==== 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 27-MAR-09 3GTA . COMPND 2 MOLECULE: BACULOVIRAL IAP REPEAT-CONTAINING 7; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.C.FRANKLIN,W.J.FAIRBROTHER,F.COHEN . 182 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10281.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 105 57.7 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 13.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 53 29.1 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 1 0 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 99 0, 0.0 74,-0.1 0, 0.0 2,-0.0 0.000 360.0 360.0 360.0 173.8 77.6 83.6 22.9 2 79 A P - 0 0 46 0, 0.0 47,-0.2 0, 0.0 48,-0.1 -0.352 360.0-135.3 -70.7 146.9 77.7 79.9 23.8 3 80 A A S S+ 0 0 59 46,-2.0 46,-0.2 1,-0.3 47,-0.1 0.862 105.1 24.0 -60.7 -39.1 74.8 77.6 22.9 4 81 A F > + 0 0 69 44,-2.7 3,-1.9 1,-0.1 -1,-0.3 -0.750 69.2 177.6-133.5 78.8 75.0 76.1 26.4 5 82 A P G > S+ 0 0 91 0, 0.0 3,-2.0 0, 0.0 4,-0.2 0.790 74.6 72.2 -56.5 -29.9 76.5 78.6 28.8 6 83 A G G 3 S+ 0 0 40 1,-0.3 3,-0.3 2,-0.1 6,-0.0 0.642 97.9 48.4 -60.6 -20.3 76.0 76.3 31.8 7 84 A M G < S+ 0 0 3 -3,-1.9 -1,-0.3 41,-0.2 41,-0.2 0.088 76.8 107.3-108.1 23.2 78.8 74.0 30.5 8 85 A G < + 0 0 36 -3,-2.0 2,-0.5 40,-0.1 -1,-0.1 0.680 58.4 90.3 -71.0 -19.1 81.3 76.8 30.0 9 86 A S > - 0 0 52 -3,-0.3 4,-2.2 -4,-0.2 5,-0.2 -0.704 68.9-151.1 -81.9 124.1 83.3 75.7 33.0 10 87 A E H > S+ 0 0 104 -2,-0.5 4,-2.6 1,-0.2 5,-0.2 0.879 98.0 55.8 -60.2 -38.8 86.0 73.2 32.2 11 88 A E H > S+ 0 0 78 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.913 107.4 47.5 -61.3 -45.9 85.7 71.7 35.6 12 89 A L H > S+ 0 0 31 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.910 111.9 51.3 -61.4 -41.7 81.9 71.1 35.2 13 90 A R H < S+ 0 0 5 -4,-2.2 25,-0.5 1,-0.2 4,-0.4 0.921 109.9 49.5 -61.0 -42.4 82.7 69.5 31.8 14 91 A L H >< S+ 0 0 44 -4,-2.6 3,-1.6 1,-0.2 -2,-0.2 0.914 106.3 55.6 -63.9 -41.8 85.3 67.2 33.3 15 92 A A H >< S+ 0 0 5 -4,-2.3 3,-1.2 1,-0.3 -1,-0.2 0.804 96.4 66.8 -59.5 -29.5 82.9 66.1 36.1 16 93 A S T 3< S+ 0 0 27 -4,-1.3 3,-0.5 -3,-0.4 -1,-0.3 0.693 89.5 66.4 -66.9 -19.5 80.4 65.0 33.4 17 94 A F T X + 0 0 8 -3,-1.6 3,-2.1 -4,-0.4 -1,-0.3 0.169 61.2 118.4 -87.9 18.4 82.8 62.2 32.3 18 95 A Y T < S+ 0 0 69 -3,-1.2 79,-0.2 1,-0.3 -1,-0.2 0.810 86.7 32.4 -58.2 -30.5 82.4 60.3 35.6 19 96 A D T 3 S+ 0 0 107 -3,-0.5 -1,-0.3 76,-0.1 -2,-0.1 -0.041 84.0 