==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER APOPTOSIS 09-NOV-08 3F7H . COMPND 2 MOLECULE: BACULOVIRAL IAP REPEAT-CONTAINING PROTEIN 7; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.C.FRANKLIN,W.J.FAIRBROTHER,F.COHEN . 183 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10349.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 106 57.9 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 . 14 7.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 2.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 1.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 24 13.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 54 29.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 2.2 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 4 3 2 0 1 0 0 0 0 0 0 0 0 0 0 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 2 2 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 2 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 78 A G 0 0 101 0, 0.0 74,-0.1 0, 0.0 2,-0.0 0.000 360.0 360.0 360.0 176.1 77.8 84.1 22.6 2 79 A P - 0 0 45 0, 0.0 47,-0.2 0, 0.0 48,-0.1 -0.343 360.0-132.9 -68.2 146.5 78.0 80.4 23.4 3 80 A A S S+ 0 0 59 46,-2.1 46,-0.2 1,-0.3 47,-0.1 0.858 106.1 24.3 -59.4 -38.0 75.2 78.1 22.5 4 81 A F > + 0 0 68 44,-2.5 3,-2.0 1,-0.1 -1,-0.3 -0.727 69.0 177.5-135.6 77.3 75.4 76.6 26.0 5 82 A P G > S+ 0 0 91 0, 0.0 3,-2.0 0, 0.0 4,-0.2 0.783 74.9 71.8 -56.9 -29.7 76.9 79.1 28.5 6 83 A G G 3 S+ 0 0 41 1,-0.3 3,-0.3 2,-0.1 6,-0.0 0.696 97.9 48.6 -60.3 -23.0 76.4 76.7 31.4 7 84 A M G < S+ 0 0 3 -3,-2.0 -1,-0.3 1,-0.2 41,-0.2 0.100 77.2 107.9-104.3 22.6 79.2 74.5 30.1 8 85 A G < + 0 0 35 -3,-2.0 2,-0.5 40,-0.1 -1,-0.2 0.690 58.4 88.9 -68.2 -20.5 81.6 77.3 29.6 9 86 A S > - 0 0 54 -3,-0.3 4,-2.2 -4,-0.2 5,-0.2 -0.710 69.6-150.1 -83.3 123.2 83.7 76.2 32.6 10 87 A E H > S+ 0 0 103 -2,-0.5 4,-2.7 1,-0.2 5,-0.2 0.882 98.3 55.3 -56.9 -40.1 86.4 73.6 31.8 11 88 A E H > S+ 0 0 55 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.896 107.7 48.2 -63.8 -40.7 86.1 72.1 35.2 12 89 A L H > S+ 0 0 33 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.902 111.3 51.0 -65.2 -41.2 82.3 71.5 34.7 13 90 A R H < S+ 0 0 4 -4,-2.2 25,-0.5 1,-0.2 4,-0.4 0.930 109.7 50.3 -60.0 -44.4 83.0 70.0 31.3 14 91 A L H >< S+ 0 0 35 -4,-2.7 3,-1.7 1,-0.2 -2,-0.2 0.912 105.7 55.9 -60.4 -41.7 85.6 67.6 32.9 15 92 A A H >< S+ 0 0 5 -4,-2.1 3,-1.3 1,-0.3 -1,-0.2 0.828 96.0 66.5 -61.0 -30.6 83.2 66.5 35.6 16 93 A S T 3< S+ 0 0 29 -4,-1.3 