==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-OCT-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 13-AUG-12 4GKU . COMPND 2 MOLECULE: BETA-LACTAMASE TEM; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR Y.ZHANG,C.CAO . 263 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11031.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 178 67.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 38 14.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.4 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-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 . 2 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 10.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 89 33.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 2.3 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 0 0 0 2 1 1 1 2 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 0 2 0 1 0 0 1 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 . 2 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 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 24 A H >> 0 0 93 0, 0.0 3,-1.6 0, 0.0 4,-0.9 0.000 360.0 360.0 360.0 137.6 30.3 -0.8 24.4 2 25 A P H 3> + 0 0 84 0, 0.0 4,-1.7 0, 0.0 3,-0.3 0.784 360.0 67.0 -55.3 -32.2 30.0 -1.1 28.2 3 26 A E H 3> S+ 0 0 91 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.838 96.4 54.8 -58.5 -34.8 31.6 2.3 28.6 4 27 A T H <> S+ 0 0 1 -3,-1.6 4,-2.5 2,-0.2 -1,-0.2 0.854 104.6 52.7 -70.6 -32.8 28.6 3.9 27.0 5 28 A L H X S+ 0 0 37 -4,-0.9 4,-2.5 -3,-0.3 -1,-0.2 0.840 104.8 56.5 -69.0 -32.8 26.3 2.2 29.6 6 29 A V H X S+ 0 0 89 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.944 109.5 45.5 -59.2 -46.7 28.6 3.8 32.3 7 30 A K H X S+ 0 0 23 -4,-1.8 4,-2.8 2,-0.2 -2,-0.2 0.912 110.1 54.0 -64.8 -42.6 27.8 7.2 30.7 8 31 A V H X S+ 0 0 0 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.921 111.5 45.0 -56.6 -44.5 24.1 6.4 30.5 9 32 A K H X S+ 0 0 107 -4,-2.5 4,-2.0 2,-0.2 -1,-0.2 0.872 110.9 54.5 -67.7 -34.7 24.0 5.5 34.2 10 33 A D H X S+ 0 0 60 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.902 106.6 51.0 -62.8 -41.9 26.0 8.6 34.9 11 34 A A H X S+ 0 0 1 -4,-2.8 4,-2.7 2,-0.2 5,-0.3 0.923 107.4 53.7 -58.1 -43.7 23.4 10.7 33.0 12 35 A E H X>S+ 0 0 27 -4,-2.0 5,-1.6 1,-0.2 4,-1.0 0.898 110.8 47.0 -60.6 -39.7 20.8 9.0 35.2 13 36 A D H <5S+ 0 0 120 -4,-2.0 -1,-0.2 