==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/STRUCTURAL PROTEIN 24-JUL-03 1Q2D . COMPND 2 MOLECULE: HISTONE ACETYLTRANSFERASE GCN5; . SOURCE 2 ORGANISM_SCIENTIFIC: TETRAHYMENA THERMOPHILA; . AUTHOR A.N.POUX,R.MARMORSTEIN . 167 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9310.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 121 72.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 3.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 35 21.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.6 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 . 1 0.6 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 . 15 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 17 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 46 27.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.8 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 0 0 0 2 0 0 0 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 1 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 . 1 0 0 0 1 1 0 2 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 1 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 49 A L 0 0 67 0, 0.0 2,-0.3 0, 0.0 52,-0.2 0.000 360.0 360.0 360.0 91.5 7.2 14.9 15.2 2 50 A D E -A 52 0A 83 50,-2.6 50,-3.6 2,-0.0 2,-0.7 -0.858 360.0-148.0-115.3 149.2 3.6 16.3 14.8 3 51 A F E +A 51 0A 22 -2,-0.3 2,-0.3 48,-0.2 48,-0.2 -0.830 34.5 172.3-114.4 90.0 2.1 19.6 15.7 4 52 A D E -A 50 0A 71 46,-1.2 46,-3.2 -2,-0.7 2,-0.3 -0.740 36.9-117.6-107.6 150.3 -1.5 18.9 16.6 5 53 A I E -A 49 0A 62 -2,-0.3 2,-0.4 44,-0.3 44,-0.3 -0.644 35.1-164.6 -77.8 134.4 -4.4 20.9 18.0 6 54 A L E +A 48 0A 8 42,-4.4 42,-2.2 -2,-0.3 2,-0.3 -0.985 10.0 177.2-127.4 129.1 -5.5 19.3 21.3 7 55 A T - 0 0 64 -2,-0.4 2,-1.8 40,-0.2 40,-0.1 -0.976 42.0 -98.8-136.3 151.8 -8.7 20.0 23.1 8 56 A N + 0 0 63 -2,-0.3 -2,-0.0 38,-0.3 7,-0.0 -0.448 55.2 150.5 -64.5 82.7 -10.5 18.7 26.2 9 57 A D - 0 0 93 -2,-1.8 -1,-0.2 2,-0.1 5,-0.0 0.268 64.1-112.2-100.0 10.2 -12.9 16.3 24.6 10 58 A G S S+ 0 0 58 1,-0.2 2,-0.2 2,-0.1 -2,-0.1 0.559 71.2 134.4 74.3 8.9 -13.0 14.1 27.7 11 59 A T > - 0 0 56 1,-0.1 4,-2.5 0, 0.0 5,-0.2 -0.618 64.0-123.4 -90.4 153.8 -11.2 11.0 26.2 12 60 A H H > S+ 0 0 183 -2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.922 109.8 53.1 -58.0 -45.7 -8.4 9.2 28.1 13 61 A R H > S+ 0 0 65 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.958 115.9 34.5 -56.1 -59.7 -6.0 9.8 25.2 14 62 A N H > S+ 0 0 44 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.891 115.4 57.4 -66.2 -38.7 -6.4 13.6 24.8 15 63 A M H X S+ 0 0 53 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.897 105.9 50.2 -58.4 -43.3 -6.8 14.2 28.6 16 64 A K H X S+ 0 0 115 -4,-2.2 4,-2.6 -5,-0.2 -1,-0.2 0.920 110.6 49.3 -62.2 -45.3 -3.5 12.5 29.3 17 65 A L H X S+ 0 0 20 -4,-1.6 4,-2.6 1,-0.2 -2,-0.2 0.892 109.9 51.5 -62.6 -39.9 -1.7 14.6 26.7 18 66 A L H X S+ 0 0 2 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.863 110.9 48.4 -64.9 -36.8 -3.3 17.8 28.1 19 67 A I H X S+ 0 0 64 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.923 110.3 50.3 -69.6 -43.5 -2.1 16.8 31.6 20 68 A D H X S+ 0 0 45 -4,-2.6 4,-1.6 1,-0.2 -2,-0.2 0.930 113.4 46.9 -58.8 -43.2 1.4 16.1 30.3 21 69 A L H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.922 110.3 52.3 -62.9 -44.8 1.4 19.5 28.6 22 70 A K H X S+ 0 0 27 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.873 108.5 51.1 -60.0 -38.8 0.1 21.2 31.8 23 71 A N H X S+ 0 0 61 -4,-2.5 4,-2.0 2,-0.2 -1,-0.2 0.828 108.6 51.0 -69.0 -33.2 2.9 19.6 33.7 24 72 A I H X S+ 0 0 16 -4,-1.6 4,-2.3 -5,-0.2 -2,-0.2 0.921 109.6 51.7 -69.2 -42.1 5.4 20.9 31.2 25 73 A F H X S+ 0 0 0 -4,-2.6 4,-1.5 1,-0.2 -2,-0.2 0.945 111.1 46.2 -57.5 -50.8 3.9 24.4 31.6 26 74 A S H < S+ 0 0 20 -4,-2.3 6,-0.2 1,-0.2 -1,-0.2 0.906 113.9 47.2 -61.6 -43.3 4.1 24.4 35.4 27 75 A R H < S+ 0 0 186 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.867 119.4 40.7 -66.7 -34.6 7.7 23.1 35.5 28 76 A Q H < S+ 0 0 57 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.571 120.2 45.1 -89.2 -11.2 8.8 25.7 32.9 29 77 A L >< + 0 0 11 -4,-1.5 3,-2.2 -5,-0.2 -1,-0.2 -0.512 65.0 164.8-130.1 63.2 6.7 28.5 34.4 30 78 A P T 3 S+ 0 0 97 0, 0.0 4,-0.1 0, 0.0 -1,-0.1 0.657 72.0 62.8 -55.0 -20.7 7.4 28.2 38.2 31 79 A K T 3 S+ 0 0 106 -3,-0.1 -5,-0.1 2,-0.1 -3,-0.0 0.539 88.1 88.9 -84.6 -4.2 5.9 31.7 38.9 32 80 A M S < S- 0 0 38 -3,-2.2 2,-0.3 -6,-0.2 -3,-0.1 -0.787 88.7-114.7 -96.3 129.5 2.5 30.6 37.7 33 81 A P >> - 0 0 64 0, 0.0 4,-1.6 0, 0.0 3,-1.3 -0.476 23.1-139.0 -62.3 124.1 0.1 29.0 40.2 34 82 A K H 3> S+ 0 0 103 1,-0.3 4,-2.4 -2,-0.3 3,-0.3 0.906 102.9 55.6 -51.3 -45.7 -0.2 25.4 39.0 35 83 A E H 3> S+ 0 0 137 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.793 104.7 55.1 -60.4 -25.8 -4.0 25.4 39.6 36 84 A Y H <> S+ 0 0 80 -3,-1.3 4,-1.9 2,-0.2 -1,-0.2 0.889 106.9 48.1 -73.8 -39.9 -4.2 28.5 37.4 37 85 A I H X S+ 0 0 0 -4,-1.6 4,-3.0 -3,-0.3 5,-0.2 0.929 111.6 52.4 -62.6 -45.8 -2.5 26.7 34.5 38 86 A V H X S+ 0 0 54 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.920 106.9 52.6 -54.9 -49.7 -4.9 23.8 35.1 39 87 A K H < S+ 0 0 131 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.892 115.5 38.3 -56.8 -46.0 -7.9 26.0 35.0 40 88 A L H >< S+ 0 0 23 -4,-1.9 3,-1.3 2,-0.2 6,-0.4 0.929 113.1 54.8 -74.3 -44.9 -7.1 27.6 31.6 41 89 A V H 3< S+ 0 0 5 -4,-3.0 -33,-0.3 1,-0.3 -2,-0.2 0.879 117.8 35.6 -56.7 -39.9 -5.7 24.5 29.9 42 90 A F T 3< S+ 0 0 48 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.256 92.9 112.0-100.4 13.6 -9.0 22.6 30.6 43 91 A D S X S- 0 0 41 -3,-1.3 3,-0.6 -4,-0.2 -35,-0.2 -0.522 77.9-111.7 -87.6 159.5 -11.5 25.3 30.3 44 92 A R T 3 S+ 0 0 221 1,-0.2 -1,-0.1 -2,-0.2 -4,-0.1 0.740 112.1 50.0 -56.1 -29.8 -14.1 25.5 27.4 45 93 A H T 3 S+ 0 0 69 20,-0.1 21,-0.6 -5,-0.0 -1,-0.2 0.751 95.7 79.5 -85.3 -27.1 -12.5 28.5 25.8 46 94 A H E < - B 0 65A 13 -3,-0.6 2,-0.3 -6,-0.4 -38,-0.3 -0.474 53.7-170.1 -87.1 156.6 -8.9 27.5 25.6 47 95 A E E - B 0 64A 42 17,-2.8 17,-3.2 -2,-0.2 2,-0.4 -0.966 8.9-146.8-140.0 154.3 -7.1 25.2 23.1 48 96 A S E -AB 6 63A 1 -42,-2.2 -42,-4.4 -2,-0.3 2,-0.6 -0.983 5.1-160.3-131.7 130.6 -3.6 23.7 22.9 49 97 A M E -AB 5 62A 4 13,-2.3 13,-2.4 -2,-0.4 2,-0.3 -0.927 27.4-162.0-103.5 126.5 -1.4 22.9 19.9 50 98 A V E -AB 4 61A 1 -46,-3.2 -46,-1.2 -2,-0.6 2,-0.7 -0.773 24.1-129.8-115.0 157.5 1.2 20.3 21.0 51 99 A I E -AB 3 60A 0 9,-2.6 8,-2.3 -2,-0.3 9,-0.7 -0.920 34.9-170.1-100.9 113.0 4.5 19.1 19.8 52 100 A L E -AB 2 58A 15 -50,-3.6 -50,-2.6 -2,-0.7 3,-0.2 -0.911 13.1-151.8-111.2 128.6 4.1 15.3 19.7 53 101 A K E >> S- B 0 57A 48 4,-2.7 3,-1.1 -2,-0.5 4,-0.8 -0.616 76.0 -20.0 -89.5 162.9 7.0 12.9 19.2 54 102 A N T 34 S- 0 0 130 1,-0.3 -1,-0.2 -2,-0.2 2,-0.2 0.478 115.8 -65.0 -4.1 69.7 6.1 9.5 17.6 55 103 A K T 34 S+ 0 0 173 -3,-0.2 -1,-0.3 1,-0.1 3,-0.1 0.245 128.5 51.7 57.4 -5.9 2.4 9.5 18.4 56 104 A Q T <4 S+ 0 0 162 -3,-1.1 2,-0.3 -2,-0.2 -2,-0.1 0.102 85.3 79.2-149.8 40.0 2.4 9.4 22.2 57 105 A K E < -B 53 0A 129 -4,-0.8 -4,-2.7 -37,-0.0 2,-0.5 -0.834 53.6-150.1-156.3 115.2 4.6 12.0 23.8 58 106 A V E +B 52 0A 10 -2,-0.3 -6,-0.2 -6,-0.2 3,-0.1 -0.673 23.2 163.0 -81.3 125.1 4.2 15.7 24.5 59 107 A I E - 0 0 1 -8,-2.3 22,-2.9 -2,-0.5 2,-0.3 0.379 66.9 -16.9-119.9 -1.3 7.5 17.7 24.4 60 108 A G E +BC 51 80A 0 -9,-0.7 -9,-2.6 20,-0.3 -1,-0.4 -0.970 61.0 166.4 175.9 172.9 6.0 21.1 24.1 61 109 A G E -BC 50 79A 0 18,-2.9 18,-2.3 -2,-0.3 2,-0.4 -0.971 28.3-117.4 172.8 171.9 3.0 23.2 23.3 62 110 A I E -BC 49 78A 0 -13,-2.4 -13,-2.3 -2,-0.3 2,-0.5 -0.987 17.8-155.3-136.8 124.0 1.1 26.5 23.2 63 111 A C E +BC 48 77A 0 14,-3.0 13,-2.5 -2,-0.4 14,-1.8 -0.880 28.0 164.7-100.6 127.3 -2.2 27.1 25.0 64 112 A F E -BC 47 75A 0 -17,-3.2 -17,-2.8 -2,-0.5 2,-0.4 -0.862 30.4-140.0-138.5 169.3 -4.3 29.8 23.5 65 113 A R E -BC 46 74A 64 9,-2.3 9,-2.7 -2,-0.3 2,-0.3 -0.976 15.5-149.2-137.9 123.9 -7.7 31.3 23.4 66 114 A Q E - C 0 73A 21 -21,-0.6 2,-0.5 -2,-0.4 7,-0.2 -0.656 9.2-160.2 -91.5 144.6 -9.5 32.7 20.3 67 115 A Y E >> - C 0 72A 21 5,-2.7 4,-1.5 -2,-0.3 5,-1.0 -0.762 20.7-173.6-120.0 76.0 -12.0 35.5 20.3 68 116 A K T >45S+ 0 0 89 -2,-0.5 3,-0.7 1,-0.2 -1,-0.2 0.841 75.5 49.6 -40.7 -59.3 -13.5 34.6 16.9 69 117 A P T 345S+ 0 0 113 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 0.934 117.4 43.4 -50.6 -46.7 -15.9 37.5 16.3 70 118 A Q T 345S- 0 0 61 -3,-0.4 -2,-0.2 2,-0.1 3,-0.1 0.664 105.9-133.8 -71.9 -20.4 -13.0 39.9 17.1 71 119 A R T <<5 + 0 0 84 -4,-1.5 36,-2.4 -3,-0.7 37,-1.2 0.902 66.3 104.6 65.7 43.5 -10.5 37.9 15.1 72 120 A F E < -Cd 67 108A 0 -5,-1.0 -5,-2.7 35,-0.2 2,-0.4 -0.979 50.8-154.1-146.9 156.3 -7.7 37.8 17.6 73 121 A A E -Cd 66 109A 0 35,-2.1 37,-2.8 -2,-0.3 2,-0.4 -0.988 9.8-137.7-136.4 145.5 -6.3 35.2 20.0 74 122 A E E -Cd 65 110A 38 -9,-2.7 -9,-2.3 -2,-0.4 2,-0.7 -0.864 15.6-134.2-104.3 135.0 -4.4 35.4 23.2 75 123 A V E +C 64 0A 1 35,-2.8 37,-0.5 -2,-0.4 -11,-0.2 -0.782 25.3 177.0 -86.1 119.5 -1.4 33.2 24.0 76 124 A A E - 0 0 10 -13,-2.5 2,-0.3 -2,-0.7 -12,-0.2 0.928 63.1 -1.6 -87.3 -55.9 -1.9 31.9 27.5 77 125 A F E -C 63 0A 2 -14,-1.8 -14,-3.0 86,-0.1 2,-0.3 -0.995 55.6-176.5-141.2 147.3 1.1 29.6 27.8 78 126 A L E +C 62 0A 25 -2,-0.3 2,-0.3 -16,-0.2 -16,-0.2 -0.999 