==== 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 3FQF . 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) . 9060.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 110 70.1 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 . 15 9.6 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 0 100 0, 0.0 88,-2.9 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 134.9 -21.9 -11.1 24.3 2 2 A L E +a 89 0A 18 86,-0.2 104,-2.4 102,-0.1 105,-1.1 -0.956 360.0 169.0-117.1 116.8 -20.9 -12.7 27.6 3 3 A S E -ab 90 107A 0 86,-3.0 88,-3.3 -2,-0.5 2,-0.4 -0.870 32.3-128.6-126.0 153.2 -21.2 -10.6 30.7 4 4 A I E -ab 91 108A 0 103,-2.1 105,-3.4 -2,-0.3 2,-0.4 -0.835 19.8-166.8 -91.9 141.9 -21.1 -11.0 34.5 5 5 A L E + b 0 109A 4 86,-2.6 2,-0.3 -2,-0.4 105,-0.2 -0.963 27.3 142.2-129.1 114.5 -24.0 -9.5 36.4 6 6 A V E - b 0 110A 11 103,-2.4 105,-2.5 -2,-0.4 2,-0.4 -0.991 41.6-146.9-151.7 153.2 -23.4 -9.2 40.2 7 7 A A E + b 0 111A 14 -2,-0.3 2,-0.3 103,-0.2 105,-0.2 -0.998 30.9 167.8-119.6 127.4 -23.9 -7.2 43.3 8 8 A H E - b 0 112A 8 103,-2.3 105,-3.2 -2,-0.4 6,-0.2 -0.967 26.6-126.5-137.5 155.5 -21.1 -7.3 45.9 9 9 A D E > - b 0 113A 0 4,-1.8 3,-2.0 -2,-0.3 105,-0.2 -0.146 48.9 -76.6 -89.5-169.8 -20.2 -5.4 49.1 10 10 A L T 3 S+ 0 0 97 105,-2.3 106,-0.1 103,-0.6 104,-0.1 0.681 135.4 40.7 -62.9 -19.0 -16.9 -3.7 50.0 11 11 A Q T 3 S- 0 0 66 104,-0.3 -1,-0.3 2,-0.1 105,-0.1 0.124 123.5-102.4-114.7 15.3 -15.3 -7.1 50.8 12 12 A R < + 0 0 77 -3,-2.0 111,-2.9 1,-0.2 2,-0.2 0.592 64.1 161.0 70.7 18.1 -16.9 -8.8 47.8 13 13 A V E +H 122 0B 1 109,-0.2 -4,-1.8 1,-0.1 109,-0.3 -0.483 11.3 169.6 -63.0 134.2 -19.7 -10.6 49.8 14 14 A I E + 0 0 19 107,-3.1 2,-0.3 1,-0.3 108,-0.2 0.507 58.7 9.4-119.0 -16.0 -22.5 -11.7 47.5 15 15 A G E -H 121 0B 9 106,-1.4 105,-2.5 5,-0.2 106,-1.4 -0.995 45.2-161.3-160.1 159.8 -24.6 -13.9 49.9 16 16 A F B > S-I 19 0C 64 3,-2.3 3,-1.3 -2,-0.3 103,-0.1 -0.890 80.8 -18.5-148.6 121.9 -25.3 -15.2 53.3 17 17 A E T 3 S- 0 0 133 -2,-0.3 3,-0.1 1,-0.3 102,-0.0 0.900 126.3 -50.2 49.6 53.0 -27.3 -18.4 54.1 18 18 A N T 3 S+ 0 0 122 1,-0.2 2,-0.3 0, 0.0 -1,-0.3 0.600 120.7 100.1 66.5 15.2 -29.0 -18.5 50.7 19 19 A Q B < S-I 16 0C 133 -3,-1.3 -3,-2.3 31,-0.0 -1,-0.2 -0.907 82.1-107.0-126.3 154.2 -30.0 -14.9 50.9 20 20 A L - 0 0 100 -2,-0.3 -5,-0.2 -5,-0.2 -6,-0.0 -0.709 33.6-138.6 -69.9 129.5 -28.9 -11.5 49.5 21 21 A P S S+ 0 0 32 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 0.704 79.8 45.0 -67.1 -19.2 -27.5 -9.9 52.7 22 22 A W S S- 0 0 10 