2,-0.2 -2,-0.2 0.915 113.4 46.6 -65.9 -45.8 22.7 10.2 38.3 14 37 A Q H <5S+ 0 0 112 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.859 119.3 39.9 -67.0 -37.9 23.2 13.7 37.1 15 38 A L H <5S- 0 0 11 -4,-2.7 227,-0.6 2,-0.2 228,-0.4 0.650 99.3-134.6 -85.0 -15.4 19.6 14.2 36.1 16 39 A G T <5S+ 0 0 63 -4,-1.0 2,-0.3 -5,-0.3 -3,-0.2 0.929 72.3 95.4 57.8 46.1 18.2 12.3 39.1 17 40 A A S -A 232 0A 45 5,-2.8 4,-2.1 -2,-0.4 207,-0.2 -0.664 22.8-147.2 -75.9 126.4 22.3 -2.5 14.5 26 49 A L T 4 S+ 0 0 20 205,-2.3 206,-0.2 -2,-0.5 -1,-0.2 0.847 91.0 42.5 -67.4 -36.1 20.4 -1.2 11.5 27 50 A N T 4 S+ 0 0 143 204,-0.5 -1,-0.2 1,-0.1 205,-0.1 0.939 126.0 28.0 -76.7 -48.8 21.0 -4.2 9.2 28 51 A S T 4 S- 0 0 68 2,-0.1 -2,-0.2 1,-0.0 -1,-0.1 0.737 91.5-135.4 -89.7 -26.4 20.5 -7.1 11.6 29 52 A G < + 0 0 17 -4,-2.1 2,-0.2 1,-0.3 -3,-0.1 0.527 55.7 142.0 82.5 4.9 18.1 -5.5 14.0 30 53 A K - 0 0 123 -5,-0.1 -5,-2.8 1,-0.1 2,-0.4 -0.558 57.7-110.7 -82.4 144.4 20.0 -6.8 17.0 31 54 A I E -B 24 0A 61 -7,-0.2 -7,-0.2 -2,-0.2 3,-0.1 -0.607 28.8-177.1 -73.2 124.5 20.5 -4.8 20.1 32 55 A L E S- 0 0 66 -9,-3.0 2,-0.3 -2,-0.4 -8,-0.2 0.823 73.3 -4.1 -87.8 -40.3 24.1 -3.8 20.6 33 56 A E E S-B 23 0A 39 -10,-1.4 -10,-2.5 -29,-0.0 -1,-0.4 -0.983 70.1-179.8-150.5 150.5 23.6 -2.1 24.0 34 57 A S E -B 22 0A 40 -2,-0.3 2,-0.3 -12,-0.2 -12,-0.2 -0.997 14.6-173.2-152.3 151.7 20.6 -1.3 26.1 35 58 A F E S-B 21 0A 38 -14,-2.4 -14,-2.7 -2,-0.3 -2,-0.0 -0.952 82.6 -11.4-146.6 129.8 19.5 0.2 29.4 36 59 A R S > S+ 0 0 68 -2,-0.3 3,-1.2 -16,-0.2 123,-0.1 0.903 79.2 170.1 47.4 51.0 15.9 0.0 30.8 37 60 A P T 3 + 0 0 39 0, 0.0 122,-2.7 0, 0.0 123,-0.4 0.725 68.2 38.9 -69.7 -25.4 14.8 -1.4 27.3 38 61 A E T 3 S+ 0 0 146 120,-0.2 2,-0.4 119,-0.1 -2,-0.1 -0.186 89.0 107.5-119.8 39.9 11.3 -2.4 28.3 39 62 A E S < S- 0 0 63 -3,-1.2 2,-0.3 2,-0.0 120,-0.1 -0.892 72.6-109.1-109.7 148.6 10.3 0.5 30.6 40 63 A R + 0 0 89 -2,-0.4 117,-0.2 117,-0.2 110,-0.1 -0.581 37.5 173.0 -84.6 137.9 7.7 3.1 29.5 41 64 A F E -E 156 0B 0 115,-2.3 115,-2.3 -2,-0.3 2,-0.1 -0.987 40.5 -97.9-134.9 144.2 8.7 6.7 28.6 42 65 A P E -E 155 0B 17 0, 0.0 113,-0.3 0, 0.0 196,-0.2 -0.423 26.7-148.3 -58.2 133.3 6.6 9.5 27.1 43 66 A M > + 0 0 1 111,-2.3 3,-1.8 93,-0.2 112,-0.1 0.820 26.7 176.0 -71.1 -35.4 7.3 9.8 23.4 44 67 A M G > S- 0 0 1 110,-0.5 3,-1.8 100,-0.4 4,-0.2 -0.252 70.8 -15.9 51.7-147.3 6.7 13.5 