3,-0.5 -3,-0.4 -1,-0.3 0.695 90.3 66.3 -63.3 -19.9 80.7 65.5 32.9 17 94 A F T X + 0 0 8 -3,-1.7 3,-2.0 -4,-0.4 -1,-0.3 0.167 61.1 117.4 -88.9 18.9 83.2 62.7 31.8 18 95 A Y T < S+ 0 0 69 -3,-1.3 -1,-0.2 1,-0.3 79,-0.2 0.820 86.9 33.1 -58.8 -31.4 82.8 60.7 35.0 19 96 A D T 3 S+ 0 0 108 -3,-0.5 -1,-0.3 76,-0.1 -2,-0.1 -0.036 83.9 148.8-113.8 29.8 81.4 57.7 33.1 20 97 A W < - 0 0 13 -3,-2.0 3,-0.5 1,-0.1 23,-0.1 -0.444 38.2-151.9 -63.3 129.5 83.4 58.2 29.9 21 98 A P S S+ 0 0 80 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.493 84.0 53.7 -84.0 -3.3 84.0 54.8 28.3 22 99 A L > + 0 0 37 4,-0.2 4,-3.0 1,-0.1 -2,-0.0 -0.252 57.7 143.0-127.8 45.7 87.3 55.7 26.4 23 100 A T T 4 S+ 0 0 87 -3,-0.5 -1,-0.1 1,-0.2 -3,-0.0 0.898 80.2 37.3 -58.7 -46.9 89.6 57.1 29.1 24 101 A A T 4 S+ 0 0 94 1,-0.2 -1,-0.2 -3,-0.1 36,-0.1 0.846 120.7 47.8 -71.2 -34.0 92.9 55.5 27.7 25 102 A E T 4 S+ 0 0 80 1,-0.3 35,-2.4 34,-0.1 36,-0.2 0.846 131.4 8.4 -80.0 -38.8 91.9 56.0 24.1 26 103 A V S < S- 0 0 0 -4,-3.0 -1,-0.3 33,-0.2 -4,-0.2 -0.833 86.1-130.2-146.7 100.4 90.7 59.7 24.2 27 104 A P >> - 0 0 44 0, 0.0 4,-2.0 0, 0.0 3,-0.7 -0.292 1.9-142.1 -63.2 130.9 91.4 61.5 27.5 28 105 A P H 3> S+ 0 0 11 0, 0.0 4,-3.0 0, 0.0 5,-0.3 0.841 101.5 63.1 -51.5 -37.7 88.6 63.4 29.2 29 106 A E H 3> S+ 0 0 114 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.894 107.8 40.9 -56.0 -42.6 91.1 66.1 30.2 30 107 A L H <> S+ 0 0 89 -3,-0.7 4,-1.7 2,-0.2 -1,-0.2 0.858 113.3 52.9 -77.8 -37.5 91.8 66.9 26.5 31 108 A L H <>S+ 0 0 0 -4,-2.0 5,-2.2 2,-0.2 -2,-0.2 0.949 113.1 44.6 -58.2 -50.6 88.1 66.7 25.4 32 109 A A H ><5S+ 0 0 0 -4,-3.0 3,-1.8 1,-0.2 -2,-0.2 0.906 111.1 52.9 -61.2 -44.7 87.2 69.1 28.2 33 110 A A H 3<5S+ 0 0 26 -4,-1.9 -1,-0.2 -5,-0.3 -2,-0.2 0.851 105.6 56.6 -59.4 -33.9 90.1 71.5 27.4 34 111 A A T 3<5S- 0 0 0 -4,-1.7 -1,-0.3 -3,-0.1 -2,-0.2 0.292 127.3 -96.4 -85.0 9.2 88.9 71.5 23.7 35 112 A G T < 5S+ 0 0 0 -3,-1.8 13,-2.4 1,-0.3 2,-0.3 0.365 81.3 131.3 98.7 -2.9 85.4 72.7 24.7 36 113 A F E < -A 47 0A 0 -5,-2.2 2,-0.3 11,-0.2 -1,-0.3 -0.596 34.1-170.6 -92.3 142.7 83.6 69.3 24.8 37 114 A F E -A 46 0A 21 9,-2.4 9,-2.0 -2,-0.3 2,-0.4 -0.917 31.5-107.6-119.9 155.0 81.3 67.9 27.4 38 115 A H E -A 45 0A 16 -25,-0.5 7,-0.2 -2,-0.3 -20,-0.1 -0.688 14.7-154.8 -81.4 128.0 80.0 64.3 27.6 39 116 A T - 0 0 53 5,-2.2 -1,-0.1 -2,-0.4 6,-0.1 0.730 40.6-118.4 -70.2 -22.4 76.3 63.9 26.8 40 117 A G S S+ 0 0 49 4,-0.5 2,-0.5 1,-0.3 5,-0.1 0.220 83.9 104.2 100.3 -11.9 76.2 60.7 28.9 