2,-0.2 0.935 110.3 42.9 -65.9 -43.3 -7.0 0.8 6.9 136 176 A T H X>S+ 0 0 86 -4,-2.7 4,-1.9 2,-0.2 5,-0.8 0.926 107.3 60.0 -69.5 -41.9 -7.2 -1.4 10.0 137 177 A Y H <5S+ 0 0 15 -4,-2.0 4,-0.5 -5,-0.3 6,-0.3 0.870 115.7 36.0 -54.6 -33.0 -4.1 -3.5 8.9 138 178 A L H <>S+ 0 0 2 -4,-1.4 5,-0.6 4,-0.2 4,-0.3 0.731 106.6 69.5 -92.1 -23.4 -2.2 -0.2 8.9 139 179 A N H <5S- 0 0 85 -4,-1.7 -2,-0.2 -5,-0.2 -3,-0.2 0.977 136.1 -22.0 -59.0 -54.5 -4.0 1.3 12.0 140 180 A D T <5S+ 0 0 122 -4,-1.9 -2,-0.2 3,-0.1 -1,-0.2 0.227 128.2 76.7-141.4 13.5 -2.4 -1.2 14.4 141 181 A H T >5S+ 0 0 6 -4,-0.3 3,-2.2 -3,-0.0 4,-2.1 0.188 105.7 87.9-177.6 -36.7 1.8 -2.5 10.7 143 183 A E H 3> S+ 0 0 77 0, 0.0 4,-0.9 0, 0.0 -1,-0.3 0.779 111.6 39.6 -47.6 -28.0 4.3 -0.5 15.1 145 185 A W H <> S+ 0 0 63 -3,-2.2 4,-1.9 2,-0.2 5,-0.3 0.805 104.7 65.0 -93.4 -32.5 6.8 -1.6 12.4 146 186 A I H X>S+ 0 0 3 -4,-2.1 5,-1.8 1,-0.2 4,-0.9 0.892 113.6 35.2 -57.6 -36.1 6.5 1.5 10.3 147 187 A Q H <5S+ 0 0 119 -4,-2.1 -1,-0.2 3,-0.2 -2,-0.2 0.868 108.9 63.2 -86.1 -38.5 8.1 3.5 13.2 148 188 A E H <5S+ 0 0 160 -4,-0.9 -2,-0.2 -5,-0.4 -1,-0.2 0.860 109.5 43.6 -55.0 -31.6 10.4 0.7 14.4 149 189 A N H <5S- 0 0 78 -4,-1.9 -1,-0.2 -5,-0.0 -2,-0.2 0.836 140.4 -76.6 -83.3 -32.5 12.1 1.0 11.0 150 190 A G T <5 - 0 0 41 -4,-0.9 -3,-0.2 -5,-0.3 3,-0.2 0.069 69.4 -95.5 161.7 -33.3 12.2 4.8 11.0 151 191 A G >>< - 0 0 7 -5,-1.8 4,-1.9 -6,-0.2 3,-1.4 -0.426 51.9 -62.7 115.4 166.7 8.6 6.0 10.2 152 192 A W H 3> S+ 0 0 12 1,-0.3 4,-1.5 2,-0.2 5,-0.3 0.901 130.3 66.1 -55.2 -38.1 6.9 7.1 6.9 153 193 A D H 3> S+ 0 0 118 1,-0.2 4,-2.5 2,-0.2 -1,-0.3 0.876 105.6 43.9 -52.7 -33.8 9.4 9.9 6.7 154 194 A T H <>>S+ 0 0 42 -3,-1.4 4,-2.7 2,-0.2 5,-0.6 0.906 102.5 64.5 -78.1 -40.9 12.1 7.2 6.2 155 195 A F H <>S+ 0 0 9 -4,-1.9 5,-1.0 1,-0.2 4,-0.5 0.800 119.2 27.1 -52.8 -25.1 9.9 5.3 3.8 156 196 A V H <5S+ 0 0 4 -4,-1.5 -2,-0.2 3,-0.2 -1,-0.2 0.839 120.8 49.3-103.5 -55.6 10.2 8.4 1.5 157 197 A E H <5S+ 0 0 132 -4,-2.5 -3,-0.2 -5,-0.3 -2,-0.2 0.824 115.8 49.7 -55.4 -27.1 13.5 10.0 2.5 158 198 A L T <5S- 0 0 86 -4,-2.7 -1,-0.2 -5,-0.3 -3,-0.2 0.957 141.4 -8.8 -78.2 -52.0 15.1 6.5 2.1 159 199 A Y T + 0 0 139 -2,-0.2 4,-3.1 -3,-0.2 3,-0.5 0.939 39.3 149.4 -52.6 -89.9 26.0 8.8 -13.7 172 212 A E H >> S- 0 0 143 1,-0.3 2,-3.1 2,-0.2 3,-0.7 0.979 91.7 -43.8 52.8 75.7 29.7 9.4 -14.4 173 213 A R H 34 S- 0 0 167 1,-0.2 -1,-0.3 2,-0.1 -2,-0.1 -0.329 130.8 -25.1 69.5 -69.0 30.6 6.0 -15.8 174 214 A L H 34 S- 0 0 57 -2,-3.1 -1,-0.2 -3,-0.5 -2,-0.2 0.107 84.4-102.5-165.2 32.8 28.6 4.1 -13.1 175 215 A E H << S+ 0 0 143 -4,-3.1 2,-0.2 -3,-0.7 -3,-0.1 0.812 101.4 75.6 44.0 31.4 28.4 6.5 -10.0 176 216 A H S < S- 0 0 120 -4,-0.5 -2,-0.3 -5,-0.2 -1,-0.2 -0.839 83.8-120.9-150.6-172.2 31.2 4.3 -8.6 177 217 A H - 0 0 178 -2,-0.2 -2,-0.1 -3,-0.1 -4,-0.0 0.068 53.3-104.8-128.3 24.7 34.9 3.5 -8.9 178 218 A H + 0 0 107 1,-0.1 -2,-0.0 -4,-0.1 0, 0.0 0.929 52.6 172.7 53.8 44.0 34.9 -0.2 -9.8 179 219 A H + 0 0 147 1,-0.1 2,-1.0 2,-0.0 -1,-0.1 0.840 50.9 98.6 -54.2 -29.3 36.0 -1.0 -6.3 180 220 A H 0 0 160 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.423 360.0 360.0 -62.4 101.2 35.4 -4.7 -7.3 181 221 A H 0 0 200 -2,-1.0 -2,-0.0 0, 0.0 -3,-0.0 -0.530 360.0 360.0-113.9 360.0 39.0 -5.7 -8.1