==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 07-JAN-09 3FQV . COMPND 2 MOLECULE: TRIMETHOPRIM-SENSITIVE DIHYDROFOLATE REDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: STAPHYLOCOCCUS AUREUS RF122; . AUTHOR A.C.ANDERSON,K.M.FREY,J.LIU,M.N.LOMBARDO . 157 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8900.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 109 69.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 29 18.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 23 14.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 2 1.3 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 . 17 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 21 13.4 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+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 0 2 0 0 0 1 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 1 2 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 PARALLEL BRIDGES PER LADDER . 1 1 0 0 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 ANTIPARALLEL BRIDGES PER LADDER . 1 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 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 1 A T 0 0 96 0, 0.0 88,-2.9 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 137.5 -21.7 -10.9 24.2 2 2 A L E +a 89 0A 19 86,-0.2 104,-2.5 102,-0.1 105,-1.2 -0.974 360.0 169.5-115.6 117.7 -20.7 -12.6 27.4 3 3 A S E -ab 90 107A 0 86,-2.8 88,-3.6 -2,-0.5 2,-0.4 -0.900 32.6-128.1-126.6 151.6 -21.0 -10.5 30.5 4 4 A I E -ab 91 108A 0 103,-2.5 105,-3.3 -2,-0.3 2,-0.4 -0.812 20.4-166.9 -89.6 140.8 -20.9 -10.9 34.3 5 5 A L E + b 0 109A 4 86,-2.7 2,-0.3 -2,-0.4 105,-0.2 -0.966 26.3 144.3-130.0 116.4 -23.8 -9.4 36.2 6 6 A V E - b 0 110A 9 103,-2.4 105,-2.6 -2,-0.4 2,-0.4 -0.993 40.9-149.2-153.0 148.0 -23.2 -9.2 40.0 7 7 A A E + b 0 111A 14 -2,-0.3 2,-0.3 103,-0.2 105,-0.2 -0.998 31.9 166.6-117.5 125.5 -23.9 -7.1 43.1 8 8 A H E - b 0 112A 8 103,-2.3 105,-3.1 -2,-0.4 6,-0.2 -0.979 27.1-126.3-138.8 153.7 -21.1 -7.3 45.7 9 9 A D E > - b 0 113A 0 4,-1.7 3,-2.1 -2,-0.3 105,-0.2 -0.084 49.0 -75.0 -88.2-170.2 -20.3 -5.4 48.9 10 10 A L T 3 S+ 0 0 88 105,-2.4 106,-0.1 103,-0.5 104,-0.1 0.705 136.2 40.1 -61.8 -20.9 -17.0 -3.6 49.9 11 11 A Q T 3 S- 0 0 97 