41 118 A H S > S- 0 0 126 3,-0.3 3,-2.2 0, 0.0 -1,-0.3 -0.913 95.3 -54.6-107.2 125.7 75.3 58.4 25.9 42 119 A Q T 3 S- 0 0 121 -2,-0.5 -2,-0.2 1,-0.3 13,-0.0 -0.139 107.6 -38.3 47.3-132.5 77.9 56.2 24.3 43 120 A D T 3 S+ 0 0 23 -23,-0.1 2,-0.3 -22,-0.1 -1,-0.3 0.012 95.6 139.2-109.8 28.2 80.9 58.4 23.3 44 121 A K < + 0 0 65 -3,-2.2 -5,-2.2 11,-0.1 -4,-0.5 -0.565 24.9 173.6 -77.3 128.6 78.8 61.3 22.1 45 122 A V E -AB 38 54A 2 9,-2.4 9,-2.0 -2,-0.3 2,-0.3 -0.871 14.6-156.2-128.3 164.4 80.2 64.8 23.1 46 123 A R E -AB 37 53A 80 -9,-2.0 -9,-2.4 -2,-0.3 2,-0.4 -0.999 20.9-119.6-141.9 143.8 79.3 68.4 22.3 47 124 A C E > -A 36 0A 0 5,-2.0 4,-1.4 -2,-0.3 -11,-0.2 -0.685 18.7-143.0 -79.2 133.1 81.1 71.7 22.2 48 125 A F T 4 S+ 0 0 13 -13,-2.4 -44,-2.5 -2,-0.4 -45,-0.2 0.785 95.7 43.3 -65.2 -27.5 79.5 74.2 24.7 49 126 A F T 4 S+ 0 0 51 -14,-0.2 -46,-2.1 -47,-0.2 -1,-0.2 0.949 128.7 19.4 -88.9 -54.7 80.1 77.1 22.3 50 127 A C T 4 S- 0 0 47 -48,-0.1 -2,-0.1 2,-0.1 3,-0.1 0.570 91.9-133.5 -91.8 -11.2 79.2 75.9 18.8 51 128 A Y < + 0 0 113 -4,-1.4 2,-0.3 1,-0.2 -3,-0.1 0.641 47.8 159.8 65.7 18.3 77.0 73.0 20.0 52 129 A G - 0 0 10 19,-0.1 -5,-2.0 -6,-0.1 2,-0.3 -0.555 29.4-145.0 -74.3 130.8 78.7 70.7 17.4 53 130 A G E -B 46 0A 40 -2,-0.3 2,-0.3 -7,-0.2 -7,-0.2 -0.782 17.1-176.3-100.5 142.8 78.4 67.0 18.3 54 131 A L E +B 45 0A 24 -9,-2.0 -9,-2.4 -2,-0.3 2,-0.2 -0.999 9.2 159.3-136.3 139.0 81.0 64.3 17.7 55 132 A Q + 0 0 104 -2,-0.3 -11,-0.1 -11,-0.2 -13,-0.1 -0.774 46.6 63.6-140.9-172.8 80.9 60.6 18.3 56 133 A S - 0 0 76 -2,-0.2 -1,-0.1 1,-0.2 2,-0.1 0.929 69.4-167.1 54.4 49.8 82.7 57.4 17.1 57 134 A W - 0 0 16 -14,-0.2 2,-0.3 -3,-0.1 -1,-0.2 -0.432 7.8-143.1 -67.7 137.7 86.0 58.5 18.6 58 135 A K > - 0 0 140 -2,-0.1 3,-2.3 1,-0.1 -1,-0.0 -0.790 31.4 -89.5-103.1 148.1 89.0 56.5 17.5 59 136 A R T 3 S+ 0 0 222 -2,-0.3 -33,-0.2 1,-0.3 -34,-0.1 -0.303 115.5 21.0 -56.7 134.6 92.0 55.7 19.8 60 137 A G T 3 S+ 0 0 70 -35,-2.4 -1,-0.3 1,-0.3 -34,-0.1 0.403 84.7 152.8 84.2 -2.4 94.5 58.5 19.5 61 138 A D < - 0 0 39 -3,-2.3 -1,-0.3 -36,-0.2 3,-0.1 -0.338 42.1-135.3 -55.8 140.1 92.1 61.1 18.2 62 139 A D > - 0 0 77 1,-0.1 4,-2.5 -36,-0.1 5,-0.2 -0.913 6.9-150.6-102.0 112.4 93.1 64.7 19.1 63 140 A P H > S+ 0 0 1 0, 0.0 4,-2.2 0, 0.0 -1,-0.1 0.852 95.7 49.4 -52.9 -41.9 90.1 66.6 20.3 64 141 A W H > S+ 0 0 37 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.900 111.5 49.9 -64.2 -41.9 91.4 70.0 19.1 65 142 A T H > S+ 0 0 48 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.926 