==== 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 TRANSFERASE 22-JUN-99 1QSN . COMPND 2 MOLECULE: TGCN5 HISTONE ACETYL TRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: TETRAHYMENA THERMOPHILA; . AUTHOR J.R.ROJAS,R.C.TRIEVEL,J.ZHOU,Y.MO,X.LI,S.L.BERGER,C.DAVID . 173 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9484.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 125 72.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 3.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 35 20.2 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 . 17 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 19 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 45 26.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.7 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 72 0, 0.0 2,-0.3 0, 0.0 52,-0.2 0.000 360.0 360.0 360.0 94.5 55.4 13.8 47.2 2 50 A D E -A 52 0A 67 50,-2.5 50,-3.2 2,-0.0 2,-0.6 -0.768 360.0-149.7-107.2 152.8 52.5 11.3 46.8 3 51 A F E +A 51 0A 24 -2,-0.3 2,-0.3 48,-0.2 48,-0.2 -0.847 34.8 170.1-119.3 90.3 48.8 11.6 47.8 4 52 A D E -A 50 0A 73 46,-1.3 46,-2.9 -2,-0.6 2,-0.5 -0.760 41.6-113.6-110.4 152.8 47.7 8.1 48.6 5 53 A I E -A 49 0A 55 -2,-0.3 2,-0.8 44,-0.3 44,-0.3 -0.672 35.5-141.5 -75.7 122.8 44.6 6.6 50.1 6 54 A L E -A 48 0A 14 42,-3.9 42,-0.8 -2,-0.5 2,-0.3 -0.818 13.9-150.6 -95.9 111.0 45.9 5.0 53.3 7 55 A T - 0 0 77 -2,-0.8 2,-1.4 40,-0.1 11,-0.1 -0.636 10.6-139.6 -84.0 133.9 44.2 1.7 54.0 8 56 A N + 0 0 68 -2,-0.3 -1,-0.1 1,-0.2 -2,-0.0 -0.674 47.5 144.8 -91.7 81.2 43.7 0.4 57.5 9 57 A D - 0 0 83 -2,-1.4 -1,-0.2 2,-0.1 -2,-0.0 0.161 68.4-107.8-106.1 15.3 44.6 -3.2 56.8 10 58 A G S S+ 0 0 56 1,-0.2 2,-0.3 -3,-0.1 -2,-0.1 0.752 72.5 138.0 66.2 25.0 46.3 -4.0 60.1 11 59 A T > - 0 0 57 1,-0.1 4,-2.6 0, 0.0 5,-0.3 -0.730 64.2-118.9-100.6 153.9 49.8 -4.2 58.7 12 60 A H H > S+ 0 0 183 -2,-0.3 4,-1.9 1,-0.2 5,-0.2 0.905 111.8 50.8 -56.0 -43.8 52.8 -2.7 60.5 13 61 A R H > S+ 0 0 139 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.948 116.2 36.6 -61.7 -53.2 53.5 -0.3 57.6 14 62 A N H > S+ 0 0 17 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.870 115.4 54.5 -70.9 -36.0 50.0 1.2 57.2 15 63 A M H X S+ 0 0 54 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.897 108.1 50.8 -64.4 -37.0 49.2 1.2 