23.1 45 68 A S G > S+ 0 0 10 1,-0.3 3,-1.6 167,-0.3 4,-0.3 0.546 119.7 86.4 -66.6 -4.9 7.4 14.8 19.6 46 69 A T G X> S+ 0 0 0 -3,-1.8 3,-1.2 1,-0.3 4,-0.7 0.790 77.1 70.4 -63.5 -23.4 9.3 11.5 18.6 47 70 A F H <> S+ 0 0 0 -3,-1.8 4,-2.6 1,-0.2 -1,-0.3 0.746 78.3 78.6 -62.0 -23.5 5.8 10.2 17.7 48 71 A K H <> S+ 0 0 0 -3,-1.6 4,-2.1 1,-0.2 -1,-0.2 0.789 88.9 54.9 -61.8 -28.1 5.7 12.5 14.7 49 72 A V H <> S+ 0 0 0 -3,-1.2 4,-1.7 -4,-0.3 -1,-0.2 0.918 109.5 46.5 -66.2 -45.5 8.0 10.2 12.8 50 73 A L H X S+ 0 0 1 -4,-0.7 4,-2.2 -3,-0.2 -2,-0.2 0.891 109.7 56.1 -62.6 -40.7 5.5 7.3 13.4 51 74 A L H X S+ 0 0 0 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.955 109.4 43.4 -54.9 -54.0 2.7 9.6 12.4 52 75 A a H X S+ 0 0 0 -4,-2.1 4,-2.6 1,-0.2 -1,-0.2 0.796 108.2 61.5 -68.0 -24.7 4.2 10.3 9.0 53 76 A G H X S+ 0 0 0 -4,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.931 106.2 45.3 -57.3 -48.8 5.0 6.7 8.7 54 77 A A H X S+ 0 0 5 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.882 112.2 52.1 -62.8 -38.9 1.2 5.9 8.9 55 78 A V H X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.935 109.9 48.2 -64.2 -43.6 0.6 8.7 6.4 56 79 A L H X S+ 0 0 0 -4,-2.6 4,-3.0 2,-0.2 -1,-0.2 0.837 106.1 57.6 -66.8 -32.5 3.1 7.2 4.0 57 80 A S H X S+ 0 0 35 -4,-1.9 4,-1.8 2,-0.2 -1,-0.2 0.904 108.0 47.7 -62.2 -41.5 1.6 3.8 4.4 58 81 A R H <>S+ 0 0 70 -4,-1.9 5,-3.1 2,-0.2 6,-1.0 0.890 110.3 51.7 -65.2 -39.2 -1.7 5.3 3.3 59 82 A V H ><5S+ 0 0 35 -4,-2.1 3,-1.7 4,-0.2 -2,-0.2 0.950 108.4 51.7 -60.5 -46.7 0.1 7.0 0.3 60 83 A D H 3<5S+ 0 0 56 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.878 110.9 48.0 -55.6 -40.0 1.6 3.6 -0.6 61 84 A A T 3<5S- 0 0 59 -4,-1.8 -1,-0.3 -5,-0.1 -2,-0.2 0.432 116.9-113.4 -82.6 -0.5 -1.9 2.0 -0.5 62 85 A G T < 5S+ 0 0 55 -3,-1.7 -3,-0.2 -4,-0.4 -2,-0.1 0.731 88.7 114.3 72.9 23.1 -3.4 4.9 -2.7 63 86 A Q S - 0 0 97 -2,-0.3 3,-1.6 1,-0.1 29,-0.4 -0.998 13.4-143.2-128.6 132.8 -1.7 11.8 -1.7 66 89 A L T 3 S+ 0 0 24 -2,-0.4 29,-2.7 1,-0.3 30,-0.4 0.779 104.0 53.3 -61.5 -26.6 1.3 13.8 -0.7 67 90 A G T 3 S+ 0 0 45 27,-0.2 -1,-0.3 26,-0.2 2,-0.1 0.536 78.2 120.6 -86.3 -6.2 0.1 16.6 -3.0 68 91 A R < - 0 0 93 -3,-1.6 26,-1.6 25,-0.1 2,-0.4 -0.370 59.2-135.1 -64.0 131.7 -3.4 16.8 -1.4 69 92 A R E -F 93 0C 125 24,-0.2 2,-0.5 -2,-0.1 24,-0.3 -0.717 15.8-163.8 -96.3 137.9 -4.1 20.3 -0.0 70 93 A I E -F 92 0C 25 