95,-0.1 2,-0.6 2,-0.0 -2,-0.1 -0.752 75.4-127.2-123.2 166.0 -29.1 -6.5 51.8 23 23 A H + 0 0 160 -2,-0.2 123,-0.5 4,-0.0 124,-0.2 -0.943 38.8 155.7-117.8 106.2 -32.4 -5.1 50.6 24 24 A L >> + 0 0 8 -2,-0.6 4,-1.5 1,-0.1 3,-1.3 -0.710 19.4 179.8-139.0 82.4 -32.0 -2.9 47.5 25 25 A P H 3> S+ 0 0 54 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.821 84.3 63.1 -49.0 -37.6 -35.0 -2.5 45.2 26 26 A N H 3> S+ 0 0 39 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.846 103.6 48.1 -55.9 -39.0 -33.0 -0.2 42.9 27 27 A D H <> S+ 0 0 12 -3,-1.3 4,-2.5 2,-0.2 -1,-0.2 0.869 107.5 53.9 -72.7 -38.1 -30.6 -3.0 42.1 28 28 A L H X S+ 0 0 102 -4,-1.5 4,-2.2 2,-0.2 -2,-0.2 0.888 109.5 49.5 -61.5 -38.2 -33.5 -5.5 41.4 29 29 A K H X S+ 0 0 123 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.898 108.5 53.4 -63.7 -43.9 -34.7 -2.9 38.9 30 30 A H H X S+ 0 0 31 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.917 109.5 47.8 -54.0 -49.1 -31.2 -2.7 37.4 31 31 A V H X S+ 0 0 16 -4,-2.5 4,-2.5 1,-0.2 5,-0.3 0.921 111.8 50.2 -59.6 -46.1 -31.2 -6.5 37.0 32 32 A K H X S+ 0 0 127 -4,-2.2 4,-1.7 1,-0.2 -2,-0.2 0.904 112.1 47.5 -59.1 -44.1 -34.7 -6.4 35.4 33 33 A K H < S+ 0 0 151 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.896 117.2 41.4 -66.1 -42.1 -33.6 -3.7 32.9 34 34 A L H < S+ 0 0 34 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.888 123.4 33.5 -74.1 -39.3 -30.4 -5.4 31.9 35 35 A S H >< S+ 0 0 0 -4,-2.5 3,-2.2 -5,-0.2 -2,-0.2 0.600 81.2 113.6-104.7 -14.5 -31.5 -9.0 31.6 36 36 A T T 3< S+ 0 0 52 -4,-1.7 21,-0.2 -5,-0.3 20,-0.1 -0.380 90.3 16.1 -59.9 131.2 -35.1 -8.8 30.4 37 37 A G T 3 S+ 0 0 59 19,-3.0 -1,-0.3 1,-0.3 20,-0.2 0.557 121.1 76.2 79.7 8.4 -35.3 -10.3 26.9 38 38 A H S < S- 0 0 76 -3,-2.2 20,-2.7 18,-0.2 2,-0.4 -0.288 86.0 -77.9-126.3-150.4 -31.9 -11.9 27.3 39 39 A T E -cd 58 89A 11 49,-1.9 51,-3.1 18,-0.2 2,-0.4 -0.983 25.3-163.6-128.4 132.2 -30.3 -14.9 29.0 40 40 A L E -cd 59 90A 0 18,-2.6 20,-2.9 -2,-0.4 2,-0.5 -0.935 8.0-164.5-105.7 134.8 -29.3 -15.6 32.7 41 41 A V E +cd 60 91A 0 49,-2.7 51,-3.2 -2,-0.4 52,-0.5 -0.984 17.1 168.7-117.8 127.4 -27.0 -18.4 33.5 42 42 A M E -cd 61 93A 0 18,-2.7 20,-2.7 -2,-0.5 52,-0.2 -0.973 34.6-109.7-138.1 154.6 -26.7 -19.6 37.1 43 43 A G E > -c 62 0A 7 50,-2.5 4,-2.3 -2,-0.3 5,-0.2 -0.359 42.2-103.8 -73.0 162.6 -25.3 -22.4 39.1 44 44 A R H > S+ 0 0 116 18,-1.3 4,-2.4 1,-0.2 5,-0.2 0.866 120.0 51.4 -56.3 -43.0 -27.7 -24.9 40.7 45 45 A K H > S+ 0 0 151 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.893 