112.6 46.5 -59.4 -47.6 92.2 68.6 15.7 66 143 A E H X S+ 0 0 33 -4,-2.5 4,-2.3 2,-0.2 5,-0.4 0.874 110.1 54.3 -63.7 -38.1 88.7 67.1 15.4 67 144 A H H X S+ 0 0 0 -4,-2.2 4,-2.4 -5,-0.2 -2,-0.2 0.935 114.5 40.1 -59.7 -47.6 87.1 70.4 16.6 68 145 A A H < S+ 0 0 0 -4,-2.3 -2,-0.2 2,-0.2 -1,-0.2 0.828 113.3 55.9 -72.9 -34.0 89.0 72.3 13.8 69 146 A K H < S+ 0 0 106 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.948 123.4 21.7 -59.8 -50.8 88.4 69.6 11.3 70 147 A W H < S+ 0 0 141 -4,-2.3 -2,-0.2 1,-0.2 -3,-0.2 0.770 134.6 31.0 -96.1 -31.1 84.6 69.5 11.6 71 148 A F >< + 0 0 48 -4,-2.4 3,-2.0 -5,-0.4 -1,-0.2 -0.422 62.6 156.5-128.4 59.7 83.7 72.9 13.1 72 149 A P T 3 S+ 0 0 52 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.662 71.4 61.1 -63.8 -17.9 86.3 75.4 11.8 73 150 A G T 3 S+ 0 0 58 -3,-0.1 2,-0.2 4,-0.0 -5,-0.1 0.453 72.6 125.2 -86.3 -2.1 84.0 78.4 12.3 74 151 A C <> - 0 0 6 -3,-2.0 4,-2.0 -7,-0.2 5,-0.1 -0.397 52.3-152.4 -62.1 127.9 83.7 77.9 16.1 75 152 A Q H > S+ 0 0 107 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.794 94.8 55.3 -76.9 -29.3 84.7 81.1 17.9 76 153 A F H > S+ 0 0 38 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.916 109.7 48.5 -62.0 -46.5 85.8 79.3 21.1 77 154 A L H >>S+ 0 0 0 2,-0.2 4,-3.1 1,-0.2 5,-0.6 0.926 113.6 46.9 -55.3 -48.7 88.2 77.2 18.9 78 155 A L H X5S+ 0 0 50 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.938 113.4 47.2 -62.0 -48.9 89.4 80.4 17.2 79 156 A R H <5S+ 0 0 231 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.884 120.2 39.5 -59.3 -40.7 89.9 82.3 20.5 80 157 A S H <5S+ 0 0 56 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.904 131.8 19.0 -78.0 -45.1 91.7 79.3 22.0 81 158 A K H <5S- 0 0 82 -4,-3.1 4,-0.5 -5,-0.2 -3,-0.2 0.617 98.3-128.5-109.5 -19.0 93.9 78.0 19.1 82 159 A G X< - 0 0 28 -4,-2.1 4,-1.3 -5,-0.6 3,-0.1 0.114 28.2 -81.2 85.2 160.9 94.1 80.9 16.6 83 160 A Q H > S+ 0 0 93 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.834 122.1 60.3 -70.3 -36.6 93.4 81.0 12.8 84 161 A E H > S+ 0 0 138 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.906 105.0 50.5 -58.5 -44.0 96.8 79.6 11.7 85 162 A Y H > S+ 0 0 56 -4,-0.5 4,-1.5 2,-0.2 -1,-0.2 0.914 112.5 45.9 -57.8 -47.3 96.0 76.4 13.6 86 163 A I H X S+ 0 0 4 -4,-1.3 4,-1.2 1,-0.2 -2,-0.2 0.927 112.7 50.7 -65.1 -44.8 92.6 76.0 12.0 87 164 A N H < S+ 0 0 83 -4,-2.9 3,-0.2 1,-0.2 -1,-0.2 0.873 107.8 53.0 -59.1 -41.2 94.0 76.8 8.5 88 165 A N H < S+ 0 0 129 -4,-2.2 -1,-0.2 2,-0.2 -2,-0.2 0.842 102.2 57.2 -68.1 -34.5 96.8 74.2 8.8 89 166 A I H < 0 0 53 -4,-1.5 -1,-0.2 1,-0.3 -2,-0.2 0.811 360.0 360.0 -66.0 -29.8 94.3 71.4 9.7 90 167 A H < 0 0 138 -4,-1.2 -1,-0.3 -3,-0.2 -2,-0.2 0.270 360.0 360.0 -95.4 360.0 92.6 72.3 6.4 91 !