104,-0.4 -1,-0.3 106,-0.1 105,-0.1 0.128 123.2-102.3-113.2 18.5 -15.4 -7.0 50.6 12 12 A R < + 0 0 76 -3,-2.1 111,-2.8 1,-0.2 2,-0.2 0.634 64.1 160.4 66.6 21.1 -16.9 -8.8 47.6 13 13 A V E +H 122 0B 2 109,-0.2 -4,-1.7 1,-0.1 109,-0.3 -0.503 11.6 169.6 -63.3 135.2 -19.7 -10.6 49.6 14 14 A I E + 0 0 18 107,-3.1 2,-0.3 1,-0.3 108,-0.2 0.491 58.8 11.3-118.8 -15.5 -22.5 -11.7 47.3 15 15 A G E -H 121 0B 7 106,-1.4 105,-2.5 5,-0.2 106,-1.5 -0.997 45.1-161.6-161.3 157.1 -24.5 -13.9 49.6 16 16 A F B > S-I 19 0C 65 3,-2.5 3,-1.5 -2,-0.3 103,-0.1 -0.930 82.1 -15.8-146.9 125.1 -25.3 -15.3 53.0 17 17 A E T 3 S- 0 0 138 -2,-0.3 3,-0.1 1,-0.3 -1,-0.0 0.901 126.8 -51.9 47.1 54.1 -27.2 -18.5 53.7 18 18 A N T 3 S+ 0 0 96 1,-0.2 2,-0.3 32,-0.0 -1,-0.3 0.581 122.2 91.5 63.8 15.5 -28.6 -18.7 50.2 19 19 A Q B < S-I 16 0C 149 -3,-1.5 -3,-2.5 31,-0.0 -1,-0.2 -0.882 85.6 -97.3-131.2 161.9 -29.9 -15.2 50.2 20 20 A L - 0 0 94 -2,-0.3 -5,-0.2 -5,-0.2 -6,-0.0 -0.690 31.9-139.6 -72.9 133.8 -28.8 -11.7 49.2 21 21 A P S S+ 0 0 38 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.633 79.8 47.0 -71.2 -14.7 -27.5 -10.0 52.4 22 22 A W S S- 0 0 18 95,-0.1 2,-0.6 2,-0.0 -2,-0.1 -0.794 73.5-129.8-126.4 164.7 -29.1 -6.7 51.5 23 23 A H + 0 0 134 -2,-0.3 123,-0.4 4,-0.0 124,-0.2 -0.946 37.5 155.1-118.3 108.4 -32.4 -5.3 50.2 24 24 A L >> - 0 0 6 -2,-0.6 3,-1.4 1,-0.1 4,-1.3 -0.708 18.6-179.6-139.1 83.3 -32.0 -3.0 47.2 25 25 A P H 3> S+ 0 0 34 0, 0.0 4,-2.0 0, 0.0 5,-0.2 0.833 84.2 63.0 -49.1 -39.1 -35.0 -2.6 44.8 26 26 A N H 3> S+ 0 0 40 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.827 102.6 49.9 -56.5 -35.8 -33.0 -0.3 42.6 27 27 A D H <> S+ 0 0 10 -3,-1.4 4,-2.4 2,-0.2 -1,-0.2 0.869 106.8 52.9 -73.3 -37.4 -30.5 -3.1 41.9 28 28 A L H X S+ 0 0 98 -4,-1.3 4,-2.4 2,-0.2 -2,-0.2 0.872 109.5 51.0 -63.5 -36.2 -33.3 -5.5 41.0 29 29 A K H X S+ 0 0 151 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.884 107.6 52.9 -62.7 -42.9 -34.6 -2.9 38.5 30 30 A H H X S+ 0 0 30 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.906 110.6 47.0 -58.6 -46.1 -31.0 -2.6 37.1 31 31 A V H X S+ 0 0 15 -4,-2.4 4,-2.8 2,-0.2 5,-0.3 0.926 111.8 51.1 -60.4 -48.1 -31.0 -6.4 36.6 32 32 A K H X S+ 0 0 127 -4,-2.4 4,-1.7 1,-0.2 -2,-0.2 