20.3 144.9-141.1 136.7 4.0 28.4 25.7 79 127 A A E -C 61 0A 10 -18,-2.3 -18,-2.9 -2,-0.3 2,-0.4 -0.978 33.6-152.2-170.5 157.6 6.7 25.9 26.5 80 128 A V E -C 60 0A 14 -2,-0.3 -20,-0.3 -20,-0.3 5,-0.1 -0.992 44.4-101.8-130.7 134.5 9.1 23.1 25.5 81 129 A T >> - 0 0 31 -22,-2.9 3,-2.1 -2,-0.4 4,-0.5 -0.223 35.5-110.0 -59.4 148.7 10.2 20.5 28.0 82 130 A A G >4 S+ 0 0 59 1,-0.3 3,-1.5 2,-0.2 -1,-0.1 0.881 114.6 51.1 -44.5 -56.7 13.7 21.0 29.5 83 131 A N G 34 S+ 0 0 115 1,-0.2 -1,-0.3 3,-0.0 -2,-0.1 0.372 113.4 47.2 -69.8 7.0 15.4 18.0 27.8 84 132 A E G <4 S+ 0 0 20 -3,-2.1 5,-0.4 -25,-0.1 3,-0.4 0.351 84.9 114.9-126.5 0.6 14.1 19.1 24.3 85 133 A Q << + 0 0 79 -3,-1.5 -4,-0.0 -4,-0.5 -3,-0.0 -0.270 65.6 33.7 -72.4 161.5 14.9 22.8 24.4 86 134 A V S S+ 0 0 151 1,-0.1 -1,-0.2 -2,-0.0 -3,-0.0 0.872 88.0 102.4 61.6 40.5 17.4 24.5 22.0 87 135 A R S S- 0 0 147 -3,-0.4 -2,-0.1 0, 0.0 -1,-0.1 0.209 100.4-102.3-130.6 7.1 16.6 22.2 19.2 88 136 A G S > S+ 0 0 36 3,-0.0 4,-1.7 4,-0.0 3,-0.3 0.436 88.4 120.3 85.9 -0.7 14.4 24.6 17.3 89 137 A Y H > + 0 0 26 -5,-0.4 4,-2.7 1,-0.2 5,-0.2 0.903 70.0 54.9 -63.3 -44.2 11.1 23.1 18.4 90 138 A G H > S+ 0 0 13 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.807 110.8 46.2 -60.9 -30.2 9.7 26.3 20.1 91 139 A T H > S+ 0 0 62 -3,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.859 111.9 49.3 -80.7 -36.9 10.2 28.3 16.9 92 140 A R H X S+ 0 0 116 -4,-1.7 4,-2.5 2,-0.2 -2,-0.2 0.875 109.8 54.4 -68.1 -36.0 8.7 25.6 14.7 93 141 A L H X S+ 0 0 0 -4,-2.7 4,-2.9 2,-0.2 -2,-0.2 0.932 108.6 47.0 -62.3 -47.4 5.7 25.5 17.1 94 142 A M H X S+ 0 0 0 -4,-1.5 4,-2.9 2,-0.2 5,-0.2 0.906 112.8 49.5 -61.4 -42.7 5.2 29.3 16.8 95 143 A N H X S+ 0 0 46 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.917 113.0 46.9 -61.6 -43.7 5.4 29.1 13.1 96 144 A K H X S+ 0 0 89 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.897 111.8 52.2 -63.9 -41.8 2.9 26.3 13.1 97 145 A F H X S+ 0 0 0 -4,-2.9 4,-2.8 1,-0.2 -2,-0.2 0.924 110.2 46.6 -61.8 -46.9 0.7 28.2 15.4 98 146 A K H X S+ 0 0 16 -4,-2.9 4,-2.2 2,-0.2 -1,-0.2 0.906 111.5 51.8 -63.7 -41.1 0.7 31.4 13.2 99 147 A D H X S+ 0 0 37 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.939 112.8 45.3 -60.6 -45.0 -0.0 29.3 10.1 100 148 A H H X S+ 0 0 36 -4,-2.4 4,-1.4 1,-0.2 -2,-0.2 0.911 111.7 