* 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 92 78 B G 0 0 106 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-175.4 89.2 49.0 42.4 93 79 B P - 0 0 62 0, 0.0 47,-0.2 0, 0.0 48,-0.2 -0.376 360.0-148.3 -61.9 131.8 87.9 52.6 42.4 94 80 B A S S+ 0 0 40 46,-1.7 46,-0.2 1,-0.3 45,-0.1 0.896 92.4 18.0 -67.5 -43.4 84.6 52.8 40.6 95 81 B F S > S+ 0 0 11 44,-3.3 3,-1.6 1,-0.1 -1,-0.3 -0.721 70.5 178.9-132.3 77.4 85.1 56.4 39.3 96 82 B P G > S+ 0 0 91 0, 0.0 3,-1.8 0, 0.0 4,-0.1 0.843 79.4 59.0 -53.0 -40.4 88.9 57.1 39.4 97 83 B G G > S+ 0 0 53 1,-0.3 3,-0.9 -79,-0.2 6,-0.1 0.764 97.8 61.5 -60.3 -26.8 88.5 60.6 37.9 98 84 B M G < S+ 0 0 2 -3,-1.6 -1,-0.3 1,-0.2 41,-0.2 0.239 71.9 97.5 -88.3 14.5 86.2 61.6 40.7 99 85 B G G < + 0 0 37 -3,-1.8 2,-0.6 40,-0.1 -1,-0.2 0.645 64.5 91.5 -70.1 -16.3 89.0 61.0 43.3 100 86 B S S <> S- 0 0 54 -3,-0.9 4,-2.2 1,-0.2 5,-0.2 -0.742 70.0-154.9 -78.0 117.2 89.5 64.7 43.1 101 87 B E H > S+ 0 0 89 -2,-0.6 4,-2.5 1,-0.2 5,-0.2 0.869 95.3 57.2 -60.9 -36.7 87.4 66.4 45.7 102 88 B E H > S+ 0 0 135 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.898 108.3 46.0 -60.0 -42.6 87.4 69.6 43.6 103 89 B L H > S+ 0 0 14 2,-0.2 4,-1.6 1,-0.2 -2,-0.2 0.879 110.1 53.5 -69.8 -37.4 85.9 67.7 40.7 104 90 B R H < S+ 0 0 9 -4,-2.2 25,-0.5 2,-0.2 4,-0.4 0.935 110.1 47.9 -59.5 -43.6 83.3 66.0 42.9 105 91 B L H >< S+ 0 0 74 -4,-2.5 3,-1.6 1,-0.2 -2,-0.2 0.910 106.7 57.3 -65.1 -40.2 82.3 69.5 44.1 106 92 B A H >< S+ 0 0 15 -4,-2.1 3,-1.8 1,-0.3 -1,-0.2 0.850 94.4 66.6 -55.8 -37.1 82.1 70.7 40.5 107 93 B S G >< S+ 0 0 7 -4,-1.6 3,-0.6 1,-0.3 -1,-0.3 0.699 89.7 67.1 -60.9 -20.2 79.6 67.9 39.7 108 94 B F G X + 0 0 11 -3,-1.6 3,-1.8 -4,-0.4 -1,-0.3 0.219 62.3 109.3 -86.4 13.3 77.1 69.6 42.0 109 95 B Y G < S+ 0 0 124 -3,-1.8 -1,-0.2 1,-0.3 -2,-0.1 0.819 89.5 37.6 -56.0 -30.6 76.7 72.7 39.7 110 96 B D G < S+ 0 0 59 -3,-0.6 -1,-0.3 2,-0.0 -2,-0.1 -0.040 81.5 149.1-113.1 27.8 73.2 71.4 39.0 111 97 B W < - 0 0 26 -3,-1.8 23,-0.1 1,-0.1 -3,-0.0 -0.386 61.1 -94.0 -56.1 134.7 72.3 70.1 42.5 112 98 B P > - 0 0 33 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 -0.280 21.0-135.3 -60.3 142.5 68.5 70.5 42.8 113 99 B L T 3 S+ 0 0 183 1,-0.3 -2,-0.1 -3,-0.1 -3,-0.0 0.625 107.1 