60.9 16 64 A K H X S+ 0 0 120 -4,-1.9 4,-2.1 -5,-0.3 -1,-0.2 0.856 110.9 48.7 -66.3 -36.1 52.4 3.2 61.5 17 65 A L H X S+ 0 0 8 -4,-1.4 4,-1.9 2,-0.2 -2,-0.2 0.883 111.2 49.5 -72.5 -37.7 51.4 5.7 58.8 18 66 A L H X S+ 0 0 2 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.865 111.8 48.5 -68.3 -37.1 47.9 6.0 60.3 19 67 A I H X S+ 0 0 72 -4,-2.1 4,-2.8 2,-0.2 5,-0.2 0.935 110.0 51.4 -68.7 -44.6 49.3 6.6 63.8 20 68 A D H X S+ 0 0 52 -4,-2.1 4,-1.5 1,-0.2 -2,-0.2 0.906 113.6 45.7 -56.9 -41.5 51.8 9.2 62.5 21 69 A L H X S+ 0 0 0 -4,-1.9 4,-2.4 2,-0.2 -1,-0.2 0.878 110.3 52.5 -69.4 -39.7 48.8 10.9 60.8 22 70 A K H X S+ 0 0 27 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.895 109.3 50.8 -63.7 -38.4 46.7 10.7 63.9 23 71 A N H X S+ 0 0 59 -4,-2.8 4,-2.2 2,-0.2 -1,-0.2 0.845 108.8 50.8 -68.4 -33.2 49.5 12.3 65.9 24 72 A I H X S+ 0 0 18 -4,-1.5 4,-2.2 -5,-0.2 -2,-0.2 0.918 109.8 51.7 -68.7 -42.3 49.7 15.1 63.3 25 73 A F H X S+ 0 0 0 -4,-2.4 4,-1.7 2,-0.2 -2,-0.2 0.928 111.6 45.5 -57.7 -49.4 45.9 15.6 63.6 26 74 A S H < S+ 0 0 22 -4,-2.3 3,-0.4 1,-0.2 6,-0.2 0.951 112.8 49.3 -63.1 -49.6 46.0 15.9 67.5 27 75 A R H < S+ 0 0 190 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.874 118.7 40.5 -56.7 -38.4 49.0 18.2 67.5 28 76 A Q H < S+ 0 0 54 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.628 117.8 47.3 -86.6 -15.6 47.3 20.5 64.9 29 77 A L >< + 0 0 9 -4,-1.7 3,-2.1 -3,-0.4 -1,-0.2 -0.569 65.1 167.5-124.9 68.2 43.8 20.2 66.4 30 78 A P T 3 S+ 0 0 63 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.715 71.6 63.1 -54.4 -27.3 44.3 20.8 70.2 31 79 A K T 3 S+ 0 0 103 139,-0.3 -5,-0.1 2,-0.1 -2,-0.0 0.540 89.0 91.2 -77.9 -3.9 40.6 21.3 70.9 32 80 A M S < S- 0 0 28 -3,-2.1 2,-0.3 -6,-0.2 -3,-0.1 -0.772 86.1-116.2 -97.9 132.1 40.0 17.7 69.9 33 81 A P >> - 0 0 63 0, 0.0 4,-1.5 0, 0.0 3,-1.3 -0.489 23.0-140.0 -62.3 124.0 40.1 14.8 72.3 34 82 A K H 3> S+ 0 0 109 -2,-0.3 4,-2.0 1,-0.3 5,-0.1 0.859 102.2 54.8 -54.9 -38.7 43.0 12.7 71.1 35 83 A E H 3> S+ 0 0 132 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.748 104.7 55.4 -68.5 -21.9 41.1 9.5 71.8 36 84 A Y H <> S+ 0 0 42 -3,-1.3 4,-2.1 2,-0.2 5,-0.2 0.863 105.8 50.0 -76.4 -36.8 38.3 10.8 69.6 37 85 A I H X S+ 0 0 0 -4,-1.5 4,-2.7 1,-0.2 5,-0.2 0.932 111.2 50.6 -64.6 -44.0 40.7 11.3 66.7 38 86 A V