==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 04-MAR-02 1IUG . COMPND 2 MOLECULE: PUTATIVE ASPARTATE AMINOTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS THERMOPHILUS; . AUTHOR Y.KATSURA,M.SHIROUZU,H.YAMAGUCHI,R.ISHITANI,O.NUREKI, . 696 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24701.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 507 72.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 48 6.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 57 8.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 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 . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 4 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 . 55 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 71 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 237 34.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 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 0 2 0 1 3 2 0 2 4 0 2 0 0 0 4 0 0 2 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 4 2 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 PARALLEL BRIDGES PER LADDER . 3 5 0 2 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 ANTIPARALLEL BRIDGES PER LADDER . 2 2 2 0 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 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 2 A D 0 0 173 0, 0.0 2,-1.0 0, 0.0 305,-0.2 0.000 360.0 360.0 360.0 -44.1 15.8 65.8 50.7 2 3 A W E -a 306 0A 73 303,-2.5 305,-2.5 302,-0.0 2,-0.8 -0.777 360.0-170.0 -96.4 92.7 17.4 66.5 47.3 3 4 A L E +a 307 0A 15 -2,-1.0 7,-0.4 303,-0.2 323,-0.2 -0.755 14.9 166.3 -83.4 113.0 18.0 70.2 47.2 4 5 A L + 0 0 1 303,-2.2 319,-1.5 -2,-0.8 305,-0.3 0.046 32.5 118.9-117.0 25.3 19.0 70.9 43.6 5 6 A T S S- 0 0 2 3,-0.3 2,-1.8 303,-0.2 5,-0.1 -0.649 73.4-117.4 -92.9 147.9 18.7 74.7 43.6 6 7 A P S S+ 0 0 12 0, 0.0 3,-0.2 0, 0.0 179,-0.1 -0.185 93.3 32.8 -77.7 47.8 21.6 77.1 42.9 7 8 A G S S+ 0 0 9 -2,-1.8 2,-0.2 1,-1.3 177,-0.1 0.232 103.1 40.8 114.7 118.9 21.4 78.5 46.3 8 9 A P S S- 0 0 0 0, 0.0 -1,-1.3 0, 0.0 -3,-0.3 0.633 88.5-167.6 -65.7 166.9 20.6 77.8 49.1 9 10 A V - 0 0 1 179,-0.4 2,-0.3 174,-0.3 363,-0.1 -0.716 30.5 -73.1-124.8 174.5 22.4 74.5 48.8 10 11 A R - 