0.909 112.1 46.5 -57.4 -46.0 -34.4 -6.3 35.0 33 33 A K H < S+ 0 0 153 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.905 117.5 42.4 -64.6 -44.1 -33.4 -3.5 32.6 34 34 A L H < S+ 0 0 24 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.897 123.7 31.9 -69.4 -43.4 -30.1 -5.2 31.6 35 35 A S H >< S+ 0 0 0 -4,-2.8 3,-2.2 -5,-0.2 23,-0.2 0.557 81.0 115.3-103.3 -12.5 -31.3 -8.8 31.2 36 36 A T T 3< S+ 0 0 53 -4,-1.7 21,-0.2 -5,-0.3 20,-0.1 -0.420 90.3 15.9 -59.3 129.3 -34.9 -8.6 30.0 37 37 A G T 3 S+ 0 0 60 19,-2.7 -1,-0.3 1,-0.3 20,-0.2 0.510 121.3 75.8 82.6 5.9 -35.0 -10.1 26.5 38 38 A H S < S- 0 0 75 -3,-2.2 20,-2.8 18,-0.2 2,-0.4 -0.279 85.5 -78.7-124.8-150.5 -31.6 -11.8 26.9 39 39 A T E -cd 58 89A 11 49,-2.0 51,-2.9 18,-0.2 2,-0.4 -0.973 24.1-162.0-128.1 135.4 -30.1 -14.8 28.7 40 40 A L E -cd 59 90A 0 18,-3.0 20,-3.1 -2,-0.4 2,-0.5 -0.957 6.7-164.7-109.0 134.3 -29.1 -15.5 32.3 41 41 A V E +cd 60 91A 0 49,-2.6 51,-3.3 -2,-0.4 52,-0.5 -0.985 19.1 167.2-116.2 125.3 -26.8 -18.3 33.2 42 42 A M E -cd 61 93A 0 18,-2.5 20,-3.0 -2,-0.5 52,-0.3 -0.962 35.6-106.6-137.7 153.9 -26.6 -19.4 36.8 43 43 A G E > -c 62 0A 9 50,-2.3 4,-2.0 -2,-0.3 5,-0.2 -0.306 42.1-104.0 -69.6 163.4 -25.3 -22.2 39.0 44 44 A R H > S+ 0 0 118 18,-1.2 4,-2.1 1,-0.2 5,-0.2 0.882 119.8 50.9 -57.3 -42.7 -27.8 -24.7 40.5 45 45 A K H > S+ 0 0 133 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.887 107.5 52.3 -67.2 -40.7 -27.6 -23.2 44.0 46 46 A T H > S+ 0 0 28 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.910 110.3 49.5 -58.9 -44.7 -28.2 -19.6 42.8 47 47 A F H X S+ 0 0 1 -4,-2.0 4,-3.3 1,-0.2 3,-0.4 0.925 110.3 49.3 -61.3 -44.7 -31.3 -20.8 40.9 48 48 A E H < S+ 0 0 93 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.752 103.7 60.2 -71.1 -22.5 -32.7 -22.6 44.0 49 49 A S H < S+ 0 0 55 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.871 115.1 35.5 -66.6 -37.2 -32.1 -19.6 46.1 50 50 A I H < S- 0 0 61 -4,-1.3 -2,-0.2 -3,-0.4 -1,-0.2 0.830 95.5-154.9 -85.1 -36.0 -34.5 -17.7 43.8 51 51 A G < + 0 0 44 -4,-3.3 -3,-0.1 -5,-0.2 -4,-0.1 0.072 64.5 43.4 91.0 -23.6 -36.7 -20.8 43.3 52 52 A K S S- 0 0 147 -5,-0.2 20,-0.1 18,-0.0 18,-0.0 -0.986 91.2 -88.9-152.1 152.5 -38.2 -19.9 39.9 53 53 A P - 0 0 34 