150.5-116.1 29.7 81.0 57.3 33.7 20 97 A W < - 0 0 14 -3,-2.1 3,-0.5 1,-0.1 23,-0.1 -0.423 37.9-150.6 -61.4 129.7 82.9 57.7 30.4 21 98 A P S S+ 0 0 79 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.502 85.4 51.6 -82.7 -4.2 83.4 54.3 28.8 22 99 A L > + 0 0 35 4,-0.2 4,-3.0 1,-0.1 -2,-0.1 -0.247 58.8 142.8-130.0 45.2 86.7 55.1 27.0 23 100 A T T 4 S+ 0 0 87 -3,-0.5 -1,-0.1 1,-0.2 -3,-0.0 0.898 79.7 39.4 -57.9 -47.0 89.1 56.5 29.6 24 101 A A T 4 S+ 0 0 94 1,-0.2 -1,-0.2 -3,-0.1 36,-0.1 0.861 119.4 47.6 -69.4 -35.3 92.3 54.9 28.3 25 102 A E T 4 S+ 0 0 64 1,-0.3 35,-2.2 34,-0.1 -2,-0.2 0.874 130.8 9.5 -78.5 -41.5 91.3 55.5 24.6 26 103 A V S < S- 0 0 0 -4,-3.0 -1,-0.3 33,-0.2 -4,-0.2 -0.867 85.8-130.1-142.8 102.4 90.3 59.1 24.7 27 104 A P >> - 0 0 44 0, 0.0 4,-2.1 0, 0.0 3,-0.6 -0.293 3.4-140.9 -61.1 129.8 91.1 61.0 28.0 28 105 A P H 3> S+ 0 0 10 0, 0.0 4,-3.0 0, 0.0 5,-0.3 0.844 102.8 63.6 -50.5 -37.3 88.2 63.0 29.7 29 106 A E H 3> S+ 0 0 114 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.904 107.3 41.3 -55.1 -44.0 90.8 65.6 30.6 30 107 A L H <> S+ 0 0 83 -3,-0.6 4,-1.7 2,-0.2 -1,-0.2 0.890 114.0 52.2 -73.5 -40.6 91.4 66.3 26.8 31 108 A L H <>S+ 0 0 0 -4,-2.1 5,-2.2 2,-0.2 -2,-0.2 0.947 112.9 44.3 -59.2 -49.5 87.7 66.1 25.9 32 109 A A H ><5S+ 0 0 0 -4,-3.0 3,-1.8 1,-0.2 -2,-0.2 0.904 111.0 53.9 -63.6 -42.3 86.8 68.6 28.6 33 110 A A H 3<5S+ 0 0 29 -4,-1.9 -1,-0.2 -5,-0.3 -2,-0.2 0.846 105.0 56.2 -59.4 -34.1 89.7 70.9 27.7 34 111 A A T 3<5S- 0 0 0 -4,-1.7 -1,-0.3 -3,-0.2 -2,-0.2 0.288 127.7 -97.2 -84.4 8.6 88.4 70.9 24.1 35 112 A G T < 5S+ 0 0 0 -3,-1.8 13,-2.2 1,-0.3 2,-0.3 0.368 80.8 132.0 98.4 -1.4 85.0 72.1 25.1 36 113 A F E < -A 47 0A 0 -5,-2.2 2,-0.3 11,-0.2 -1,-0.3 -0.588 33.9-170.3 -92.8 143.1 83.2 68.8 25.3 37 114 A F E -A 46 0A 21 9,-2.2 9,-2.1 -2,-0.3 2,-0.4 -0.918 31.8-107.5-120.0 155.0 80.9 67.3 27.9 38 115 A H E -A 45 0A 16 -25,-0.5 7,-0.2 -2,-0.3 -20,-0.1 -0.683 15.3-154.4 -80.4 128.1 79.6 63.8 28.1 39 116 A T - 0 0 54 5,-2.4 -1,-0.1 -2,-0.4 6,-0.1 0.752 39.7-119.2 -70.4 -23.0 75.9 63.4 27.3 40 117 A G S S+ 0 0 49 4,-0.5 2,-0.5 1,-0.2 5,-0.1 0.263 83.3 106.0 99.0 -8.9 75.8 60.2 29.4 41 118 A H S > S- 0 0 125 3,-0.3 3,-2.3 0, 0.0 -1,-0.2 -0.923 94.9 -55.5-108.8 122.9 74.7 58.1 26.5 42 119 A Q T 3 S- 0 0 126 -2,-0.5 -2,-0.2 1,-0.3 13,-0.0 -0.179 107.7 -37.9 47.5-132.2 77.3 55.7 24.9 43 120 A D T 3 S+ 0 0 23 -23,-0.1 2,-0.4 -22,-0.1 -1,-0.3 0.004 96.2 