H X S+ 0 0 55 -4,-2.0 4,-1.8 1,-0.2 -2,-0.2 0.882 108.4 53.0 -59.3 -43.5 41.9 7.7 67.2 39 87 A K H < S+ 0 0 126 -4,-1.7 4,-0.4 2,-0.2 -2,-0.2 0.954 115.5 36.6 -60.4 -53.1 38.4 6.4 67.2 40 88 A L H >< S+ 0 0 5 -4,-2.1 3,-1.6 1,-0.2 6,-0.4 0.956 113.6 56.2 -66.5 -50.3 37.3 7.9 63.9 41 89 A V H 3< S+ 0 0 4 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.853 117.8 34.3 -51.9 -40.4 40.7 7.5 62.1 42 90 A F T 3< S+ 0 0 53 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.353 95.1 113.6 -99.6 8.5 40.7 3.7 62.8 43 91 A D S X S- 0 0 37 -3,-1.6 3,-0.7 -4,-0.4 -35,-0.1 -0.300 78.6-107.8 -80.1 166.7 36.9 3.0 62.5 44 92 A R T 3 S+ 0 0 222 1,-0.2 -1,-0.1 -2,-0.0 -4,-0.1 0.574 113.9 49.0 -67.6 -10.5 35.2 0.9 59.9 45 93 A H T 3 S+ 0 0 62 -5,-0.2 21,-0.6 119,-0.1 -1,-0.2 0.655 95.6 80.6-103.9 -17.7 33.6 4.0 58.2 46 94 A H E < - B 0 65A 18 -3,-0.7 2,-0.3 -6,-0.4 19,-0.2 -0.574 50.0-171.4 -97.1 157.1 36.5 6.4 57.8 47 95 A E E - B 0 64A 56 17,-2.9 17,-3.2 -2,-0.2 2,-0.4 -0.954 9.9-146.6-138.3 155.7 39.3 6.6 55.2 48 96 A S E -AB 6 63A 2 -42,-0.8 -42,-3.9 -2,-0.3 2,-0.5 -0.983 6.3-161.2-131.4 137.3 42.5 8.7 55.0 49 97 A M E -AB 5 62A 2 13,-2.5 13,-2.3 -2,-0.4 2,-0.3 -0.973 26.0-161.8-111.4 124.2 44.4 10.2 52.1 50 98 A V E -AB 4 61A 1 -46,-2.9 -46,-1.3 -2,-0.5 2,-0.8 -0.751 24.4-127.7-112.1 157.2 47.9 11.1 53.2 51 99 A I E -AB 3 60A 0 9,-2.5 8,-2.3 -2,-0.3 9,-0.6 -0.900 34.3-162.9 -98.0 107.9 50.6 13.4 51.9 52 100 A L E -AB 2 58A 4 -50,-3.2 -50,-2.5 -2,-0.8 2,-0.6 -0.850 6.1-157.7-101.7 124.1 53.6 11.0 51.7 53 101 A K E >> S- B 0 57A 62 4,-3.6 4,-2.1 -2,-0.5 3,-0.9 -0.894 79.9 -7.0-103.3 121.0 57.1 12.5 51.5 54 102 A N T 34 S- 0 0 109 -2,-0.6 -1,-0.2 1,-0.2 4,-0.1 0.815 117.9 -77.8 65.2 30.6 59.7 10.2 50.0 55 103 A K T 34 S+ 0 0 160 -3,-0.4 -1,-0.2 1,-0.2 3,-0.1 0.779 129.8 54.3 50.9 35.2 57.2 7.3 50.1 56 104 A Q T <4 S+ 0 0 135 -3,-0.9 2,-0.5 1,-0.3 -2,-0.2 0.399 85.3 75.4-161.2 -29.9 57.6 6.8 53.9 57 105 A K E < -B 53 0A 128 -4,-2.1 -4,-3.6 -37,-0.0 2,-0.4 -0.877 63.1-144.3-107.5 124.8 57.1 10.0 55.8 58 106 A V E +B 52 0A 11 -2,-0.5 -6,-0.2 -6,-0.2 3,-0.1 -0.665 24.7 167.0 -83.0 131.0 53.6 11.4 56.5 59 107 A I E - 0 0 1 -8,-2.3 22,-2.8 1,-0.4 2,-0.3 0.293 65.1 -24.8-124.9 5.3 53.5 15.2 56.5 60 108 A G E +BC 51 80A 0 -9,-0.6 -9,-2.5 20,-0.3 -1,-0.4 -0.953 59.0 169.2 