0, 0.0 20,-0.1 0, 0.0 5,-0.0 -0.281 44.4-109.0 -63.3 149.5 -37.0 -18.4 36.6 54 54 A L > - 0 0 50 1,-0.1 3,-0.6 18,-0.1 -14,-0.1 -0.676 43.9-108.1 -78.6 133.2 -37.0 -14.6 36.1 55 55 A P T 3 S+ 0 0 85 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.149 89.4 21.1 -64.9 153.7 -39.7 -13.5 33.7 56 56 A N T 3 S+ 0 0 127 1,-0.1 -19,-2.7 -20,-0.1 2,-0.3 0.727 109.2 68.5 66.6 30.0 -39.2 -12.3 30.1 57 57 A R S < S- 0 0 34 -3,-0.6 2,-0.4 -21,-0.2 -18,-0.2 -0.966 89.9 -84.8-162.5 165.9 -35.8 -13.7 29.5 58 58 A R E -c 39 0A 91 -20,-2.8 -18,-3.0 -2,-0.3 2,-0.6 -0.667 36.3-156.2 -80.6 128.2 -34.0 -17.1 29.0 59 59 A N E -ce 40 73A 4 13,-0.5 15,-3.0 -2,-0.4 2,-0.5 -0.937 11.7-175.2-107.6 114.8 -33.1 -18.8 32.3 60 60 A V E -ce 41 74A 0 -20,-3.1 -18,-2.5 -2,-0.6 2,-0.5 -0.943 6.3-160.5-112.9 126.2 -30.2 -21.3 31.9 61 61 A V E -ce 42 75A 0 13,-2.8 15,-2.6 -2,-0.5 2,-0.6 -0.915 7.9-147.2-112.8 129.1 -29.1 -23.4 34.9 62 62 A L E +ce 43 76A 24 -20,-3.0 -18,-1.2 -2,-0.5 2,-0.3 -0.839 38.2 139.7 -94.2 121.1 -25.7 -25.1 35.1 63 63 A T - 0 0 15 13,-2.1 -2,-0.0 -2,-0.6 -20,-0.0 -0.986 54.7-138.7-154.8 154.8 -25.8 -28.4 37.0 64 64 A S S S+ 0 0 110 -2,-0.3 2,-0.7 3,-0.0 13,-0.1 0.544 73.8 113.1 -87.8 -9.7 -24.4 -32.0 36.9 65 65 A D > - 0 0 78 1,-0.2 3,-1.1 2,-0.1 -2,-0.1 -0.519 50.8-166.9 -71.5 107.6 -27.9 -33.3 37.9 66 66 A T T 3 S+ 0 0 126 -2,-0.7 -1,-0.2 1,-0.2 11,-0.0 0.637 87.9 56.4 -68.8 -16.3 -29.2 -35.2 34.9 67 67 A S T 3 S+ 0 0 99 2,-0.0 -1,-0.2 -3,-0.0 2,-0.2 0.552 76.9 123.2 -91.0 -11.3 -32.7 -35.3 36.4 68 68 A F < + 0 0 26 -3,-1.1 2,-0.3 2,-0.0 7,-0.1 -0.343 27.7 151.5 -59.7 120.6 -32.8 -31.5 36.7 69 69 A N + 0 0 139 -2,-0.2 2,-0.4 5,-0.1 5,-0.1 -0.891 12.5 171.1-153.2 118.1 -35.9 -30.2 34.9 70 70 A V > - 0 0 40 3,-0.4 3,-1.9 -2,-0.3 2,-0.2 -0.998 39.7-109.6-130.0 135.0 -37.7 -27.0 35.8 71 71 A E T 3 S+ 0 0 173 -2,-0.4 3,-0.1 1,-0.3 -2,-0.0 -0.462 107.2 19.0 -63.8 129.1 -40.5 -25.4 33.7 72 72 A G T 3 S+ 0 0 42 1,-0.2 -13,-0.5 -2,-0.2 2,-0.4 0.512 107.9 103.9 86.0 7.3 -39.2 -22.2 32.1 73 73 A V E < -e 59 0A 13 -3,-1.9 2,-0.4 -15,-0.1 -3,-0.4 -0.979 58.1-151.3-125.8 132.2 -35.6 -23.2 32.6 74 74 A D E -e 60 0A 71 -15,-3.0 -13,-2.8 -2,-0.4 2,-0.4 -0.863 21.0-142.8 -97.6 135.2 -33.1 -24.6 30.1 