0 0 66 -7,-0.4 317,-2.1 -2,-0.2 2,-0.1 -0.506 63.3-115.2 -64.6 123.0 22.9 71.1 50.4 11 12 A L - 0 0 13 -2,-0.3 177,-0.2 315,-0.2 -1,-0.1 -0.380 17.5-117.0 -72.7 141.5 25.0 71.8 53.5 12 13 A H >> - 0 0 20 175,-1.8 3,-1.4 174,-0.1 4,-1.2 -0.516 26.5-121.1 -72.5 139.1 28.5 70.4 54.0 13 14 A P H 3> S+ 0 0 83 0, 0.0 4,-1.4 0, 0.0 5,-0.1 0.834 112.6 58.4 -50.2 -37.9 28.8 68.1 57.1 14 15 A K H 3> S+ 0 0 72 1,-0.2 4,-1.8 2,-0.2 226,-0.1 0.787 101.0 57.4 -64.6 -28.3 31.4 70.4 58.7 15 16 A A H <> S+ 0 0 0 -3,-1.4 4,-2.0 2,-0.2 -1,-0.2 0.904 104.1 50.1 -69.7 -42.1 28.9 73.2 58.6 16 17 A L H X S+ 0 0 61 -4,-1.2 4,-0.7 1,-0.2 -1,-0.2 0.834 109.7 52.0 -65.8 -33.5 26.3 71.4 60.6 17 18 A E H >X S+ 0 0 95 -4,-1.4 3,-0.8 2,-0.2 4,-0.5 0.930 108.9 50.1 -66.8 -46.1 28.9 70.5 63.2 18 19 A A H >< S+ 0 0 11 -4,-1.8 3,-1.0 1,-0.2 -2,-0.2 0.871 107.3 53.8 -59.9 -40.1 29.9 74.1 63.5 19 20 A L H 3< S+ 0 0 4 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.681 102.0 59.6 -70.4 -18.7 26.3 75.3 64.0 20 21 A A H << S+ 0 0 59 -3,-0.8 -1,-0.2 -4,-0.7 -2,-0.2 0.598 83.0 107.0 -84.4 -12.8 25.9 72.8 66.9 21 22 A R S << S- 0 0 149 -3,-1.0 3,-0.1 -4,-0.5 -3,-0.0 -0.336 82.7 -97.0 -67.3 145.8 28.7 74.5 68.9 22 23 A P - 0 0 98 0, 0.0 -1,-0.1 0, 0.0 337,-0.1 -0.259 54.8 -80.6 -61.8 152.1 27.7 76.6 71.9 23 24 A Q - 0 0 9 335,-0.1 2,-0.3 -3,-0.1 329,-0.0 -0.300 45.6-154.0 -59.4 131.0 27.4 80.3 71.4 24 25 A L - 0 0 53 -3,-0.1 2,-0.4 -2,-0.1 208,-0.1 -0.822 18.0-119.2-106.5 145.3 30.7 82.3 71.4 25 26 A H > - 0 0 25 -2,-0.3 3,-1.6 1,-0.1 6,-0.4 -0.729 20.6-135.2 -83.5 131.0 31.1 85.9 72.3 26 27 A H T 3 S+ 0 0 19 -2,-0.4 -1,-0.1 1,-0.3 9,-0.1 0.569 100.6 54.6 -63.1 -12.5 32.5 87.8 69.3 27 28 A R T 3 S+ 0 0 90 4,-0.1 -1,-0.3 198,-0.1 2,-0.1 0.425 82.5 105.5-101.5 -2.1 35.0 89.8 71.5 28 29 A T S <> S- 0 0 46 -3,-1.6 4,-2.0 1,-0.1 3,-0.4 -0.435 83.6-114.9 -75.2 154.3 36.6 86.8 73.2 29 30 A E H > S+ 0 0 108 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.815 116.4 58.6 -59.5 -30.4 40.1 85.8 71.9 30 31 A A H > S+ 0 0 50 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.893 107.3 46.1 -65.3 -41.0 38.8 82.5 70.6 31 32 A A H > S+ 0 0 1 -3,-0.4 4,-2.8 -6,-0.4 -2,-0.2 0.896 109.1 54.9 -68.4 -43.2 36.3 