167.2 176.5 49.7 15.7 56.4 61 109 A G E -BC 50 79A 0 18,-2.5 18,-2.2 -2,-0.3 2,-0.4 -0.980 27.9-111.3 171.1 177.8 46.4 14.2 55.3 62 110 A I E -BC 49 78A 0 -13,-2.3 -13,-2.5 -2,-0.3 2,-0.5 -0.995 18.1-154.1-139.9 131.1 42.7 14.3 55.4 63 111 A C E +BC 48 77A 0 14,-3.0 13,-3.0 -2,-0.4 14,-1.3 -0.905 26.5 166.2-106.8 131.6 40.3 11.8 57.1 64 112 A F E -BC 47 75A 0 -17,-3.2 -17,-2.9 -2,-0.5 2,-0.4 -0.907 30.3-138.4-142.8 167.0 36.9 11.4 55.6 65 113 A R E -BC 46 74A 24 9,-2.3 9,-2.7 -2,-0.3 2,-0.3 -0.978 16.8-148.9-133.8 121.8 33.8 9.2 55.7 66 114 A Q E - C 0 73A 21 -21,-0.6 2,-0.5 -2,-0.4 7,-0.2 -0.682 9.1-163.0 -90.4 138.6 31.8 8.3 52.6 67 115 A Y E >>> - C 0 72A 15 5,-2.7 4,-1.3 -2,-0.3 5,-1.0 -0.721 20.2-177.4-115.5 74.0 28.1 7.7 52.6 68 116 A K G >45S+ 0 0 140 -2,-0.5 3,-0.9 1,-0.2 -1,-0.2 0.848 72.9 52.6 -41.6 -57.6 28.1 6.0 49.3 69 117 A P G 345S+ 0 0 112 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 0.908 115.9 41.9 -50.7 -44.0 24.4 5.3 48.8 70 118 A Q G <45S- 0 0 61 -3,-0.6 -2,-0.2 2,-0.2 3,-0.1 0.641 107.7-128.7 -78.4 -16.0 23.6 9.0 49.5 71 119 A R T <<5 + 0 0 87 -4,-1.3 36,-1.8 -3,-0.9 37,-1.2 0.899 69.3 101.6 69.4 42.6 26.5 10.2 47.3 72 120 A F E < -Cd 67 108A 0 -5,-1.0 -5,-2.7 35,-0.2 2,-0.3 -0.985 50.9-153.3-150.3 156.6 28.2 12.5 49.8 73 121 A A E -Cd 66 109A 0 35,-2.1 37,-3.2 -2,-0.3 2,-0.4 -0.971 9.4-137.7-134.5 150.5 31.1 12.5 52.2 74 122 A E E -Cd 65 110A 2 -9,-2.7 -9,-2.3 -2,-0.3 2,-0.6 -0.890 15.7-133.4-109.6 135.1 32.1 14.2 55.4 75 123 A V E +C 64 0A 0 35,-2.6 94,-0.6 -2,-0.4 37,-0.5 -0.759 24.7 178.1 -84.6 122.6 35.5 15.6 56.1 76 124 A A E - 0 0 3 -13,-3.0 2,-0.3 -2,-0.6 94,-0.2 0.926 63.6 -3.3 -87.6 -60.4 36.5 14.4 59.6 77 125 A F E -C 63 0A 0 -14,-1.3 -14,-3.0 92,-0.2 2,-0.4 -0.991 55.8-175.5-138.6 147.4 40.0 15.9 60.0 78 126 A L E +C 62 0A 24 -2,-0.3 2,-0.3 -16,-0.2 -16,-0.2 -0.988 21.9 141.5-141.7 128.2 42.4 17.9 57.8 79 127 A A E -C 61 0A 9 -18,-2.2 -18,-2.5 -2,-0.4 2,-0.4 -0.985 34.5-148.8-166.6 156.2 46.0 18.9 58.6 80 128 A V E -C 60 0A 13 -2,-0.3 -20,-0.3 -20,-0.3 5,-0.1 -0.982 44.3 -98.9-125.4 135.7 49.6 19.4 57.6 81 129 A T > - 0 0 31 -22,-2.8 3,-2.4 -2,-0.4 4,-0.3 -0.260 37.9-113.8 -56.5 139.9 52.5 19.0 60.0 82 130 A A G > S+ 0 0 57 1,-0.3 3,-1.4 2,-0.2 -1,-0.1 0.816 112.6 52.7 -41.9 -50.9 53.7 22.3 61.4 83 131 A N