139.4-108.4 28.1 80.4 57.8 23.9 44 121 A K < + 0 0 70 -3,-2.3 -5,-2.4 11,-0.1 -4,-0.5 -0.577 24.9 174.5 -78.3 127.4 78.3 60.8 22.7 45 122 A V E -AB 38 54A 2 9,-2.5 9,-2.2 -2,-0.4 2,-0.3 -0.861 12.9-157.0-126.3 163.8 79.8 64.2 23.6 46 123 A R E -AB 37 53A 81 -9,-2.1 -9,-2.2 -2,-0.3 2,-0.4 -0.999 20.4-119.1-143.1 143.6 78.8 67.8 22.8 47 124 A C E > -A 36 0A 0 5,-2.2 4,-1.5 -2,-0.3 -11,-0.2 -0.680 17.4-144.1 -80.6 132.0 80.6 71.2 22.7 48 125 A F T 4 S+ 0 0 13 -13,-2.2 -44,-2.7 -2,-0.4 -45,-0.2 0.767 95.6 42.5 -65.7 -26.3 79.1 73.7 25.1 49 126 A F T 4 S+ 0 0 48 -47,-0.2 -46,-2.0 -14,-0.2 -1,-0.2 0.942 129.0 19.6 -89.5 -55.8 79.7 76.6 22.7 50 127 A C T 4 S- 0 0 46 -48,-0.1 -2,-0.2 2,-0.1 3,-0.1 0.590 91.9-133.1 -91.0 -13.0 78.7 75.4 19.1 51 128 A Y < + 0 0 115 -4,-1.5 2,-0.2 1,-0.2 -3,-0.1 0.637 48.6 159.4 66.6 18.0 76.6 72.4 20.4 52 129 A G - 0 0 8 19,-0.1 -5,-2.2 -6,-0.1 2,-0.3 -0.532 29.3-145.1 -72.2 134.0 78.3 70.2 17.9 53 130 A G E -B 46 0A 36 -2,-0.2 2,-0.3 -7,-0.2 -7,-0.2 -0.801 16.2-174.5-104.5 143.8 78.0 66.5 18.8 54 131 A L E +B 45 0A 24 -9,-2.2 -9,-2.5 -2,-0.3 2,-0.2 -0.999 9.9 160.2-136.1 140.5 80.5 63.7 18.3 55 132 A Q + 0 0 103 -2,-0.3 -11,-0.1 -11,-0.2 -13,-0.1 -0.763 47.7 60.1-140.0-175.3 80.4 59.9 18.8 56 133 A S - 0 0 72 -2,-0.2 -1,-0.1 1,-0.2 2,-0.1 0.913 69.5-167.1 54.1 49.0 82.1 56.7 17.7 57 134 A W - 0 0 16 -14,-0.2 2,-0.3 -3,-0.1 -1,-0.2 -0.432 7.0-144.8 -67.3 137.0 85.5 57.8 19.1 58 135 A K > - 0 0 139 -2,-0.1 3,-2.4 1,-0.1 -1,-0.0 -0.783 32.6 -85.7-103.4 150.2 88.5 55.8 18.1 59 136 A R T 3 S+ 0 0 206 -2,-0.3 -33,-0.2 1,-0.3 -34,-0.1 -0.281 116.1 17.6 -55.6 131.7 91.5 55.0 20.2 60 137 A G T 3 S+ 0 0 68 -35,-2.2 -1,-0.3 1,-0.3 -34,-0.1 0.370 84.6 152.1 84.5 -4.5 94.0 57.9 20.0 61 138 A D < - 0 0 39 -3,-2.4 -1,-0.3 -36,-0.1 -4,-0.0 -0.327 42.4-134.6 -53.1 139.0 91.5 60.4 18.6 62 139 A D > - 0 0 65 1,-0.1 4,-2.5 -3,-0.1 5,-0.3 -0.902 5.3-149.0-102.5 114.9 92.5 63.9 19.6 63 140 A P H > S+ 0 0 1 0, 0.0 4,-2.5 0, 0.0 5,-0.1 0.871 96.7 49.3 -51.2 -44.7 89.5 66.0 20.8 64 141 A W H > S+ 0 0 40 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.908 111.9 49.7 -61.9 -41.7 90.9 69.4 19.5 65 142 A T H > S+ 0 0 42 -3,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.928 112.7 46.0 -61.8 -46.6 91.6 67.9 16.1 66 143 A E H X S+ 0 0 23 -4,-2.5 4,-2.3 2,-0.2 5,-0.4 0.880 110.1 55.1 -65.4 -37.5 88.1 66.3 15.8 67 144 A H H X S+ 0 0 0 -4,-2.5 4,-2.4 -5,-0.3 -2,-0.2 