58.2 -72.3 -12.8 67.3 73.7 44.5 114 100 B T T 3 S+ 0 0 124 2,-0.0 -1,-0.3 0, 0.0 20,-0.0 0.508 82.1 119.3 -87.5 -9.4 64.9 71.6 46.5 115 101 B A < - 0 0 27 -3,-1.5 34,-0.1 1,-0.1 -4,-0.0 -0.142 52.8-153.5 -65.7 156.9 67.8 69.5 48.0 116 102 B E S S+ 0 0 88 32,-0.3 35,-0.5 1,-0.1 36,-0.1 0.379 70.2 61.9-117.6 0.9 68.3 69.4 51.8 117 103 B V S S- 0 0 7 33,-0.1 -1,-0.1 31,-0.1 31,-0.1 -0.997 84.6-111.0-133.3 134.4 72.0 68.6 52.2 118 104 B P >> - 0 0 63 0, 0.0 4,-1.8 0, 0.0 3,-0.7 -0.420 12.7-131.7 -73.8 137.7 74.9 70.9 51.0 119 105 B P H 3> S+ 0 0 34 0, 0.0 4,-2.9 0, 0.0 5,-0.3 0.830 104.2 63.2 -46.2 -40.9 77.3 69.9 48.1 120 106 B E H 3> S+ 0 0 103 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.917 107.1 41.6 -59.2 -43.8 80.3 70.8 50.1 121 107 B L H <> S+ 0 0 77 -3,-0.7 4,-1.2 2,-0.2 -1,-0.2 0.883 114.8 51.3 -69.1 -40.4 79.6 68.2 52.8 122 108 B L H ><>S+ 0 0 0 -4,-1.8 5,-2.1 1,-0.2 3,-0.5 0.943 110.4 47.9 -62.6 -48.7 78.7 65.5 50.2 123 109 B A H ><5S+ 0 0 0 -4,-2.9 3,-1.6 1,-0.2 -1,-0.2 0.884 107.4 57.1 -59.3 -39.6 81.8 66.0 48.1 124 110 B A H 3<5S+ 0 0 28 -4,-1.6 -1,-0.2 -5,-0.3 -2,-0.2 0.825 103.9 53.8 -60.9 -32.7 84.0 65.9 51.3 125 111 B A T <<5S- 0 0 0 -4,-1.2 -1,-0.3 -3,-0.5 -2,-0.2 0.200 128.4 -94.1 -90.5 14.9 82.5 62.4 52.1 126 112 B G T < 5S+ 0 0 0 -3,-1.6 13,-2.4 1,-0.3 2,-0.3 0.412 82.5 132.3 94.9 -0.3 83.5 61.0 48.7 127 113 B F E < -C 138 0B 0 -5,-2.1 2,-0.3 11,-0.2 -1,-0.3 -0.601 31.6-174.1 -92.7 144.8 80.2 61.6 46.9 128 114 B F E -C 137 0B 0 9,-2.3 9,-2.3 -2,-0.3 2,-0.3 -0.958 30.4-106.3-131.1 154.2 79.6 63.2 43.5 129 115 B H E -C 136 0B 4 -25,-0.5 7,-0.2 -2,-0.3 -20,-0.1 -0.593 14.5-154.5 -81.3 135.0 76.3 64.1 41.7 130 116 B T - 0 0 19 5,-2.2 -1,-0.1 -2,-0.3 6,-0.1 0.561 45.3-109.4 -83.2 -9.8 75.1 61.9 38.8 131 117 B G S S+ 0 0 33 4,-0.4 2,-0.4 2,-0.2 5,-0.1 0.448 89.0 100.5 93.9 3.4 73.1 64.8 37.2 132 118 B H S > S- 0 0 111 3,-0.3 3,-2.1 -20,-0.0 -2,-0.3 -0.985 94.2 -50.5-128.6 123.6 69.7 63.3 38.1 133 119 B Q T 3 S- 0 0 116 -2,-0.4 -2,-0.2 1,-0.2 -18,-0.1 -0.182 107.7 -41.5 48.1-142.4 67.5 64.4 41.0 134 120 B D T 3 S+ 0 0 22 -23,-0.1 2,-0.3 -3,-0.1 -1,-0.2 -0.100 95.9 144.2-103.0 34.6 69.6 64.5 44.2 135 121 B K < + 0 0 65 -3,-2.1 -5,-2.2 11,-0.1 -4,-0.4 -0.573 22.6 175.8 -78.3 129.7 71.3 61.2 43.3 136 122 B V E -CD 129 145B 1 9,-2.4 9,-2.2 -2,-0.3 2,-0.3 -0.926 13.8-157.8-129.2 156.7 75.0 60.8 44.3 137 123 B R E -CD 128 144B 66 -9,-2.3 -9,-2.3 -2,-0.3 2,-0.4 -0.978 25.8-113.9-128.5 148.0 77.6 58.0 44.1 138 124 B C