G 3 S+ 0 0 110 1,-0.3 -1,-0.3 3,-0.0 -2,-0.1 0.417 112.8 46.8 -72.8 3.0 57.2 22.3 59.8 84 132 A E G < S+ 0 0 9 -3,-2.4 5,-0.4 -25,-0.1 3,-0.3 0.241 86.2 117.0-126.1 7.9 55.6 21.7 56.3 85 133 A Q < + 0 0 81 -3,-1.4 -4,-0.0 -4,-0.3 -3,-0.0 -0.296 64.1 31.7 -77.0 164.6 52.8 24.3 56.4 86 134 A V S S+ 0 0 145 1,-0.1 -1,-0.2 -2,-0.0 -4,-0.0 0.911 87.3 102.3 55.1 48.6 52.5 27.3 54.1 87 135 A R S S- 0 0 145 -3,-0.3 -2,-0.1 0, 0.0 -1,-0.1 0.169 101.0 -99.7-137.7 8.7 54.1 25.5 51.1 88 136 A G S > S+ 0 0 36 3,-0.0 4,-2.0 4,-0.0 5,-0.2 0.413 88.5 121.9 86.0 -0.3 50.9 24.7 49.3 89 137 A Y H > S+ 0 0 32 -5,-0.4 4,-2.2 1,-0.2 5,-0.2 0.921 71.9 51.9 -60.9 -47.2 50.6 21.1 50.4 90 138 A G H > S+ 0 0 13 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.864 110.2 47.9 -58.9 -38.5 47.2 21.5 52.0 91 139 A T H > S+ 0 0 65 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.923 112.2 48.9 -70.8 -39.5 45.6 23.1 49.0 92 140 A R H X S+ 0 0 116 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.835 109.6 53.9 -66.4 -32.4 47.0 20.4 46.7 93 141 A L H X S+ 0 0 0 -4,-2.2 4,-2.9 2,-0.2 -1,-0.2 0.940 108.0 48.6 -66.9 -47.7 45.7 17.7 49.1 94 142 A M H X S+ 0 0 0 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.882 111.9 49.3 -60.6 -39.7 42.2 19.1 49.0 95 143 A N H X S+ 0 0 44 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.927 112.4 47.7 -66.3 -42.2 42.3 19.3 45.1 96 144 A K H X S+ 0 0 78 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.901 111.9 51.8 -62.7 -39.8 43.5 15.7 45.1 97 145 A F H X S+ 0 0 0 -4,-2.9 4,-2.4 2,-0.2 -2,-0.2 0.912 109.1 48.4 -63.7 -44.8 40.8 14.8 47.5 98 146 A K H X S+ 0 0 14 -4,-2.6 4,-2.3 2,-0.2 -1,-0.2 0.907 111.2 51.2 -63.5 -39.2 38.1 16.4 45.4 99 147 A D H X S+ 0 0 35 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.950 111.7 46.8 -61.3 -50.5 39.4 14.6 42.2 100 148 A H H X S+ 0 0 31 -4,-2.5 4,-1.6 1,-0.2 -1,-0.2 0.883 111.1 51.3 -59.5 -41.8 39.3 11.3 44.0 101 149 A M H <>S+ 0 0 0 -4,-2.4 5,-2.4 2,-0.2 -1,-0.2 0.900 107.3 54.4 -63.4 -38.8 35.8 11.9 45.4 102 150 A Q H ><5S+ 0 0 38 -4,-2.3 3,-1.4 1,-0.2 -2,-0.2 0.940 110.1 46.4 -59.5 -44.8 34.7 12.8 41.8 103 151 A K H 3<5S+ 0 0 137 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.764 106.6 59.0 -68.3 -26.0 36.0 9.4 40.7 104 152 A Q T 3<5S- 0 0 82 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.348 