0.928 113.6 40.9 -57.8 -47.0 86.6 69.7 17.0 68 145 A A H < S+ 0 0 0 -4,-2.2 -2,-0.2 2,-0.2 -1,-0.2 0.828 113.4 54.4 -72.7 -35.3 88.4 71.5 14.2 69 146 A K H < S+ 0 0 94 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.931 123.1 24.0 -60.8 -48.3 87.7 68.8 11.6 70 147 A W H < S+ 0 0 152 -4,-2.3 -2,-0.2 1,-0.2 -3,-0.2 0.769 134.3 29.0 -95.8 -30.9 83.9 68.8 12.1 71 148 A F >< + 0 0 51 -4,-2.4 3,-1.9 -5,-0.4 -1,-0.2 -0.458 62.1 157.3-132.1 61.3 83.1 72.2 13.5 72 149 A P T 3 S+ 0 0 53 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.629 71.9 62.5 -65.1 -14.5 85.7 74.7 12.2 73 150 A G T 3 S+ 0 0 59 -3,-0.1 2,-0.2 4,-0.0 -5,-0.1 0.423 71.7 124.5 -89.0 -0.2 83.4 77.7 12.7 74 151 A C <> - 0 0 6 -3,-1.9 4,-2.0 -7,-0.2 5,-0.1 -0.425 52.1-153.2 -65.3 127.7 83.2 77.2 16.5 75 152 A Q H > S+ 0 0 110 2,-0.2 4,-2.7 -2,-0.2 5,-0.2 0.796 94.9 56.0 -77.1 -28.7 84.2 80.5 18.3 76 153 A F H > S+ 0 0 16 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.930 109.4 47.9 -61.8 -47.6 85.4 78.6 21.4 77 154 A L H >>S+ 0 0 0 2,-0.2 4,-2.9 1,-0.2 5,-0.6 0.923 113.5 48.1 -54.8 -48.3 87.7 76.6 19.2 78 155 A L H X5S+ 0 0 50 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.943 113.3 45.8 -61.2 -49.5 88.9 79.7 17.4 79 156 A R H <5S+ 0 0 198 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.891 120.0 40.9 -61.5 -40.0 89.6 81.6 20.7 80 157 A S H <5S+ 0 0 52 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.904 131.7 18.4 -75.5 -44.8 91.4 78.7 22.3 81 158 A K H <5S- 0 0 85 -4,-2.9 4,-0.5 -5,-0.2 -3,-0.2 0.626 98.7-126.7-110.6 -18.9 93.5 77.3 19.4 82 159 A G X< - 0 0 28 -4,-2.1 4,-1.3 -5,-0.6 3,-0.2 0.093 28.5 -82.2 86.4 160.0 93.7 80.2 16.8 83 160 A Q H > S+ 0 0 93 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.834 121.7 60.9 -70.0 -34.8 92.9 80.3 13.1 84 161 A E H > S+ 0 0 158 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.892 104.0 50.4 -60.9 -42.5 96.2 78.8 11.9 85 162 A Y H > S+ 0 0 55 -4,-0.5 4,-1.4 2,-0.2 -1,-0.2 0.925 112.7 46.1 -58.6 -48.0 95.5 75.5 13.8 86 163 A I H X S+ 0 0 3 -4,-1.3 4,-1.3 1,-0.2 3,-0.3 0.924 112.4 50.9 -63.6 -45.7 92.1 75.2 12.3 87 164 A N H < S+ 0 0 94 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.867 106.9 54.0 -58.6 -40.7 93.4 76.0 8.8 88 165 A N H < S+ 0 0 140 -4,-2.1 -1,-0.2 2,-0.2 -2,-0.2 0.828 103.6 55.0 -67.2 -33.1 96.1 73.3 9.1 89 166 A I H < 0 0 50 -4,-1.4 -1,-0.2 -3,-0.3 -2,-0.2 0.826 360.0 360.0 -69.3 -31.8 93.6 70.6 