51.9 -63.7 -43.9 -3.0 27.6 11.9 101 149 A M H <>S+ 0 0 0 -4,-2.8 5,-2.5 1,-0.2 -1,-0.2 0.833 107.7 53.6 -61.0 -34.4 -4.2 31.0 13.2 102 150 A Q H ><5S+ 0 0 41 -4,-2.2 3,-1.4 1,-0.2 -1,-0.2 0.909 108.9 47.8 -67.3 -42.3 -4.0 32.3 9.7 103 151 A K H 3<5S+ 0 0 153 -4,-1.9 -2,-0.2 1,-0.3 -1,-0.2 0.742 106.2 59.8 -69.7 -22.3 -6.2 29.5 8.5 104 152 A Q T 3<5S- 0 0 66 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.276 117.3-113.8 -88.3 9.4 -8.6 30.2 11.4 105 153 A N T < 5 + 0 0 102 -3,-1.4 2,-0.5 1,-0.2 -3,-0.2 0.861 63.7 154.1 61.2 36.4 -9.1 33.7 10.0 106 154 A I < - 0 0 4 -5,-2.5 -1,-0.2 -8,-0.1 -34,-0.2 -0.852 26.7-170.6 -97.7 130.2 -7.4 35.2 13.1 107 155 A E + 0 0 55 -36,-2.4 47,-3.4 -2,-0.5 2,-0.3 0.793 63.8 26.7 -92.8 -33.1 -5.8 38.7 12.4 108 156 A Y E -dE 72 153A 21 -37,-1.2 -35,-2.1 45,-0.2 2,-0.4 -0.980 57.3-150.8-136.2 149.2 -3.8 39.4 15.5 109 157 A L E -dE 73 152A 0 43,-2.3 43,-2.6 -2,-0.3 2,-0.4 -0.952 18.9-169.8-114.1 134.1 -2.0 37.4 18.2 110 158 A L E +dE 74 151A 0 -37,-2.8 -35,-2.8 -2,-0.4 2,-0.3 -0.959 11.5 163.4-125.8 144.6 -1.8 39.0 21.7 111 159 A T E - E 0 150A 0 39,-2.0 39,-2.6 -2,-0.4 2,-0.3 -0.968 33.5-126.5-158.0 140.8 0.3 37.8 24.6 112 160 A Y E - E 0 149A 27 -37,-0.5 2,-0.3 -2,-0.3 37,-0.2 -0.667 35.0-176.7 -85.3 149.8 1.5 39.4 27.8 113 161 A A E - E 0 148A 2 35,-1.6 35,-1.8 -2,-0.3 2,-0.3 -0.982 11.4-168.3-145.4 156.8 5.2 39.1 28.3 114 162 A D > - 0 0 52 -2,-0.3 3,-1.7 51,-0.2 4,-0.2 -0.992 52.9 -27.9-147.5 151.4 7.7 40.0 31.0 115 163 A N T >> S+ 0 0 69 -2,-0.3 3,-0.9 1,-0.3 4,-0.7 -0.156 130.9 6.9 48.6-120.7 11.5 40.3 31.4 116 164 A F H 3> S+ 0 0 104 49,-0.3 4,-1.7 1,-0.2 3,-0.4 0.842 123.2 68.0 -59.9 -36.8 13.3 37.8 29.0 117 165 A A H <> S+ 0 0 2 -3,-1.7 4,-2.9 48,-0.9 5,-0.2 0.801 89.4 63.0 -56.3 -34.6 10.0 36.8 27.3 118 166 A I H <> S+ 0 0 20 -3,-0.9 4,-1.9 1,-0.2 -1,-0.2 0.962 106.7 44.4 -56.6 -50.8 9.6 40.3 25.7 119 167 A G H X S+ 0 0 27 -4,-0.7 4,-1.6 -3,-0.4 -1,-0.2 0.887 111.8 54.1 -61.0 -38.9 12.8 39.8 23.7 120 168 A Y H X S+ 0 0 58 -4,-1.7 4,-0.8 1,-0.2 -1,-0.2 0.921 109.9 45.9 -62.5 -44.0 11.8 36.2 22.9 121 169 A F H <>S+ 0 0 5 -4,-2.9 5,-2.8 1,-0.2 -1,-0.2 0.793 105.2 60.2 -71.8 -25.6 8.5 37.3 21.4 122 170 A K H ><5S+ 0 0 106 -4,-1.9 3,-1.7 1,-0.2 -1,-0.2 0.896 102.9 53.6 -65.5 -37.4 10.1 40.2 19.5 123 171 A