109.1 50.8 -66.6 -39.9 -27.4 -23.4 44.2 46 46 A T H > S+ 0 0 30 2,-0.2 4,-0.8 1,-0.2 3,-0.4 0.923 110.7 49.4 -61.3 -44.9 -28.1 -19.9 43.0 47 47 A F H >X S+ 0 0 1 -4,-2.3 4,-3.0 1,-0.2 3,-1.1 0.919 108.3 52.5 -62.4 -43.2 -31.2 -21.1 41.2 48 48 A E H 3< S+ 0 0 98 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.751 99.2 64.3 -67.2 -20.9 -32.5 -22.9 44.3 49 49 A S H 3< S+ 0 0 54 -4,-1.2 -1,-0.3 -3,-0.4 -2,-0.2 0.779 114.3 33.0 -71.2 -25.2 -32.1 -19.7 46.3 50 50 A I H << S- 0 0 75 -3,-1.1 -2,-0.2 -4,-0.8 -1,-0.2 0.762 91.6-157.1 -96.3 -33.7 -34.7 -18.1 44.1 51 51 A G < + 0 0 38 -4,-3.0 -3,-0.1 -5,-0.2 -4,-0.1 0.172 66.2 52.0 83.7 -19.5 -36.8 -21.3 43.5 52 52 A K S S- 0 0 161 -5,-0.2 20,-0.1 18,-0.0 18,-0.0 -0.990 89.8 -97.6-147.1 150.1 -38.4 -20.1 40.3 53 53 A P - 0 0 34 0, 0.0 20,-0.1 0, 0.0 5,-0.0 -0.298 40.8-109.4 -66.7 153.2 -37.2 -18.7 37.0 54 54 A L > - 0 0 52 1,-0.1 3,-0.6 18,-0.1 -14,-0.1 -0.688 42.1-110.1 -81.9 135.2 -37.3 -14.9 36.4 55 55 A P T 3 S+ 0 0 84 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.190 88.2 23.4 -67.9 156.3 -40.0 -13.9 33.9 56 56 A N T 3 S+ 0 0 128 1,-0.1 -19,-3.0 -20,-0.1 2,-0.3 0.721 109.1 67.0 66.7 28.4 -39.4 -12.5 30.3 57 57 A R S < S- 0 0 36 -3,-0.6 2,-0.3 -21,-0.2 -18,-0.2 -0.960 91.0 -85.0-161.7 164.8 -35.9 -14.0 29.7 58 58 A R E -c 39 0A 88 -20,-2.7 -18,-2.6 -2,-0.3 2,-0.6 -0.636 36.8-154.2 -76.7 132.2 -34.2 -17.3 29.2 59 59 A N E -ce 40 73A 4 13,-0.5 15,-3.0 -2,-0.3 2,-0.5 -0.950 13.5-174.9-110.5 113.1 -33.3 -19.0 32.5 60 60 A V E -ce 41 74A 1 -20,-2.9 -18,-2.7 -2,-0.6 2,-0.5 -0.928 5.0-164.1-112.9 125.7 -30.3 -21.4 32.2 61 61 A V E -ce 42 75A 0 13,-2.5 15,-2.6 -2,-0.5 2,-0.6 -0.939 9.1-148.6-114.9 128.1 -29.2 -23.6 35.1 62 62 A L E +ce 43 76A 24 -20,-2.7 -18,-1.3 -2,-0.5 2,-0.3 -0.840 36.8 142.0 -92.8 121.5 -25.8 -25.3 35.3 63 63 A T - 0 0 14 13,-2.1 -2,-0.0 -2,-0.6 -20,-0.0 -0.984 54.6-137.1-154.6 153.5 -25.9 -28.6 37.2 64 64 A S S S+ 0 0 113 -2,-0.3 2,-0.6 2,-0.0 13,-0.1 0.513 74.2 114.3 -85.1 -7.2 -24.4 -32.2 37.1 65 65 A D > - 0 0 74 1,-0.2 3,-0.6 2,-0.1 -2,-0.1 -0.533 49.9-167.7 -73.2 110.9 -27.9 -33.5 38.1 66 66 A T T 3 S+ 0 0 127 -2,-0.6 -1,-0.2 1,-0.2 11,-0.0 0.618 88.4 50.8 -73.7 -14.4 -29.3 -35.5 35.1 67 67 A S T 3 S+ 0 0 99 2,-0.0 -1,-0.2 0, 0.0 -2,-0.1 0.597 77.9 126.1 -95.2 -16.0 -32.8 -35.5 36.7 68 68 A F < + 0 0 25 -3,-0.6 2,-0.3 1,-0.0 7,-0.1 -0.204 30.4 159.4 -52.4 122.0 -32.9 -31.8 37.3 69 69 A N + 0 0 143 5,-0.1 2,-0.4 2,-0.0 5,-0.1 -0.914 10.9 166.7-152.9 120.5 -36.1 -30.4 35.6 