E > -C 127 0B 0 5,-1.8 4,-1.6 -2,-0.3 -11,-0.2 -0.671 23.2-138.9 -73.9 131.7 80.8 57.4 46.0 139 125 B F T 4 S+ 0 0 18 -13,-2.4 -44,-3.3 -2,-0.4 -45,-0.2 0.770 97.7 37.3 -63.3 -26.6 83.7 57.6 43.6 140 126 B F T 4 S+ 0 0 46 -14,-0.2 -46,-1.7 -47,-0.2 -1,-0.2 0.935 127.0 25.9 -92.6 -56.3 85.4 54.6 45.2 141 127 B C T 4 S- 0 0 43 -48,-0.2 -2,-0.1 2,-0.1 -1,-0.1 0.486 91.4-129.3 -92.4 -4.1 82.7 52.0 46.2 142 128 B Y < + 0 0 121 -4,-1.6 -3,-0.1 1,-0.2 -1,-0.1 0.143 50.7 157.0 80.0 -16.8 80.0 53.0 43.6 143 129 B G - 0 0 8 -6,-0.2 -5,-1.8 1,-0.1 2,-0.4 -0.126 29.3-149.3 -55.7 126.8 77.3 53.2 46.3 144 130 B G E +D 137 0B 37 -7,-0.2 2,-0.3 -17,-0.1 -7,-0.2 -0.793 17.2 178.3-100.9 136.8 74.4 55.4 45.4 145 131 B L E +D 136 0B 28 -9,-2.2 -9,-2.4 -2,-0.4 2,-0.2 -0.996 6.4 161.9-134.4 142.6 72.2 57.5 47.8 146 132 B Q + 0 0 94 -2,-0.3 -11,-0.1 -11,-0.2 -13,-0.1 -0.809 47.6 60.4-142.7-176.0 69.3 59.9 47.1 147 133 B S - 0 0 73 -2,-0.2 -1,-0.1 1,-0.2 2,-0.1 0.923 69.4-165.2 54.5 48.5 66.4 61.5 48.9 148 134 B W - 0 0 9 -14,-0.2 -32,-0.3 -3,-0.1 2,-0.3 -0.413 2.9-149.7 -64.5 136.1 68.7 63.3 51.3 149 135 B K > - 0 0 119 -2,-0.1 3,-2.6 -33,-0.1 -1,-0.0 -0.830 28.0 -84.8-113.8 149.8 66.9 64.8 54.3 150 136 B R T 3 S+ 0 0 203 -2,-0.3 -33,-0.1 1,-0.3 3,-0.1 -0.248 117.5 23.7 -48.2 129.0 67.6 67.8 56.4 151 137 B G T 3 S+ 0 0 76 -35,-0.5 -1,-0.3 1,-0.3 2,-0.1 0.254 84.6 142.0 93.8 -12.3 70.1 66.9 59.1 152 138 B D < - 0 0 45 -3,-2.6 -1,-0.3 -36,-0.1 3,-0.1 -0.420 43.5-145.2 -60.6 135.7 71.6 63.9 57.2 153 139 B D > - 0 0 67 1,-0.1 4,-2.5 -3,-0.1 3,-0.3 -0.938 3.9-146.8-105.2 113.5 75.4 63.7 57.7 154 140 B P H > S+ 0 0 2 0, 0.0 4,-2.5 0, 0.0 -1,-0.1 0.858 97.5 49.3 -49.5 -43.7 77.1 62.4 54.5 155 141 B W H > S+ 0 0 42 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.919 111.8 49.3 -62.6 -42.8 79.9 60.5 56.4 156 142 B T H > S+ 0 0 32 -3,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.921 112.5 46.9 -62.3 -44.8 77.3 58.8 58.7 157 143 B E H X S+ 0 0 19 -4,-2.5 4,-2.4 2,-0.2 5,-0.4 0.896 108.2 56.4 -65.2 -40.2 75.2 57.8 55.7 158 144 B H H X S+ 0 0 0 -4,-2.5 4,-2.2 -5,-0.3 -1,-0.2 0.926 113.1 41.5 -53.0 -46.9 78.3 56.5 53.9 159 145 B A H < S+ 0 0 0 -4,-2.1 -2,-0.2 2,-0.2 -1,-0.2 0.861 112.5 54.5 -71.9 -38.7 79.0 54.2 56.9 160 146 B K H < S+ 0 0 64 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.934 122.9 24.1 -57.3 -50.1 75.4 53.2 57.4 161 147 B W H < S+ 0 0 154 -4,-2.4 -2,-0.2 1,-0.2 -3,-0.2 0.764 133.2 30.8 -96.2 -28.7 74.8 52.0 53.8 162 148 B F >< + 