10.0 90 167 A H < 0 0 135 -4,-1.3 -2,-0.2 -5,-0.1 -1,-0.2 0.474 360.0 360.0 -95.8 360.0 91.8 71.5 6.7 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 0 109 0, 0.0 2,-0.1 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0-170.5 88.7 48.6 42.8 93 79 B P - 0 0 62 0, 0.0 47,-0.2 0, 0.0 48,-0.2 -0.403 360.0-146.1 -61.4 131.2 87.5 52.2 42.9 94 80 B A S S+ 0 0 39 46,-1.8 46,-0.2 1,-0.3 45,-0.1 0.901 92.6 17.3 -64.2 -44.2 84.1 52.5 41.2 95 81 B F S > S+ 0 0 11 44,-3.2 3,-1.8 1,-0.1 -1,-0.3 -0.708 70.8 178.6-133.9 75.1 84.7 56.0 39.8 96 82 B P G > S+ 0 0 91 0, 0.0 3,-1.7 0, 0.0 4,-0.1 0.818 79.1 59.4 -52.9 -40.0 88.4 56.7 39.9 97 83 B G G > S+ 0 0 54 1,-0.3 3,-0.8 -79,-0.2 6,-0.1 0.770 97.6 61.5 -60.6 -27.4 88.1 60.1 38.4 98 84 B M G < S+ 0 0 1 -3,-1.8 -1,-0.3 1,-0.2 41,-0.2 0.216 71.0 99.5 -87.5 15.4 85.8 61.2 41.2 99 85 B G G < + 0 0 37 -3,-1.7 2,-0.6 40,-0.1 -1,-0.2 0.666 64.1 90.2 -69.3 -17.7 88.6 60.6 43.8 100 86 B S S <> S- 0 0 59 -3,-0.8 4,-2.3 1,-0.2 5,-0.2 -0.741 70.1-154.3 -79.9 117.3 89.1 64.4 43.6 101 87 B E H > S+ 0 0 98 -2,-0.6 4,-2.7 1,-0.2 5,-0.2 0.877 95.9 57.4 -58.2 -38.7 86.9 66.1 46.2 102 88 B E H > S+ 0 0 108 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.911 108.5 45.5 -58.2 -42.7 87.0 69.3 44.0 103 89 B L H > S+ 0 0 18 2,-0.2 4,-1.6 1,-0.2 -2,-0.2 0.885 110.6 53.2 -71.0 -38.1 85.5 67.3 41.1 104 90 B R H < S+ 0 0 7 -4,-2.3 25,-0.5 1,-0.2 4,-0.4 0.937 109.8 48.9 -58.3 -45.2 82.9 65.6 43.4 105 91 B L H >< S+ 0 0 64 -4,-2.7 3,-1.5 1,-0.2 -2,-0.2 0.902 106.2 56.9 -62.0 -40.6 81.9 69.1 44.5 106 92 B A H >< S+ 0 0 11 -4,-2.1 3,-1.7 1,-0.3 -1,-0.2 0.839 94.3 67.6 -57.6 -35.4 81.6 70.3 40.9 107 93 B S G >< S+ 0 0 7 -4,-1.6 3,-0.7 -3,-0.3 -1,-0.3 0.710 88.9 67.4 -59.6 -20.8 79.1 67.5 40.1 108 94 B F G X + 0 0 11 -3,-1.5 3,-1.9 -4,-0.4 -1,-0.3 0.235 62.0 109.8 -86.4 14.4 76.6 69.2 42.4 109 95 B Y G < S+ 0 0 125 -3,-1.7 -1,-0.2 1,-0.3 -2,-0.1 0.824 89.5 37.2 -56.6 -29.7 76.2 72.2 40.0 110 96 B D G < S+ 0 0 60 -3,-0.7 -1,-0.3 2,-0.0 -2,-0.1 -0.037 81.5 149.9-115.3 28.5 72.7 70.9 39.3 111 97 B W < - 0 0 27 -3,-1.9 23,-0.1 1,-0.1 -3,-0.1 -0.374 61.0 -92.9 -55.8 134.3 71.8 69.7 42.8 112 98 B P > - 0 0 33 0, 0.0 3,-1.6 0, 0.0 -1,-0.1 -0.258 21.7-135.9 -59.3 142.3 68.1 70.0 43.2 113 99 B L T 3 S+ 0 0 187 1,-0.3 -2,-0.1 -3,-0.1 -3,-0.0 0.629 106.6 58.5 -72.1 -12.8 66.9 73.3 44.8 114 100 B T T 3 S+ 0 0 124 2,-0.0 -1,-0.3 0, 0.0 20,-0.0 0.494 81.7 120.1 -88.1 -6.9 64.5 71.2 46.9 115 101 B A < - 0 0 28 -3,-1.6 34,-0.1 1,-0.1 -4,-0.0 -0.147 51.4-155.3 -68.0 157.6 67.3 69.1 48.5 116 102 B E S S+ 0 0 92 32,-0.4 35,-0.5 1,-0.1 -1,-0.1 0.380 71.1 62.9-117.7 1.6 67.9 69.1 52.2 117 103 B V S S- 0 0 6 33,-0.1 -1,-0.1 31,-0.1 31,-0.1 -0.997 84.4-113.4-133.4 133.2 71.6 68.3 52.6 118 104 B P >> - 0 0 62 0, 0.0 4,-1.7 0, 0.0 3,-0.6 -0.417 10.7-131.7 -76.8 139.7 74.4 70.5 51.3 119 105 B P H 3> S+ 0 0 34 0, 0.0 4,-3.0 0, 0.0 5,-0.3 0.840 103.8 64.1 -46.4 -43.2 76.8 69.5 48.5 120 106 B E H 3> S+ 0 0 141 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.911 107.7 40.3 -53.1 -47.6 79.9 70.5 50.5 121 107 B L H <> S+ 0 0 85 -3,-0.6 4,-1.1 2,-0.2 -1,-0.2 0.866 114.7 52.4 -70.6 -38.7 79.2 67.8 53.2 122 108 B L H ><>S+ 0 0 0 -4,-1.7 5,-2.0 2,-0.2 3,-0.7 0.950 110.2 47.3 -63.4 -49.1 78.3 65.2 50.6 123 109 B A H ><5S+ 0 0 0 -4,-3.0 3,-1.6 1,-0.2 -1,-0.2 0.878 107.8 57.3 -59.8 -38.5 81.4 65.7 48.6 124 110 B A H 3<5S+ 0 0 34 -4,-1.6 -1,-0.2 -5,-0.3 -2,-0.2 0.796 103.4 54.2 -62.9 -29.7 83.5 65.5 51.7 125 111 B A T <<5S- 0 0 0 -4,-1.1 -1,-0.3 -3,-0.7 -2,-0.2 0.185 128.5 -94.1 -91.8 15.6 82.1 62.1 52.6 126 112 B G T < 5S+ 0 0 0 -3,-1.6 13,-2.4 1,-0.3 2,-0.2 0.392 83.6 131.1 93.2 -0.7 83.1 60.6 49.2 127 113 B F E < -C 138 0B 0 -5,-2.0 2,-0.3 11,-0.2 -1,-0.3 -0.589 31.9-175.3 -92.6 144.5 79.8 61.2 47.4 128 114 B F E -C 137 0B 0 9,-2.2 9,-2.2 -2,-0.2 2,-0.3 -0.961 31.5-103.9-131.7 157.2 79.2 62.8 44.0 129 115 B H E -C 136 0B 4 -25,-0.5 7,-0.2 -2,-0.3 -20,-0.1 -0.577 14.7-153.9 -82.1 134.5 75.9 63.7 42.2 130 116 B T - 0 0 19 5,-2.1 -1,-0.1 -2,-0.3 6,-0.1 0.565 45.9-109.3 -81.9 -9.8 74.7 61.5 39.3 131 117 B G S S+ 0 0 33 4,-0.4 2,-0.4 2,-0.2 5,-0.1 0.482 89.6 98.9 93.4 5.0 72.8 64.3 37.7 132 118 B H S > S- 0 0 108 3,-0.3 3,-1.9 -20,-0.0 -2,-0.3 -0.988 94.2 -49.8-130.6 124.1 69.3 62.9 38.5 133 119 B Q T 3 S- 0 0 113 -2,-0.4 -2,-0.2 1,-0.2 -18,-0.1 -0.170 106.7 -41.8 48.7-144.2 67.2 64.0 41.5 134 120 B D T 3 S+ 0 0 21 -23,-0.1 2,-0.3 -3,-0.1 -1,-0.2 -0.058 96.1 141.6-102.3 32.4 69.2 64.0 44.7 135 121 B K < + 0 0 70 -3,-1.9 -5,-2.1 11,-0.1 -4,-0.4 -0.572 24.1 175.4 -76.6 130.3 70.9 60.7 43.9 136 122 B V E -CD 129 145B 2 9,-2.6 9,-2.0 -2,-0.3 2,-0.3 -0.901 13.6-158.1-127.9 160.7 74.6 60.4 44.8 137 123 B R E -CD 128 144B 73 -9,-2.2 -9,-2.2 -2,-0.3 2,-0.4 -0.988 25.7-112.5-134.5 149.2 77.2 57.6 44.7 138 124 B C E > -C 127 0B 0 5,-1.7 4,-1.6 -2,-0.3 -11,-0.2 -0.651 22.0-138.7 -75.3 131.1 80.4 57.0 46.5 139 125 B F T 4 S+ 0 0 18 -13,-2.4 -44,-3.2 -2,-0.4 -45,-0.2 0.772 98.4 37.2 -61.1 -26.7 83.4 57.3 44.1 140 126 B F T 4 S+ 0 0 47 -14,-0.2 -46,-1.8 -47,-0.2 -1,-0.1 0.940 127.8 24.0 -92.1 -57.4 85.0 54.2 45.8 141 127 B C T 4 S- 0 0 44 -48,-0.2 -2,-0.1 2,-0.1 -1,-0.1 0.514 91.2-128.5 -92.7 -6.6 82.4 51.7 46.8 142 128 B Y < + 0 0 116 -4,-1.6 -3,-0.1 1,-0.2 -1,-0.0 0.203 49.7 160.0 79.3 -12.5 79.6 52.7 44.2 143 129 B G - 0 0 8 -6,-0.2 -5,-1.7 1,-0.1 2,-0.4 -0.130 26.4-150.8 -53.4 127.1 77.0 52.9 47.1 144 130 B G E +D 137 0B 31 -7,-0.2 2,-0.3 17,-0.1 -7,-0.2 -0.827 17.6 176.4-106.2 139.5 74.0 55.0 46.0 145 131 B L E +D 136 0B 27 -9,-2.0 -9,-2.6 -2,-0.4 2,-0.2 -0.994 4.3 162.5-138.9 146.1 71.8 57.1 48.2 146 132 B Q + 0 0 93 -2,-0.3 -11,-0.1 -11,-0.2 -13,-0.1 -0.833 49.3 60.6-146.2-176.5 68.9 59.5 47.6 147 133 B S - 0 0 67 -2,-0.2 2,-0.1 1,-0.2 -1,-0.1 0.932 69.1-165.7 53.4 49.5 65.9 61.2 49.4 148 134 B W - 0 0 9 -14,-0.2 -32,-0.4 -3,-0.1 2,-0.3 -0.445 3.6-149.3 -65.2 134.9 68.3 63.0 51.7 149 135 B K > - 0 0 122 -2,-0.1 3,-2.5 -33,-0.1 -1,-0.0 -0.796 27.8 -85.1-110.8 151.6 66.5 64.4 54.7 150 136 B R T 3 S+ 0 0 206 -2,-0.3 -33,-0.1 1,-0.3 3,-0.1 -0.281 117.7 23.6 -50.0 129.8 67.2 67.5 56.9 151 137 B G T 3 S+ 0 0 74 -35,-0.5 -1,-0.3 1,-0.3 2,-0.1 0.251 85.0 140.5 92.8 -12.7 69.7 66.5 59.5 152 138 B D < - 0 0 44 -3,-2.5 -1,-0.3 -36,-0.1 3,-0.1 -0.418 44.4-145.0 -58.7 137.5 71.1 63.6 57.7 153 139 B D > - 0 0 64 1,-0.1 4,-2.5 -3,-0.1 5,-0.3 -0.946 3.6-145.8-107.6 115.0 74.9 63.4 58.1 154 140 B P H > S+ 0 0 1 0, 0.0 4,-2.4 0, 0.0 5,-0.1 0.856 98.2 48.6 -48.5 -43.5 76.7 62.1 54.9 155 141 B W H > S+ 0 0 44 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.918 112.0 49.4 -64.7 -42.4 79.4 60.2 56.9 156 142 B T H > S+ 0 0 42 -3,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.920 112.9 46.4 -61.7 -45.2 76.9 58.6 59.2 157 143 B E H X S+ 0 0 21 -4,-2.5 4,-2.5 2,-0.2 5,-0.4 0.882 108.6 56.3 -65.9 -37.7 74.7 57.5 56.2 158 144 B H H X S+ 0 0 0 -4,-2.4 4,-2.3 -5,-0.3 -2,-0.2 0.934 112.9 41.7 -56.8 -46.1 77.9 56.2 54.4 159 145 B A H < S+ 0 0 0 -4,-2.2 -2,-0.2 2,-0.2 -1,-0.2 0.872 113.0 53.7 -70.6 -39.0 78.6 54.0 57.4 160 146 B K H < S+ 0 0 93 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.932 123.2 24.5 -59.8 -47.4 75.0 52.9 57.9 161 147 B W H < S+ 0 0 153 -4,-2.5 -2,-0.2 1,-0.2 -3,-0.2 0.781 133.1 30.9 -95.4 -30.0 74.5 51.7 54.3 