22,-2.8 22,-2.4 -2,-0.4 2,-0.4 -0.975 2.6-162.8-118.6 118.7 -5.7 21.0 3.4 71 94 A H - 0 0 119 -2,-0.5 2,-0.3 20,-0.2 17,-0.1 -0.856 22.7-174.4 -91.9 139.4 -7.0 24.4 4.2 72 95 A Y - 0 0 20 -2,-0.4 2,-0.3 16,-0.3 19,-0.1 -0.809 21.0-103.1-135.7 173.3 -7.5 24.7 8.0 73 96 A S > - 0 0 55 -2,-0.3 3,-2.4 1,-0.1 4,-0.4 -0.680 21.8-125.0-103.2 147.8 -8.9 27.1 10.6 74 97 A Q G > S+ 0 0 126 1,-0.3 3,-1.1 -2,-0.3 -1,-0.1 0.754 112.6 70.0 -57.1 -20.1 -7.1 29.5 12.9 75 98 A N G 3 S+ 0 0 130 1,-0.2 -1,-0.3 3,-0.0 -3,-0.0 0.705 90.1 59.1 -71.0 -18.5 -9.1 27.5 15.5 76 99 A D G < S+ 0 0 71 -3,-2.4 -1,-0.2 2,-0.0 2,-0.2 0.613 81.5 112.5 -81.6 -13.8 -6.9 24.5 14.9 77 100 A L < + 0 0 44 -3,-1.1 2,-0.2 -4,-0.4 3,-0.1 -0.437 42.7 177.3 -73.5 128.9 -3.7 26.4 15.8 78 101 A V - 0 0 39 -2,-0.2 30,-0.3 1,-0.1 29,-0.2 -0.744 42.6 -57.2-121.5 171.6 -1.9 25.2 19.0 79 102 A E S S+ 0 0 155 -2,-0.2 28,-0.2 1,-0.1 -1,-0.1 -0.120 115.1 19.5 -53.9 144.0 1.3 26.3 20.8 80 103 A Y S S+ 0 0 93 1,-0.1 27,-2.4 27,-0.1 28,-0.3 0.995 70.3 145.8 53.8 85.0 4.5 26.2 18.7 81 104 A S > + 0 0 1 25,-0.2 4,-2.0 26,-0.2 5,-0.2 -0.519 9.9 163.8-142.6 63.4 3.3 26.1 15.1 82 105 A P T 4 S+ 0 0 35 0, 0.0 -1,-0.1 0, 0.0 4,-0.0 0.735 78.4 31.2 -64.6 -26.2 6.0 28.0 13.3 83 106 A V T >4 S+ 0 0 37 2,-0.1 3,-1.7 -3,-0.1 4,-0.2 0.863 117.7 50.4 -95.3 -47.6 5.0 26.8 9.8 84 107 A T G >4 S+ 0 0 0 1,-0.3 3,-1.4 2,-0.2 7,-0.1 0.812 101.2 64.4 -66.0 -30.0 1.3 26.2 10.0 85 108 A E G 3< S+ 0 0 102 -4,-2.0 3,-0.4 1,-0.2 -1,-0.3 0.700 101.4 53.6 -60.1 -19.9 0.7 29.7 11.5 86 109 A K G < S+ 0 0 167 -3,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.398 103.6 53.5-100.3 1.3 2.0 31.1 8.2 87 110 A H <> + 0 0 54 -3,-1.4 4,-2.0 -4,-0.2 -15,-0.2 0.010 59.1 119.3-130.9 30.8 -0.3 29.3 5.8 88 111 A L T 4 S+ 0 0 59 -3,-0.4 -16,-0.3 2,-0.2 -1,-0.1 0.912 85.7 42.4 -57.6 -42.3 -3.9 30.0 7.0 89 112 A T T 4 S+ 0 0 129 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.1 0.936 125.2 29.4 -73.7 -48.7 -4.7 31.6 3.6 90 113 A D T 4 S- 0 0 76 -4,-0.2 -2,-0.2 1,-0.2 -1,-0.2 0.613 97.6-143.6 -90.8 -13.5 -3.0 29.2 1.1 91 114 A G < - 0 0 0 -4,-2.0 2,-0.3 -7,-0.1 -20,-0.2 -0.099 15.8 -97.4 73.5-179.9 -3.3 26.0 3.1 92 115 A M E -F 70 0C 3 -22,-2.4 -22,-2.8 -4,-0.1 2,-0.1 -0.994 22.4-123.3-139.5 146.3 -0.7 23.2 3.2 93 116 A T E > -F 69 0C 14 -2,-0.3 4,-2.3 -24,-0.3 -24,-0.2 -0.383 33.5-107.9 -81.1 163.0 -0.2 