84.4 68.3 32 33 A R H X S+ 0 0 49 -4,-2.0 4,-3.1 1,-0.2 5,-0.2 0.932 109.6 47.1 -54.1 -53.4 39.0 86.9 67.1 33 34 A E H X S+ 0 0 120 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.875 112.2 48.6 -59.9 -40.9 41.2 84.1 66.0 34 35 A V H X S+ 0 0 33 -4,-1.7 4,-2.7 2,-0.2 -1,-0.2 0.927 113.5 48.3 -65.8 -42.7 38.4 82.2 64.2 35 36 A F H X S+ 0 0 4 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.943 114.1 45.1 -61.9 -49.3 37.4 85.5 62.5 36 37 A L H X S+ 0 0 70 -4,-3.1 4,-2.4 1,-0.2 -1,-0.2 0.856 111.3 55.2 -61.6 -36.1 41.0 86.2 61.5 37 38 A K H X S+ 0 0 98 -4,-2.3 4,-2.1 -5,-0.2 -2,-0.2 0.943 109.8 45.1 -61.8 -49.0 41.3 82.6 60.4 38 39 A A H X S+ 0 0 0 -4,-2.7 4,-2.6 2,-0.2 5,-0.3 0.914 109.7 55.8 -61.4 -43.5 38.3 83.0 58.1 39 40 A R H X S+ 0 0 12 -4,-2.6 4,-1.4 1,-0.2 -1,-0.2 0.943 111.0 45.2 -51.2 -54.1 39.7 86.3 56.8 40 41 A G H X S+ 0 0 29 -4,-2.4 4,-1.5 1,-0.2 -1,-0.2 0.834 112.3 49.4 -61.3 -39.6 42.9 84.5 55.8 41 42 A L H X S+ 0 0 15 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.889 110.5 49.1 -69.8 -39.8 41.2 81.5 54.2 42 43 A L H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.811 106.2 60.9 -66.9 -28.5 38.9 83.7 52.1 43 44 A R H X>S+ 0 0 76 -4,-1.4 5,-1.4 -5,-0.3 4,-0.7 0.921 109.1 40.3 -61.6 -47.9 42.0 85.6 51.1 44 45 A E H <5S+ 0 0 116 -4,-1.5 3,-0.5 2,-0.2 -2,-0.2 0.883 112.7 55.8 -69.0 -42.7 43.4 82.4 49.6 45 46 A A H <5S+ 0 0 5 -4,-2.5 119,-0.3 1,-0.2 -2,-0.2 0.874 111.1 43.7 -58.6 -39.7 40.1 81.4 48.1 46 47 A F H <5S- 0 0 0 -4,-2.3 124,-0.3 -5,-0.1 -1,-0.2 0.610 105.4-130.5 -81.7 -14.9 39.8 84.8 46.2 47 48 A R T <5 + 0 0 108 -4,-0.7 123,-1.7 -3,-0.5 125,-0.5 0.994 58.3 135.1 62.1 62.8 43.5 84.7 45.1 48 49 A T < - 0 0 11 -5,-1.4 -1,-0.2 121,-0.2 -2,-0.1 -0.976 60.8-148.6-142.1 155.1 44.4 88.2 46.2 49 50 A E S S+ 0 0 143 -2,-0.3 149,-0.1 2,-0.1 -1,-0.1 0.401 86.2 77.8 -96.6 -2.4 47.1 90.0 48.1 50 51 A G S S- 0 0 0 -7,-0.1 2,-0.3 1,-0.1 148,-0.2 0.312 89.9 -76.1 -84.6-147.1 44.4 92.4 49.3 51 52 A E E -B 197 0B 37 146,-2.1 146,-3.3 147,-0.1 2,-0.5 -0.909 24.4-149.9-124.2 148.5 41.7 92.1 52.0 52 53 A V E -B 196 0B 0 -2,-0.3 2,-0.4 144,-0.2 144,-0.3 -0.973 15.0-153.6-117.8 125.4 38.4 90.2 52.3 53 54 A L E -B 195 0B 0 142,-3.1 142,-2.0 -2,-0.5 2,-0.6 -0.858 6.6-142.5-102.4 135.3 35.7 91.7 54.5 54 55 A I E -B 194 0B 5 -2,-0.4 2,-0.4 140,-0.2 140,-0.2 -0.874 21.0-171.7 -98.0 119.3 33.0 89.6 56.1 55 56 A L E -B 193 0B 4 138,-3.2 138,-2.6 -2,-0.6 2,-1.0 -0.898 25.1-127.0-114.1 141.4 29.6 91.2 56.2 56 57 A T E S+B 192 0B 8 -2,-0.4 351,-0.4 136,-0.2 2,-0.3 -0.773 77.6 58.4 -89.2 104.2 26.5 90.0 58.0 57 58 A G S S- 0 0 0 134,-1.4 134,-0.3 -2,-1.0 349,-0.2 -0.918 90.5 -55.1 161.8-177.9 23.8 89.9 55.3 58 59 A S >> - 0 0 0 347,-0.4 4,-1.0 -2,-0.3 3,-0.7 -0.182 57.4 -93.8 -80.5 177.0 23.0 88.3 52.0 59 60 A G H 3> S+ 0 0 0 1,-0.2 4,-1.6 2,-0.2 3,-0.4 0.854 122.3 62.8 -58.1 -37.2 25.1 88.4 48.8 60 61 A T H 3> S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.867 97.9 57.2 -57.0 -37.9 23.2 91.5 47.5 61 62 A L H <> S+ 0 0 2 -3,-0.7 4,-2.2 1,-0.2 -1,-0.2 0.887 105.3 50.4 -60.4 -41.7 24.4 93.5 50.5 62 63 A A H X S+ 0 0 0 -4,-1.0 4,-1.8 -3,-0.4 -1,-0.2 0.845 108.5 52.9 -65.2 -35.8 28.1 92.7 49.5 63 64 A M H X S+ 0 0 0 -4,-1.6 4,-2.0 2,-0.2 -2,-0.2 0.918 110.8 46.5 -65.8 -43.9 27.3 93.9 46.0 64 65 A E H X S+ 0 0 13 -4,-2.2 4,-2.7 1,-0.2 5,-0.2 0.881 111.5 51.1 -65.4 -41.3 25.9 97.2 47.2 65 66 A A H X S+ 0 0 0 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.856 108.8 52.1 -65.2 -37.2 28.8 97.8 49.6 66 67 A L H X S+ 0 0 0 -4,-1.8 4,-0.6 2,-0.2 -2,-0.2 0.951 114.3 42.0 -62.7 -51.1 31.3 97.2 46.8 67 68 A V H >X S+ 0 0 0 -4,-2.0 4,-1.5 1,-0.2 3,-0.8 0.919 115.6 48.6 -62.6 -48.9 29.6 99.7 44.5 68 69 A K H 3< S+ 0 0 14 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.840 113.6 46.2 -60.7 -41.5 29.0 102.3 47.2 69 70 A N H 3< S+ 0 0 0 -4,-1.9 137,-3.3 -5,-0.2 -1,-0.2 0.472 118.3 38.7 -86.2 -2.7 32.6 102.2 48.6 70 71 A L H << S+ 0 0 3 -3,-0.8 2,-0.4 -4,-0.6 -2,-0.2 0.527 113.1 52.0-119.6 -14.9 34.5 102.4 45.2 71 72 A F < - 0 0 2 -4,-1.5 -1,-0.2 135,-0.2 3,-0.1 -0.991 67.9-148.8-130.5 130.9 32.3 104.8 43.3 72 73 A A > - 0 0 32 -2,-0.4 3,-1.8 1,-0.1 -3,-0.1 -0.596 42.8 -77.4 -92.2 157.5 31.2 108.3 44.3 73 74 A P T 3 S+ 0 0 91 0, 0.0 25,-0.2 0, 0.0 24,-0.1 -0.253 116.9 26.8 -55.3 136.5 27.9 109.9 43.1 74 75 A G T 3 S+ 0 0 54 23,-2.8 24,-0.2 1,-0.3 23,-0.1 0.193 87.2 136.8 96.2 -16.1 28.0 111.2 39.6 75 76 A E < - 