K H 3<5S+ 0 0 167 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.778 105.9 53.3 -65.6 -26.1 12.1 37.5 17.7 124 172 A Q T 3<5S- 0 0 16 -4,-0.8 -1,-0.3 -3,-0.2 -2,-0.2 0.271 129.9 -96.5 -91.6 9.6 8.8 35.8 16.9 125 173 A G T < 5S+ 0 0 41 -3,-1.7 28,-0.4 1,-0.3 -3,-0.2 0.490 78.3 138.4 93.3 2.0 7.5 39.0 15.3 126 174 A F < - 0 0 3 -5,-2.8 2,-0.3 26,-0.1 -1,-0.3 -0.555 33.9-159.3 -81.1 147.6 5.5 40.4 18.2 127 175 A T B -F 151 0A 58 24,-2.6 24,-2.2 -2,-0.2 -5,-0.0 -0.882 27.2-135.2-127.2 159.1 5.8 44.2 18.9 128 176 A K S S+ 0 0 116 -2,-0.3 2,-0.4 22,-0.2 21,-0.1 0.783 92.8 74.0 -78.7 -31.8 5.2 46.5 21.8 129 177 A E S S- 0 0 170 22,-0.1 2,-0.4 -3,-0.0 22,-0.2 -0.726 78.8-146.3 -85.2 129.4 3.4 49.0 19.6 130 178 A H - 0 0 59 -2,-0.4 4,-0.1 1,-0.1 -2,-0.1 -0.832 22.9-175.5-101.8 133.5 -0.1 47.8 18.5 131 179 A R + 0 0 167 -2,-0.4 -1,-0.1 2,-0.1 -2,-0.0 0.516 66.7 95.6 -97.5 -8.2 -1.6 48.6 15.2 132 180 A M S S- 0 0 9 1,-0.1 5,-0.1 -3,-0.1 -2,-0.1 -0.675 94.3 -99.3 -83.8 130.6 -4.8 46.9 16.4 133 181 A P >> - 0 0 52 0, 0.0 3,-2.1 0, 0.0 4,-0.6 -0.263 26.6-139.5 -52.5 123.9 -7.4 49.2 17.8 134 182 A Q H >> S+ 0 0 117 1,-0.3 4,-1.8 2,-0.2 3,-0.9 0.854 100.4 61.3 -52.9 -41.4 -7.1 49.1 21.6 135 183 A E H 34 S+ 0 0 127 1,-0.2 -1,-0.3 2,-0.2 -3,-0.0 0.462 91.9 70.1 -68.9 -0.2 -10.9 49.1 22.0 136 184 A K H <4 S+ 0 0 102 -3,-2.1 -1,-0.2 1,-0.1 -2,-0.2 0.865 110.5 27.2 -84.7 -38.8 -11.0 45.8 20.1 137 185 A W H XX S+ 0 0 9 -3,-0.9 4,-2.9 -4,-0.6 3,-2.6 0.713 95.4 108.1 -93.8 -22.8 -9.4 43.7 22.9 138 186 A K B 3< S+g 141 0B 125 -4,-1.8 4,-0.1 1,-0.3 -3,-0.0 -0.316 86.5 21.9 -57.2 129.7 -10.6 45.9 25.8 139 187 A G T 34 S+ 0 0 78 2,-0.5 -1,-0.3 1,-0.1 3,-0.1 0.217 126.0 54.7 95.8 -16.4 -13.3 44.1 27.7 140 188 A Y T <4 S+ 0 0 110 -3,-2.6 2,-0.6 1,-0.3 -2,-0.2 0.708 105.8 46.8-112.6 -46.1 -12.2 40.7 26.3 141 189 A I B < S-g 138 0B 3 -4,-2.9 -2,-0.5 1,-0.0 -1,-0.3 -0.894 94.6-114.6-103.1 121.6 -8.5 40.7 27.3 142 190 A K - 0 0 140 -2,-0.6 2,-0.8 -3,-0.1 -4,-0.0 -0.237 25.8-130.9 -54.2 139.0 -7.8 41.7 30.9 143 191 A D - 0 0 91 6,-0.0 2,-0.5 2,-0.0 -1,-0.1 -0.836 26.7-173.8 -98.7 103.5 -5.7 44.9 31.0 144 192 A Y > - 0 0 99 -2,-0.8 3,-1.1 1,-0.1 5,-0.1 -0.872 19.4-162.1-103.9 125.3 -2.8 44.5 33.4 145 193 A D T 3 S+ 0 0 164 -2,-0.5 -1,-0.1 1,-0.2 -2,-0.0 0.845 90.8 60.3 -69.1 -32.7 -0.6 47.5 34.2 146 194 A G T 3 S+ 0 0 74 2,-0.1 2,-0.3 -32,-0.0 -1,-0.2 0.387 99.9 65.5 -78.3 5.1 2.2 45.2 35.4 147 195 A G S < S- 0 0 25 -3,-1.1 2,-0.7 -33,-0.1 -33,-0.1 -0.929 78.8-121.2-129.9 155.0 2.7 43.5 32.1 148 196 A T E -E 113 0A 44 -35,-1.8 -35,-1.6 -2,-0.3 2,-0.6 -0.820 26.8-144.8 -93.0 116.3 3.8 44.4 28.6 149 197 A L E -E 112 0A 19 -2,-0.7 2,-0.3 -37,-0.2 -37,-0.2 -0.717 22.6-173.0 -83.3 121.7 1.0 43.7 26.1 150 198 A M E -E 111 0A 0 -39,-2.6 -39,-2.0 -2,-0.6 2,-0.3 -0.876 5.3-162.8-116.7 150.5 2.6 42.5 22.8 151 199 A E E -EF 110 127A 3 -24,-2.2 -24,-2.6 -2,-0.3 2,-0.5 -0.971 11.5-159.0-135.9 149.1 0.9 41.8 19.4 152 200 A C E -E 109 0A 6 -43,-2.6 -43,-2.3 -2,-0.3 2,-0.3 -0.989 20.2-137.8-126.6 122.6 1.7 40.0 16.2 153 201 A Y E -E 108 0A 65 -2,-0.5 2,-0.8 -28,-0.4 -45,-0.2 -0.624 10.6-151.2 -79.4 132.6 -0.1 40.9 13.1 154 202 A I - 0 0 4 -47,-3.4 -1,-0.0 -2,-0.3 -2,-0.0 -0.887 11.4-152.2-108.6 100.5 -1.2 37.8 11.0 155 203 A H > - 0 0 50 -2,-0.8 3,-1.3 1,-0.1 -53,-0.0 -0.544 20.3-122.2 -72.6 134.1 -1.3 38.9 7.3 156 204 A P T 3 S+ 0 0 82 0, 0.0 -1,-0.1 0, 0.0 -51,-0.1 0.697 103.3 21.4 -50.0 -26.9 -3.8 36.9 5.2 157 205 A Y T 3 S+ 0 0 191 2,-0.1 2,-0.4 0, 0.0 -3,-0.0 -0.022 85.0 115.7-142.1 43.3 -1.1 35.7 2.8 158 206 A V S < S- 0 0 64 -3,-1.3 2,-1.0 2,-0.0 0, 0.0 -0.864 71.5-113.7-101.7 140.2 2.3 35.9 4.3 159 207 A D + 0 0 141 -2,-0.4 2,-0.6 2,-0.0 -60,-0.1 -0.685 39.8 173.0 -85.9 104.2 3.8 32.4 4.6 160 208 A Y 0 0 32 -2,-1.0 -58,-0.1 -62,-0.1 -2,-0.0 -0.942 360.0 360.0-105.9 121.9 4.3 31.5 8.2 161 209 A G 0 0 77 -2,-0.6 -65,-0.1 -62,-0.1 -68,-0.0 -0.962 360.0 360.0 158.0 360.0 5.4 27.9 8.5 162 !* 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 0.0 163 320 B K 0 0 28 0, 0.0 -49,-0.1 0, 0.0 -86,-0.1 0.000 360.0 360.0 360.0 55.7 3.1 34.0 30.2 164 321 B K + 0 0 22 -51,-0.1 -47,-0.1 -135,-0.1 -135,-0.1 0.863 360.0 153.4 -58.6 -43.1 4.9 34.4 33.5 165 322 B P + 0 0 8 0, 0.0 2,-1.1 0, 0.0 -48,-0.9 0.543 14.1 174.3 8.5 63.6 8.6 34.4 32.1 166 323 B L S S- 0 0 45 1,-0.2 -51,-0.1 -51,-0.1 -2,-0.1 -0.753 76.9 -40.7 -94.4 99.2 10.4 36.4 34.8 167 324 B D 0 0 111 -2,-1.1 -1,-0.2 -53,-0.2 -52,-0.1 0.569 360.0 360.0 61.7 10.5 14.0 36.2 33.8 168 325 B G 0 0 88 -4,-0.0 -1,-0.1 -140,-0.0 -2,-0.1 0.619 360.0 360.0 -21.5 360.0 13.5 32.6 33.0