119.0-112.2 -84.5 5.7 34.3 7.7 43.7 105 153 A N T < 5 + 0 0 103 -3,-1.4 2,-0.5 1,-0.2 -3,-0.2 0.855 63.8 153.9 67.4 37.7 31.0 9.0 42.4 106 154 A I < - 0 0 5 -5,-2.4 -1,-0.2 1,-0.1 -34,-0.2 -0.866 26.9-171.6-101.5 129.0 30.5 11.5 45.2 107 155 A E + 0 0 54 -36,-1.8 47,-3.1 -2,-0.5 2,-0.3 0.721 66.8 28.4 -91.6 -26.8 28.3 14.5 44.5 108 156 A Y E -dE 72 153A 21 -37,-1.2 -35,-2.1 45,-0.2 2,-0.4 -0.995 56.8-154.4-140.6 146.6 28.8 16.6 47.7 109 157 A L E -dE 73 152A 0 43,-2.2 43,-2.5 -2,-0.3 2,-0.4 -0.951 19.0-167.1-114.2 134.7 31.4 17.1 50.4 110 158 A L E +dE 74 151A 0 -37,-3.2 -35,-2.6 -2,-0.4 2,-0.3 -0.949 11.2 167.4-124.4 146.4 30.3 18.2 53.8 111 159 A T E - E 0 150A 0 39,-2.3 39,-3.1 -2,-0.4 2,-0.3 -0.973 31.4-128.2-156.4 141.3 32.3 19.6 56.7 112 160 A Y E - E 0 149A 14 -37,-0.5 2,-0.3 -2,-0.3 37,-0.2 -0.701 34.7-175.8 -85.9 145.2 31.6 21.3 60.0 113 161 A A E - E 0 148A 3 35,-1.9 35,-2.0 -2,-0.3 2,-0.3 -0.959 11.7-171.3-140.3 158.5 33.7 24.4 60.4 114 162 A D > - 0 0 74 -2,-0.3 3,-1.4 33,-0.2 4,-0.2 -0.991 54.4 -27.6-150.4 148.8 34.3 27.0 63.1 115 163 A N T >> S+ 0 0 80 -2,-0.3 3,-1.4 1,-0.3 4,-0.7 -0.161 131.3 4.6 48.3-125.1 36.0 30.3 63.4 116 164 A F H >> S+ 0 0 72 57,-0.6 4,-2.2 1,-0.3 3,-0.7 0.865 123.1 69.0 -56.2 -41.8 39.0 30.6 60.9 117 165 A A H <> S+ 0 0 2 -3,-1.4 4,-2.3 54,-0.3 -1,-0.3 0.733 91.3 62.3 -52.2 -26.4 38.2 27.2 59.3 118 166 A I H <> S+ 0 0 23 -3,-1.4 4,-1.7 -4,-0.2 -1,-0.3 0.962 107.9 41.0 -65.9 -50.2 35.0 28.7 57.8 119 167 A G H <>S+ 0 0 3 -4,-2.3 5,-2.5 1,-0.2 3,-0.5 0.802 105.2 62.6 -71.0 -28.6 37.0 26.2 53.4 122 170 A K H ><5S+ 0 0 95 -4,-1.7 3,-1.6 1,-0.3 -1,-0.2 0.900 102.4 51.4 -61.5 -40.6 35.3 29.0 51.5 123 171 A K H 3<5S+ 0 0 160 -4,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.712 106.7 56.3 -67.7 -19.9 38.6 29.5 49.6 124 172 A Q T <<5S- 0 0 19 -4,-0.5 -1,-0.3 -3,-0.5 -2,-0.2 0.237 130.2 -92.7 -94.8 9.3 38.5 25.8 48.9 125 173 A G T < 5S+ 0 0 41 -3,-1.6 28,-0.4 1,-0.3 -3,-0.2 0.419 82.1 132.4 98.6 -3.4 35.0 25.9 47.3 126 174 A F < - 0 0 3 -5,-2.5 2,-0.3 26,-0.1 -1,-0.3 -0.545 35.0-163.4 -83.6 150.2 32.7 25.2 50.3 127 175 A T B -F 151 0A 68 24,-2.2 24,-2.2 -2,-0.2 -5,-0.0 -0.929 27.5-135.7-132.3 156.2 29.7 27.4 51.0 128 176 A K S S+ 0 0 115 -2,-0.3 2,-0.4 22,-0.2 21,-0.1 0.810 91.8 76.1 -77.6 -33.1 27.4 28.0 54.0 129 177 A E S S- 0 0 167 22,-0.1 2,-0.4 -3,-0.1 22,-0.2 -0.657 80.0-144.7 -79.6 133.0 24.3 27.9 51.7 130 178 A H - 0 0 54 -2,-0.4 4,-0.1 1,-0.1 -2,-0.1 -0.806 25.6-176.2-104.2 142.2 23.5 24.3 50.7 131 179 A R + 0 0 173 -2,-0.4 -1,-0.1 2,-0.1 3,-0.0 0.562 66.1 92.8-105.0 -15.0 22.1 23.2 47.4 132 180 A M S S- 0 0 10 1,-0.1 5,-0.1 2,-0.0 2,-0.1 -0.622 95.1 -98.7 -80.4 133.5 21.9 19.6 48.6 133 181 A P >> - 0 0 54 0, 0.0 3,-2.6 0, 0.0 4,-0.5 -0.308 27.4-136.8 -54.4 121.8 18.5 18.6 50.1 134 182 A Q H >> S+ 0 0 117 1,-0.3 4,-2.0 2,-0.2 3,-1.2 0.870 102.0 62.6 -46.9 -46.6 18.8 18.9 53.9 135 183 A E H 34 S+ 0 0 123 1,-0.2 -1,-0.3 2,-0.2 -3,-0.0 0.478 91.2 71.6 -62.5 -0.4 16.8 15.6 54.3 136 184 A K H <4 S+ 0 0 104 -3,-2.6 -1,-0.2 1,-0.1 -2,-0.2 0.871 110.3 24.9 -84.1 -38.8 19.7 13.9 52.5 137 185 A W H XX S+ 0 0 10 -3,-1.2 3,-2.9 -4,-0.5 4,-2.7 0.710 96.9 107.5 -95.2 -23.8 22.3 14.2 55.2 138 186 A K B 3< S+g 141 0B 130 -4,-2.0 4,-0.1 1,-0.3 0, 0.0 -0.363 87.3 22.7 -58.8 120.2 19.8 14.4 58.1 139 187 A G T 34 S+ 0 0 77 2,-0.6 -1,-0.3 -2,-0.2 3,-0.1 0.222 125.7 54.9 104.7 -13.1 19.9 11.1 59.9 140 188 A Y T <4 S+ 0 0 106 -3,-2.9 2,-0.5 1,-0.3 25,-0.3 0.709 104.6 46.0-114.8 -48.6 23.4 10.4 58.7 141 189 A I B < S-g 138 0B 4 -4,-2.7 -2,-0.6 23,-0.1 -1,-0.3 -0.878 94.5-111.5-102.2 127.3 25.4 13.4 59.7 142 190 A K - 0 0 119 -2,-0.5 2,-0.9 -3,-0.1 -4,-0.0 -0.274 26.0-134.5 -57.2 139.6 25.0 14.6 63.2 143 191 A D - 0 0 92 3,-0.0 2,-0.5 6,-0.0 -1,-0.1 -0.810 26.5-177.3-102.5 94.5 23.2 17.9 63.3 144 192 A Y > - 0 0 85 -2,-0.9 3,-0.8 22,-0.2 5,-0.1 -0.796 21.2-156.6 -95.5 130.8 25.1 20.2 65.8 145 193 A D T 3 S+ 0 0 157 -2,-0.5 -1,-0.1 1,-0.2 -2,-0.0 0.762 90.1 64.2 -74.1 -24.0 23.7 23.6 66.4 146 194 A G T 3 S+ 0 0 75 -3,-0.0 2,-0.2 2,-0.0 -1,-0.2 0.557 97.4 62.1 -78.2 -9.1 27.1 24.9 67.6 147 195 A G S < S- 0 0 28 -3,-0.8 2,-0.7 -33,-0.1 -33,-0.2 -0.732 78.7-118.2-117.4 168.1 28.8 24.4 64.3 148 196 A T E -E 113 0A 42 -35,-2.0 -35,-1.9 -2,-0.2 2,-0.6 -0.906 26.1-147.8-104.0 112.9 28.6 25.7 60.7 149 197 A L E -E 112 0A 22 -2,-0.7 2,-0.3 -37,-0.2 -37,-0.2 -0.718 21.1-172.5 -81.7 120.0 27.8 22.9 58.2 150 198 A M E -E 111 0A 0 -39,-3.1 -39,-2.3 -2,-0.6 2,-0.4 -0.882 5.1-159.9-116.4 147.6 29.5 23.7 54.9 151 199 A E E -EF 110 127A 5 -24,-2.2 -24,-2.2 -2,-0.3 2,-0.5 -0.961 11.3-159.5-132.6 146.7 29.2 21.9 51.5 152 200 A C E -E 109 0A 5 -43,-2.5 -43,-2.2 -2,-0.4 2,-0.3 -0.981 19.9-139.4-123.3 118.2 31.2 21.7 48.3 153 201 A Y E -E 108 0A 68 -2,-0.5 2,-0.7 -28,-0.4 -45,-0.2 -0.598 10.7-151.6 -76.0 133.9 29.3 20.5 45.2 154 202 A I - 0 0 4 -47,-3.1 -1,-0.0 -2,-0.3 -2,-0.0 -0.873 11.5-151.1-110.4 96.2 31.4 18.1 43.1 155 203 A H > - 0 0 52 -2,-0.7 3,-1.3 1,-0.1 -53,-0.0 -0.469 20.8-120.1 -68.4 135.9 30.4 18.5 39.5 156 204 A P T 3 S+ 0 0 84 0, 0.0 -1,-0.1 0, 0.0 -51,-0.1 0.681 104.7 22.7 -49.7 -25.3 30.8 15.3 37.4 157 205 A Y T 3 S+ 0 0 195 2,-0.1 2,-0.4 0, 0.0 -2,-0.0 0.039 85.1 115.4-142.2 39.9 33.2 16.9 34.9 158 206 A V < - 0 0 62 -3,-1.3 2,-0.8 0, 0.0 -56,-0.0 -0.795 68.9-118.7 -97.9 144.0 34.9 19.9 36.4 159 207 A D - 0 0 110 -2,-0.4 2,-0.3 2,-0.0 -60,-0.1 -0.801 33.9-174.4 -93.2 108.6 38.6 19.4 36.7 160 208 A Y + 0 0 35 -2,-0.8 -65,-0.0 -65,-0.1 2,-0.0 -0.765 51.3 10.0 -98.8 144.9 39.7 19.6 40.4 161 209 A G 0 0 12 -2,-0.3 -69,-0.1 -70,-0.1 -68,-0.1 -0.230 360.0 360.0 83.0-178.3 43.3 19.5 41.3 162 210 A R 0 0 239 -70,-0.2 -1,-0.1 -2,-0.0 -70,-0.0 0.330 360.0 360.0-158.5 360.0 46.4 19.7 39.0 163 !* 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 0.0 164 309 B K 0 0 100 0, 0.0 -119,-0.1 0, 0.0 -23,-0.1 0.000 360.0 360.0 360.0 153.4 28.0 8.1 63.4 165 310 B S - 0 0 8 -25,-0.3 2,-0.5 -120,-0.0 -24,-0.1 0.542 360.0-157.2-133.8 -61.7 30.9 10.5 63.1 166 311 B T - 0 0 1 1,-0.1 -22,-0.2 2,-0.0 -1,-0.0 -0.512 51.1 -77.9 110.7 -65.5 30.1 14.1 63.9 167 312 B G - 0 0 13 -2,-0.5 -91,-0.1 -93,-0.1 -1,-0.1 0.602 39.0-170.2 130.0 58.9 32.7 16.2 62.2 168 313 B G + 0 0 2 1,-0.2 2,-5.4 -132,-0.1 -92,-0.2 0.547 55.3 118.7 -52.3 -6.6 36.0 16.3 64.0 169 314 B K + 0 0 9 -94,-0.6 -1,-0.2 -92,-0.1 -92,-0.2 -0.175 42.9 143.8 -57.8 56.9 36.9 19.0 61.5 170 315 B A + 0 0 29 -2,-5.4 2,-0.4 -94,-0.2 -139,-0.3 -0.794 23.3 171.1-116.8 94.9 37.3 21.2 64.6 171 316 B P - 0 0 16 0, 0.0 -54,-0.3 0, 0.0 -57,-0.1 -0.839 36.5-117.4-102.6 133.2 40.1 23.9 64.8 172 317 B R - 0 0 99 -2,-0.4 -55,-0.1 1,-0.2 -143,-0.0 0.797 65.3 -67.8 -26.2-107.8 40.3 26.5 67.6 173 318 B K 0 0 125 -58,-0.1 -57,-0.6 -57,-0.1 -1,-0.2 0.212 360.0 360.0-131.3 -14.9 39.9 29.9 66.1 174 319 B Q 0 0 139 -58,-0.1 -59,-0.0 -59,-0.1 -2,-0.0 0.025 360.0 360.0 171.6 360.0 43.2 29.2 64.5