0 0 53 -3,-1.8 24,-2.0 22,-0.2 2,-0.5 -0.342 57.2-113.6 -70.3 146.7 30.7 108.8 38.3 76 77 A R E +c 99 0B 106 22,-0.2 46,-2.4 44,-0.1 47,-1.2 -0.675 39.6 174.8 -81.6 120.5 30.5 107.0 34.9 77 78 A V E -cd 100 123B 0 22,-2.5 24,-2.2 -2,-0.5 2,-0.5 -0.985 24.7-141.7-133.4 141.8 30.0 103.3 35.0 78 79 A L E -cd 101 124B 0 45,-2.8 47,-2.0 -2,-0.4 24,-0.2 -0.879 20.3-178.7-102.0 123.5 29.4 100.6 32.4 79 80 A V E -c 102 0B 0 22,-2.8 24,-1.2 -2,-0.5 2,-0.2 -0.906 12.6-155.8-128.5 103.1 27.1 97.8 33.3 80 81 A P E -c 103 0B 2 0, 0.0 2,-0.5 0, 0.0 24,-0.2 -0.562 12.0-152.7 -74.8 139.1 26.4 95.0 30.8 81 82 A V E +c 104 0B 1 22,-2.8 24,-2.3 -2,-0.2 3,-0.1 -0.968 38.9 138.3-121.0 121.5 23.0 93.2 31.4 82 83 A Y + 0 0 0 -2,-0.5 26,-0.9 1,-0.2 2,-0.3 0.092 69.0 6.3-145.5 21.2 22.5 89.6 30.4 83 84 A G S > S- 0 0 0 24,-0.2 4,-2.2 1,-0.1 5,-0.2 -0.983 89.1 -69.6 177.0 179.8 20.6 88.1 33.3 84 85 A K H > S+ 0 0 49 -2,-0.3 4,-2.5 1,-0.2 -1,-0.1 0.911 124.9 41.9 -56.7 -49.3 18.8 88.5 36.6 85 86 A F H > S+ 0 0 12 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.805 114.9 46.6 -75.8 -32.0 21.9 89.3 38.6 86 87 A S H > S+ 0 0 1 2,-0.3 4,-1.7 1,-0.2 -1,-0.2 0.858 112.5 52.8 -72.3 -38.0 23.7 91.7 36.2 87 88 A E H >X S+ 0 0 52 -4,-2.2 4,-1.4 1,-0.2 3,-1.3 0.987 106.5 55.8 -51.3 -56.7 20.4 93.3 35.9 88 89 A R H 3X S+ 0 0 22 -4,-2.5 4,-1.7 1,-0.3 -2,-0.3 0.813 102.4 52.4 -43.0 -45.9 20.7 93.4 39.6 89 90 A F H 3X S+ 0 0 1 -4,-1.6 4,-2.1 1,-0.2 -1,-0.3 0.853 104.2 58.3 -61.9 -37.6 24.0 95.2 39.5 90 91 A Y H S+ 0 0 0 -4,-2.1 5,-1.8 2,-0.2 -2,-0.2 0.885 110.1 49.9 -64.4 -40.4 24.4 101.4 40.5 94 95 A L H ><5S+ 0 0 80 -4,-2.0 3,-2.2 1,-0.2 4,-0.2 0.969 111.3 46.8 -62.4 -53.2 21.4 103.6 39.8 95 96 A E H 3<5S+ 0 0 73 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.800 104.8 62.5 -60.7 -29.0 20.4 103.8 43.5 96 97 A A T 3<5S- 0 0 4 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.426 121.0-109.6 -76.5 1.9 24.0 104.6 44.4 97 98 A G T < 5 + 0 0 40 -3,-2.2 -23,-2.8 1,-0.2 2,-0.3 0.872 68.3 144.9 73.2 40.8 23.7 107.7 42.3 98 99 A L < - 0 0 10 -5,-1.8 2,-0.8 -25,-0.2 -1,-0.2 -0.770 56.8-115.0-110.7 154.5 25.8 106.8 39.3 99 100 A V E -c 76 0B 76 -24,-2.0 -22,-2.5 -2,-0.3 2,-0.5 -0.794 43.8-160.0 -86.9 112.7 25.5 107.5 35.6 100 101 A V E -c 77 0B 26 -2,-0.8 2,-0.7 -24,-0.2 -22,-0.2 -0.857 22.2-159.4-111.0 123.5 24.9 104.1 34.1 101 102 A E E -c 78 0B 46 -24,-2.2 -22,-2.8 -2,-0.5 2,-0.6 -0.848 20.2-159.6 -92.9 118.5 25.4 102.9 30.6 102 103 A R E -c 79 0B 73 -2,-0.7 2,-0.7 -24,-0.2 -24,-0.0 -0.893 8.1-169.2-106.9 112.4 23.3 99.7 30.3 103 104 A L E -c 80 0B 43 -24,-1.2 -22,-2.8 -2,-0.6 2,-0.3 -0.901 15.8-146.2-105.1 109.5 24.2 97.3 27.4 104 105 A D E +c 81 0B 107 -2,-0.7 -22,-0.2 -24,-0.2 -2,-0.0 -0.535 18.1 179.9 -81.3 137.5 21.5 94.6 26.9 105 106 A Y - 0 0 27 -24,-2.3 3,-0.1 -2,-0.3 2,-0.1 -0.941 39.5 -94.5-130.5 148.5 22.2 91.1 25.8 106 107 A P > - 0 0 86 0, 0.0 3,-2.6 0, 0.0 2,-0.1 -0.415 55.1 -93.6 -62.5 138.3 19.8 88.2 25.3 107 108 A Y T 3 S+ 0 0 39 1,-0.3 -24,-0.2 -2,-0.1 3,-0.1 -0.363 118.2 37.0 -54.8 123.3 19.5 86.1 28.4 108 109 A G T 3 S+ 0 0 1 -26,-0.9 169,-1.2 1,-0.5 170,-0.4 0.097 100.4 97.7 117.4 -19.4 22.0 83.3 27.9 109 110 A D < - 0 0 31 -3,-2.6 -1,-0.5 167,-0.2 26,-0.1 -0.472 58.2-147.1 -96.2 168.0 24.6 85.4 26.2 110 111 A T - 0 0 23 -2,-0.2 -29,-0.0 -3,-0.1 27,-0.0 -0.943 29.5 -88.1-134.1 155.4 27.7 87.2 27.6 111 112 A P - 0 0 5 0, 0.0 27,-0.4 0, 0.0 31,-0.1 -0.250 35.2-128.7 -63.3 147.8 29.5 90.5 26.8 112 113 A R >> - 0 0 126 1,-0.1 3,-1.4 25,-0.1 4,-0.8 -0.759 18.6-123.4 -95.3 144.5 32.2 90.6 24.1 113 114 A P T 34 S+ 0 0 37 0, 0.0 3,-0.4 0, 0.0 4,-0.4 0.826 113.4 58.4 -56.5 -30.1 35.6 92.2 25.1 114 115 A E T 34 S+ 0 0 131 1,-0.2 3,-0.3 2,-0.2 28,-0.0 0.747 97.7 60.8 -71.8 -24.3 35.1 94.6 22.2 115 116 A D T <4 S+ 0 0 52 -3,-1.4 -1,-0.2 1,-0.2 27,-0.0 0.779 108.4 41.2 -74.5 -28.3 31.8 95.8 23.6 116 117 A V S < S+ 0 0 0 -4,-0.8 2,-2.5 -3,-0.4 -1,-0.2 0.408 81.6 105.7 -99.4 0.2 33.3 97.1 26.8 117 118 A A + 0 0 28 -4,-0.4 2,-0.4 -3,-0.3 -1,-0.1 -0.433 51.8 136.5 -79.5 65.4 36.4 98.6 25.2 118 119 A K - 0 0 72 -2,-2.5 3,-0.5 32,-0.0 2,-0.2 -0.953 48.5-138.4-115.7 135.2 35.0 102.1 25.7 119 120 A E S S+ 0 0 154 -2,-0.4 31,-0.1 1,-0.2 -2,-0.0 -0.624 78.0 51.4 -91.6 149.0 37.0 105.1 26.9 120 121 A G S S+ 0 0 58 29,-0.4 2,-0.4 1,-0.3 -1,-0.2 0.504 75.8 117.6 107.8 6.4 35.5 107.6 29.4 121 122 A Y - 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