162 148 B F >< + 0 0 45 -4,-2.3 3,-2.0 -5,-0.4 -1,-0.2 -0.435 61.2 156.2-131.2 58.5 78.0 50.8 53.1 163 149 B P T 3 S+ 0 0 53 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.659 72.5 61.4 -64.1 -16.2 80.0 49.6 56.1 164 150 B G T 3 S+ 0 0 71 -3,-0.1 2,-0.2 4,-0.0 -5,-0.1 0.440 73.1 125.8 -87.1 -1.5 82.4 47.6 53.9 165 151 B C <> - 0 0 5 -3,-2.0 4,-2.2 -7,-0.2 5,-0.1 -0.404 51.8-153.2 -63.3 126.5 83.6 50.7 52.0 166 152 B Q H > S+ 0 0 133 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.793 96.0 54.0 -72.0 -31.4 87.5 51.0 52.1 167 153 B F H > S+ 0 0 43 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.927 110.3 47.6 -64.9 -46.7 87.4 54.8 51.6 168 154 B L H >>S+ 0 0 0 2,-0.2 4,-2.6 1,-0.2 5,-0.6 0.924 113.3 49.0 -55.2 -48.1 85.0 55.0 54.6 169 155 B L H X5S+ 0 0 73 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.934 113.0 45.2 -60.7 -48.5 87.3 52.7 56.6 170 156 B R H <5S+ 0 0 225 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.848 118.8 44.3 -63.9 -33.9 90.5 54.7 55.8 171 157 B S H <5S+ 0 0 54 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.850 132.0 13.0 -79.3 -38.7 88.7 58.0 56.5 172 158 B K H <5S- 0 0 84 -4,-2.6 4,-0.4 -5,-0.2 -3,-0.2 0.637 96.9-124.1-119.0 -23.0 86.9 57.1 59.8 173 159 B G X< - 0 0 29 -4,-1.9 4,-1.2 -5,-0.6 3,-0.2 0.076 30.9 -82.0 87.7 158.8 88.2 53.8 61.2 174 160 B Q H > S+ 0 0 93 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.838 122.4 59.7 -68.6 -36.6 86.4 50.6 62.2 175 161 B E H > S+ 0 0 166 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.896 103.5 52.7 -59.8 -42.0 85.2 51.8 65.6 176 162 B Y H > S+ 0 0 57 -4,-0.4 4,-1.5 -3,-0.2 -1,-0.2 0.914 112.6 44.9 -56.3 -46.3 83.3 54.7 64.0 177 163 B I H X S+ 0 0 1 -4,-1.2 4,-1.7 2,-0.2 3,-0.2 0.952 114.2 47.8 -66.8 -50.3 81.5 52.2 61.7 178 164 B N H X S+ 0 0 78 -4,-3.0 4,-2.4 1,-0.2 5,-0.2 0.906 108.1 55.5 -57.9 -44.0 80.8 49.6 64.4 179 165 B N H X S+ 0 0 92 -4,-2.7 4,-2.7 1,-0.2 -1,-0.2 0.876 105.1 52.6 -58.7 -39.8 79.4 52.3 66.8 180 166 B I H < S+ 0 0 24 -4,-1.5 -1,-0.2 -3,-0.2 -2,-0.2 0.909 112.7 44.8 -62.8 -40.9 76.9 53.5 64.2 181 167 B H H < S+ 0 0 102 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.831 115.4 47.5 -73.3 -31.2 75.6 49.9 63.7 182 168 B L H < 0 0 148 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.889 360.0 360.0 -75.2 -39.9 75.5 49.2 67.4 183 169 B T < 0 0 134 -4,-2.7 -3,-0.2 -5,-0.2 -2,-0.2 0.995 360.0 360.0 -73.6 360.0 73.7 52.4 68.3