75 75 A V E -e 61 0A 45 -2,-0.4 2,-0.3 -15,-0.2 -13,-0.2 -0.803 18.0-177.7-105.0 139.1 -30.4 -26.9 31.6 76 76 A I E -e 62 0A 16 -15,-2.6 -13,-2.1 -2,-0.4 3,-0.1 -0.927 13.7-163.0-125.5 156.7 -26.7 -27.1 30.7 77 77 A H + 0 0 97 -2,-0.3 2,-0.3 -15,-0.2 -15,-0.1 0.342 68.9 45.2-121.9 3.6 -24.2 -29.6 32.1 78 78 A S S > S- 0 0 47 1,-0.1 3,-0.6 -14,-0.0 4,-0.3 -0.987 71.5-125.7-147.5 151.6 -20.8 -28.0 31.1 79 79 A I G >> S+ 0 0 26 -2,-0.3 3,-2.2 1,-0.2 4,-0.5 0.908 111.5 62.7 -58.1 -43.4 -19.1 -24.6 31.1 80 80 A E G >4 S+ 0 0 117 1,-0.3 3,-0.5 2,-0.2 4,-0.3 0.743 90.1 68.7 -58.4 -25.6 -18.4 -25.1 27.3 81 81 A D G X4 S+ 0 0 66 -3,-0.6 3,-0.8 1,-0.2 -1,-0.3 0.726 88.0 66.3 -63.9 -25.4 -22.2 -25.1 26.8 82 82 A I G X4 S+ 0 0 3 -3,-2.2 3,-1.9 -4,-0.3 -1,-0.2 0.900 92.3 59.8 -63.4 -41.4 -22.3 -21.4 27.6 83 83 A Y G << S+ 0 0 92 -4,-0.5 -1,-0.2 -3,-0.5 -2,-0.2 0.606 100.8 56.1 -67.1 -13.1 -20.3 -20.5 24.5 84 84 A Q G < S+ 0 0 150 -3,-0.8 -1,-0.3 -4,-0.3 -2,-0.2 0.345 80.9 107.8-100.3 4.2 -23.0 -22.0 22.3 85 85 A L < - 0 0 22 -3,-1.9 2,-0.1 -4,-0.1 4,-0.1 -0.707 69.1-129.0 -81.7 128.5 -25.8 -19.9 23.7 86 86 A P + 0 0 92 0, 0.0 2,-0.1 0, 0.0 -2,-0.1 -0.432 61.0 8.4 -77.5 153.3 -26.9 -17.2 21.2 87 87 A G S S- 0 0 56 -2,-0.1 2,-0.7 2,-0.1 -49,-0.1 -0.344 111.6 -13.9 87.7-161.8 -27.3 -13.4 22.0 88 88 A H - 0 0 36 -51,-0.2 -49,-2.0 -2,-0.1 2,-0.5 -0.724 66.7-167.8 -81.8 117.3 -26.3 -11.4 25.1 89 89 A V E -ad 2 39A 5 -88,-2.9 -86,-2.8 -2,-0.7 2,-0.5 -0.927 5.7-160.3-113.4 126.4 -25.5 -13.9 27.9 90 90 A F E -ad 3 40A 2 -51,-2.9 -49,-2.6 -2,-0.5 2,-0.6 -0.929 16.8-137.1-107.4 121.9 -25.1 -12.7 31.5 91 91 A I E -ad 4 41A 0 -88,-3.6 -86,-2.7 -2,-0.5 -49,-0.2 -0.714 26.3-176.0 -74.8 118.2 -23.3 -14.8 34.0 92 92 A F E - 0 0 35 -51,-3.3 2,-0.2 -2,-0.6 -50,-0.2 0.402 32.7-168.3-108.5 -2.4 -25.6 -14.4 37.0 93 93 A G E - d 0 42A 2 -52,-0.5 -50,-2.3 1,-0.2 -1,-0.4 -0.608 55.4-149.2 125.4 173.5 -23.9 -16.3 39.8 94 94 A G > - 0 0 11 -52,-0.3 4,-2.7 -2,-0.2 5,-0.2 0.418 56.8 -92.4-103.6-138.7 -22.9 -17.7 42.1 95 95 A Q H > S+ 0 0 62 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.894 121.2 48.8 -53.7 -48.1 -19.4 -17.8 43.5 96 96 A T H > S+ 0 0 89 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.933 