70 70 A V > - 0 0 37 3,-0.4 3,-2.0 -2,-0.3 2,-0.1 -0.999 41.0-109.1-135.7 130.5 -38.0 -27.2 36.3 71 71 A E T 3 S+ 0 0 177 -2,-0.4 3,-0.1 1,-0.3 -2,-0.0 -0.367 106.9 18.2 -53.6 129.2 -40.7 -25.6 34.2 72 72 A G T 3 S+ 0 0 48 1,-0.2 -13,-0.5 -20,-0.1 2,-0.4 0.463 105.9 104.7 86.2 4.0 -39.3 -22.5 32.5 73 73 A V E < -e 59 0A 14 -3,-2.0 2,-0.4 -15,-0.1 -3,-0.4 -0.959 57.3-150.5-121.9 133.1 -35.7 -23.5 33.0 74 74 A D E -e 60 0A 69 -15,-3.0 -13,-2.5 -2,-0.4 2,-0.4 -0.885 21.1-141.2 -99.1 133.7 -33.2 -24.8 30.5 75 75 A V E -e 61 0A 45 -2,-0.4 2,-0.3 -15,-0.2 -13,-0.2 -0.746 18.5-177.6-101.2 138.9 -30.5 -27.1 31.9 76 76 A I E -e 62 0A 17 -15,-2.6 -13,-2.1 -2,-0.4 3,-0.1 -0.950 13.9-162.2-126.8 155.7 -26.9 -27.3 30.9 77 77 A H + 0 0 101 -2,-0.3 2,-0.3 -15,-0.2 -15,-0.1 0.390 69.5 37.3-120.1 -0.6 -24.3 -29.7 32.2 78 78 A S S > S- 0 0 44 1,-0.1 3,-0.9 -14,-0.0 4,-0.4 -0.992 72.3-121.5-147.9 155.0 -20.9 -28.1 31.3 79 79 A I G >> S+ 0 0 31 -2,-0.3 3,-1.9 1,-0.2 4,-0.6 0.866 111.2 66.0 -57.4 -37.7 -19.3 -24.7 31.1 80 80 A E G >4 S+ 0 0 127 1,-0.3 3,-0.7 2,-0.2 4,-0.3 0.804 90.3 65.8 -58.1 -28.6 -18.6 -25.3 27.5 81 81 A D G X4 S+ 0 0 60 -3,-0.9 3,-1.3 1,-0.2 -1,-0.3 0.778 88.2 68.2 -62.5 -28.8 -22.4 -25.3 26.9 82 82 A I G X4 S+ 0 0 3 -3,-1.9 3,-1.6 -4,-0.4 -1,-0.2 0.873 91.4 59.9 -59.6 -39.2 -22.5 -21.6 27.9 83 83 A Y G << S+ 0 0 101 -3,-0.7 -1,-0.3 -4,-0.6 -2,-0.2 0.582 99.8 57.1 -69.3 -11.1 -20.6 -20.6 24.7 84 84 A Q G < S+ 0 0 147 -3,-1.3 -1,-0.3 -4,-0.3 -2,-0.2 0.422 79.6 107.9 -97.8 -2.9 -23.4 -22.1 22.5 85 85 A L < - 0 0 23 -3,-1.6 2,-0.1 -4,-0.3 4,-0.1 -0.638 69.2-129.7 -76.2 127.1 -26.1 -19.9 24.0 86 86 A P + 0 0 90 0, 0.0 2,-0.1 0, 0.0 -2,-0.1 -0.430 60.8 7.6 -76.2 155.1 -27.3 -17.2 21.6 87 87 A G S S- 0 0 56 -2,-0.1 2,-0.6 2,-0.1 -49,-0.1 -0.341 112.7 -13.4 83.3-159.5 -27.6 -13.5 22.3 88 88 A H - 0 0 37 -51,-0.2 -49,-1.9 -2,-0.1 2,-0.5 -0.735 66.8-166.7 -84.3 119.2 -26.5 -11.5 25.3 89 89 A V E -ad 2 39A 4 -88,-2.9 -86,-3.0 -2,-0.6 2,-0.5 -0.933 4.8-160.0-114.1 127.3 -25.7 -14.0 28.2 90 90 A F E -ad 3 40A 2 -51,-3.1 -49,-2.7 -2,-0.5 2,-0.5 -0.948 15.9-138.1-110.3 121.8 -25.3 -12.8 31.8 91 91 A I E -ad 4 41A 0 -88,-3.3 -86,-2.6 -2,-0.5 -49,-0.2 -0.701 26.7-177.8 -74.6 120.3 -23.5 -15.0 34.3 92 92 A F E + 0 0 41 -51,-3.2 2,-0.2 -2,-0.5 -50,-0.2 0.449 34.0 88.8-113.5 -5.7 -25.8 -14.5 37.3 93 93 A G E - d 0 42A 3 -52,-0.5 -50,-2.5 1,-0.2 -1,-0.4 -0.635 58.0 -40.9 137.0 165.9 -24.2 -16.5 40.2 94 94 A G > - 0 0 9 -52,-0.2 4,-2.7 -2,-0.2 5,-0.2 0.376 54.7 -97.9-110.8-140.9 -22.9 -17.9 42.4 95 95 A Q H > S+ 0 0 61 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.919 120.0 47.9 -54.0 -48.6 -19.4 -17.9 43.8 96 96 A T H > S+ 0 0 89 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.937 113.8 45.7 -61.6 -48.1 -18.4 -21.1 42.0 97 97 A L H > S+ 0 0 1 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.915 113.0 50.5 -63.0 -42.5 -19.7 -20.0 38.6 98 98 A Y H X S+ 0 0 6 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.906 109.1 52.0 -60.8 -42.4 -18.1 -16.6 38.9 99 99 A E H < S+ 0 0 104 -4,-2.5 4,-0.3 -5,-0.2 -1,-0.2 0.880 113.4 45.1 -60.7 -37.1 -14.8 -18.2 39.8 100 100 A E H < S+ 0 0 97 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.756 123.4 34.3 -76.0 -25.3 -15.1 -20.4 36.7 101 101 A M H >X S+ 0 0 0 -4,-1.7 3,-2.2 -3,-0.1 4,-1.5 0.636 86.8 90.0-109.2 -18.8 -16.2 -17.5 34.4 102 102 A I T 3< S+ 0 0 15 -4,-2.5 3,-0.1 1,-0.3 -3,-0.1 0.846 93.1 47.2 -56.5 -37.7 -14.4 -14.3 35.5 103 103 A D T 34 S+ 0 0 130 -4,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.535 115.1 49.1 -76.9 -6.3 -11.4 -14.9 33.2 104 104 A K T <4 S+ 0 0 123 -3,-2.2 -2,-0.2 0, 0.0 -1,-0.2 0.709 85.8 98.6-104.7 -26.8 -13.7 -15.7 30.3 105 105 A V < - 0 0 0 -4,-1.5 -102,-0.2 -3,-0.1 3,-0.1 -0.270 62.9-140.2 -77.0 152.3 -16.3 -12.8 30.1 106 106 A D S S- 0 0 83 -104,-2.4 50,-2.0 1,-0.2 2,-0.3 0.896 80.6 -13.2 -69.4 -42.6 -16.2 -9.8 27.9 107 107 A D E -bF 3 155A 13 -105,-1.1 -103,-2.1 48,-0.2 2,-0.4 -0.921 60.7-127.3-157.4 171.1 -17.5 -7.4 30.6 108 108 A M E -bF 4 154A 0 46,-2.6 46,-2.8 -2,-0.3 2,-0.7 -0.998 0.8-156.3-136.4 133.1 -19.0 -7.1 34.0 109 109 A Y E -bF 5 153A 46 -105,-3.4 -103,-2.4 -2,-0.4 2,-0.5 -0.936 30.3-179.9-105.9 106.1 -22.0 -5.2 35.4 110 110 A I E -bF 6 152A 0 42,-2.2 42,-3.7 -2,-0.7 2,-0.7 -0.924 25.3-157.3-116.0 128.9 -21.2 -4.8 39.0 111 111 A T E -bF 7 151A 0 -105,-2.5 -103,-2.3 -2,-0.5 2,-0.7 -0.931 18.4-152.5 -97.6 110.1 -23.3 -3.1 41.7 112 112 A V E -bF 8 150A 19 38,-2.9 38,-2.0 -2,-0.7 2,-0.6 -0.786 3.0-153.4 -85.2 117.3 -20.9 -2.1 44.5 113 113 A I E -bF 9 149A 0 -105,-3.2 2,-2.4 -2,-0.7 -103,-0.6 -0.839 11.8-140.9 -91.9 117.0 -22.7 -2.0 47.8 114 114 A E + 0 0 74 34,-2.7 2,-0.3 -2,-0.6 -105,-0.1 -0.314 69.2 80.1 -85.0 58.5 -20.8 0.4 50.0 115 115 A G S S- 0 0 16 -2,-2.4 -105,-2.3 32,-0.1 2,-0.5 -0.920 76.5-115.7-147.6 174.6 -21.1 -1.5 53.2 116 116 A K + 0 0 162 -2,-0.3 2,-0.2 -107,-0.2 -2,-0.1 -0.924 38.9 177.5-121.4 104.5 -19.6 -4.5 55.1 117 117 A F - 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