0 0 48 -4,-2.2 3,-1.9 -5,-0.4 -1,-0.2 -0.447 61.4 156.6-132.0 59.0 78.3 51.1 52.5 163 149 B P T 3 S+ 0 0 52 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.647 72.1 61.9 -63.2 -16.8 80.4 49.9 55.5 164 150 B G T 3 S+ 0 0 72 -3,-0.1 2,-0.2 -23,-0.0 -5,-0.1 0.447 72.7 125.8 -86.6 -2.2 82.8 47.9 53.3 165 151 B C <> - 0 0 5 -3,-1.9 4,-2.0 -7,-0.2 5,-0.1 -0.380 52.0-152.7 -62.2 126.2 84.0 51.0 51.4 166 152 B Q H > S+ 0 0 136 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.806 95.9 54.2 -72.2 -32.7 87.8 51.2 51.4 167 153 B F H > S+ 0 0 41 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.926 109.9 48.3 -61.5 -48.0 87.7 55.1 51.1 168 154 B L H >>S+ 0 0 0 2,-0.2 4,-2.7 1,-0.2 5,-0.6 0.919 112.6 48.8 -54.6 -47.0 85.4 55.3 54.1 169 155 B L H X5S+ 0 0 74 -4,-2.0 4,-1.8 1,-0.2 -2,-0.2 0.931 112.8 46.3 -63.4 -46.6 87.7 52.9 56.1 170 156 B R H <5S+ 0 0 230 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.851 118.7 43.0 -61.2 -36.8 90.9 54.9 55.2 171 157 B S H <5S+ 0 0 55 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.856 133.1 12.9 -80.4 -39.0 89.1 58.2 56.0 172 158 B K H <5S- 0 0 81 -4,-2.7 4,-0.4 -5,-0.2 -3,-0.2 0.649 96.8-126.3-117.1 -24.9 87.3 57.3 59.2 173 159 B G X< - 0 0 27 -4,-1.8 4,-1.2 -5,-0.6 3,-0.1 0.027 31.2 -79.7 88.5 161.7 88.6 54.0 60.6 174 160 B Q H > S+ 0 0 93 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.832 122.8 59.4 -69.6 -35.5 86.8 50.8 61.6 175 161 B E H > S+ 0 0 169 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.897 103.9 52.1 -61.8 -42.3 85.6 51.9 65.0 176 162 B Y H > S+ 0 0 59 -4,-0.4 4,-1.5 2,-0.2 -1,-0.2 0.916 113.2 44.7 -57.0 -45.6 83.7 54.8 63.5 177 163 B I H X S+ 0 0 2 -4,-1.2 4,-1.6 2,-0.2 -2,-0.2 0.944 114.1 48.0 -67.4 -50.0 81.9 52.4 61.1 178 164 B N H X S+ 0 0 78 -4,-2.9 4,-1.9 1,-0.2 -2,-0.2 0.901 108.1 55.7 -58.1 -43.8 81.2 49.8 63.7 179 165 B N H X S+ 0 0 93 -4,-2.6 4,-2.6 1,-0.2 5,-0.3 0.872 104.8 52.6 -58.2 -40.7 79.8 52.4 66.2 180 166 B I H X S+ 0 0 10 -4,-1.5 4,-1.7 1,-0.2 -1,-0.2 0.897 112.5 45.3 -62.7 -39.7 77.3 53.6 63.6 181 167 B H H < S+ 0 0 93 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.763 114.9 48.1 -76.0 -23.7 76.1 50.0 63.1 182 168 B L H < S+ 0 0 144 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.857 113.8 44.6 -82.5 -37.7 76.0 49.4 66.8 183 169 B T H < 0 0 86 -4,-2.6 -2,-0.2 -5,-0.2 -3,-0.2 0.889 360.0 360.0 -73.9 -39.9 74.1 52.5 67.8 184 170 B H < 0 0 143 -4,-1.7 -3,-0.2 -5,-0.3 -2,-0.1 0.967 360.0 360.0 -81.6 360.0 71.5 52.2 65.0