113.7 45.5 -61.7 -47.4 -18.4 -21.0 41.6 97 97 A L H > S+ 0 0 1 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.905 112.8 50.9 -63.0 -41.9 -19.7 -19.8 38.2 98 98 A Y H X S+ 0 0 9 -4,-2.7 4,-2.7 1,-0.2 -1,-0.2 0.910 110.1 50.1 -60.7 -42.9 -18.0 -16.4 38.7 99 99 A E H < S+ 0 0 95 -4,-2.5 4,-0.3 -5,-0.2 -1,-0.2 0.881 113.7 46.0 -62.8 -38.2 -14.7 -18.0 39.5 100 100 A E H < S+ 0 0 92 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.727 123.8 33.0 -73.5 -24.3 -15.0 -20.2 36.4 101 101 A M H >X S+ 0 0 0 -4,-1.5 3,-2.4 -3,-0.2 4,-1.6 0.640 87.7 87.8-113.5 -19.0 -16.0 -17.3 34.2 102 102 A I T 3< S+ 0 0 19 -4,-2.7 -3,-0.1 1,-0.3 -2,-0.1 0.846 93.5 51.9 -54.4 -35.6 -14.3 -14.1 35.3 103 103 A D T 34 S+ 0 0 93 -4,-0.3 -1,-0.3 -5,-0.2 -2,-0.1 0.580 115.3 42.5 -72.0 -12.8 -11.3 -14.9 33.1 104 104 A K T <4 S+ 0 0 116 -3,-2.4 -2,-0.2 0, 0.0 -1,-0.2 0.645 86.9 101.3-114.5 -22.1 -13.5 -15.5 30.1 105 105 A V < - 0 0 0 -4,-1.6 -102,-0.2 1,-0.1 3,-0.1 -0.296 55.9-149.1 -74.9 153.4 -16.1 -12.7 30.0 106 106 A D S S+ 0 0 85 -104,-2.5 50,-2.0 1,-0.2 2,-0.3 0.814 80.3 18.4 -76.7 -31.9 -15.9 -9.6 27.7 107 107 A D E -bF 3 155A 14 -105,-1.2 -103,-2.5 48,-0.2 2,-0.4 -0.916 58.8-150.3-150.3 145.9 -17.7 -7.4 30.2 108 108 A M E -bF 4 154A 0 46,-2.8 46,-3.1 -2,-0.3 2,-0.7 -0.989 0.3-165.9-132.6 128.4 -18.8 -7.0 33.8 109 109 A Y E +bF 5 153A 40 -105,-3.3 -103,-2.4 -2,-0.4 2,-0.5 -0.940 25.6 178.8-105.1 106.3 -21.8 -5.1 35.2 110 110 A I E -bF 6 152A 0 42,-2.3 42,-3.6 -2,-0.7 2,-0.7 -0.932 25.2-157.7-116.6 127.7 -21.1 -4.7 38.9 111 111 A T E -bF 7 151A 0 -105,-2.6 -103,-2.3 -2,-0.5 2,-0.7 -0.940 18.6-151.5 -97.8 111.8 -23.3 -3.1 41.5 112 112 A V E -bF 8 150A 18 38,-2.9 38,-2.0 -2,-0.7 2,-0.7 -0.789 3.0-152.1 -84.8 116.8 -20.9 -2.1 44.3 113 113 A I E -bF 9 149A 0 -105,-3.1 2,-2.3 -2,-0.7 -103,-0.5 -0.835 11.8-141.0 -89.4 117.5 -22.8 -2.1 47.6 114 114 A E + 0 0 72 34,-2.7 2,-0.3 -2,-0.7 -105,-0.1 -0.331 68.9 81.9 -85.6 59.9 -21.0 0.4 49.8 115 115 A G S S- 0 0 15 -2,-2.3 -105,-2.4 32,-0.1 2,-0.6 -0.925 76.5-116.1-149.1 171.0 -21.3 -1.6 53.0 116 116 A K + 0 0 148 -2,-0.3 2,-0.3 -107,-0.2 -2,-0.1 -0.937 39.2 177.7-119.5 107.1 -19.7 -4.5 54.9 117 117 A F - 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