19.9 1.3 94 117 A V H > S+ 0 0 0 -26,-1.6 4,-2.1 -29,-0.4 5,-0.2 0.899 123.2 51.8 -55.8 -42.1 0.1 16.6 3.1 95 118 A R H > S+ 0 0 112 -29,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.912 109.0 49.1 -58.7 -47.1 3.8 16.6 2.1 96 119 A E H > S+ 0 0 83 -30,-0.4 4,-2.2 1,-0.2 -1,-0.2 0.850 109.9 53.0 -62.9 -34.2 4.3 20.1 3.5 97 120 A L H X S+ 0 0 0 -4,-2.3 4,-2.7 2,-0.2 -2,-0.2 0.909 109.1 46.8 -70.2 -43.1 2.6 19.1 6.8 98 121 A a H X S+ 0 0 0 -4,-2.1 4,-2.6 2,-0.2 5,-0.4 0.902 111.6 52.9 -65.0 -40.0 4.9 16.1 7.3 99 122 A S H X>S+ 0 0 42 -4,-2.3 4,-2.5 -5,-0.2 5,-0.7 0.942 112.5 44.8 -55.3 -46.8 7.8 18.3 6.6 100 123 A A H X5S+ 0 0 3 -4,-2.2 6,-2.3 1,-0.2 4,-1.1 0.909 113.9 49.0 -67.1 -41.5 6.6 20.7 9.2 101 124 A A H <5S+ 0 0 0 -4,-2.7 4,-0.3 4,-0.3 -1,-0.2 0.914 123.3 30.2 -64.4 -45.6 5.9 18.1 11.8 102 125 A I H <5S+ 0 0 0 -4,-2.6 -2,-0.2 -5,-0.2 -3,-0.2 0.925 126.1 37.8 -82.4 -50.0 9.2 16.3 11.4 103 126 A T H <5S+ 0 0 9 -4,-2.5 87,-2.9 -5,-0.4 88,-0.5 0.843 136.4 19.1 -75.4 -31.7 11.7 19.0 10.5 104 127 A M S < - 0 0 0 -6,-2.3 4,-1.3 1,-0.1 -25,-0.2 -0.288 14.2-156.7 -52.8 120.6 5.2 21.9 14.2 107 130 A N H > S+ 0 0 16 -27,-2.4 4,-2.0 -28,-0.2 34,-0.3 0.893 89.2 48.3 -73.0 -43.9 2.3 20.9 16.6 108 131 A T H > S+ 0 0 0 -30,-0.3 4,-2.8 -28,-0.3 5,-0.2 0.920 108.1 57.1 -62.3 -42.3 -0.6 22.0 14.5 109 132 A A H > S+ 0 0 0 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.912 107.2 49.1 -52.4 -43.7 0.8 20.2 11.6 110 133 A A H X S+ 0 0 0 -4,-1.3 4,-2.7 2,-0.2 -1,-0.2 0.929 110.5 49.1 -64.6 -45.8 0.8 17.0 13.7 111 134 A N H X S+ 0 0 21 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.908 110.2 51.1 -59.8 -42.7 -2.8 17.4 14.8 112 135 A L H X S+ 0 0 16 -4,-2.8 4,-1.6 2,-0.2 -1,-0.2 0.911 112.0 47.8 -60.3 -41.6 -3.9 18.0 11.2 113 136 A L H X S+ 0 0 0 -4,-2.1 4,-1.2 -5,-0.2 -2,-0.2 0.897 108.3 53.6 -67.3 -41.2 -2.1 14.8 10.1 114 137 A L H >X>S+ 0 0 0 -4,-2.7 5,-3.2 1,-0.2 4,-1.3 0.910 106.6 54.7 -56.7 -40.9 -3.6 12.9 13.0 115 138 A T H 3<5S+ 0 0 91 -4,-2.3 3,-0.5 1,-0.2 -1,-0.2 0.908 101.9 56.6 -60.7 -40.5 -7.0 14.1 11.7 116 139 A T H 3<5S+ 0 0 25 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.799 113.5 40.1 -63.4 -28.7 -6.3 12.7 8.2 117 140 A I H <<5S- 0 0 20 -4,-1.2 -1,-0.2 -3,-0.6 -2,-0.2 0.583 125.4 -93.7 -98.5 -9.7 -5.7 9.2 9.6 118 141 A G T <5 - 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