==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 14-FEB-03 1NYY . COMPND 2 MOLECULE: BETA-LACTAMASE TEM; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR X.WANG,G.MINASOV,J.BLAZQUEZ,E.CASELLI,F.PRATI,B.K.SHOICHET . 263 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11177.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 182 69.2 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 . 4 1.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 11.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 90 34.2 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 26 A H >> 0 0 88 0, 0.0 3,-1.3 0, 0.0 4,-0.9 0.000 360.0 360.0 360.0 141.2 2.9 1.5 8.6 2 27 A P H 3> + 0 0 84 0, 0.0 4,-1.5 0, 0.0 3,-0.1 0.772 360.0 67.4 -58.6 -29.3 6.5 1.7 7.1 3 28 A E H 3> S+ 0 0 103 1,-0.2 4,-1.4 2,-0.2 5,-0.1 0.842 96.5 55.5 -62.5 -30.7 6.4 5.5 7.1 4 29 A T H <> S+ 0 0 1 -3,-1.3 4,-2.2 1,-0.2 -1,-0.2 0.888 103.2 53.7 -69.9 -34.8 6.4 5.4 10.9 5 30 A L H X S+ 0 0 45 -4,-0.9 4,-2.7 1,-0.2 5,-0.3 0.851 100.9 61.3 -67.0 -31.2 9.6 3.3 10.9 6 31 A V H X S+ 0 0 90 -4,-1.5 4,-2.2 1,-0.2 -1,-0.2 0.953 108.9 42.8 -55.8 -46.0 11.1 6.0 8.7 7 32 A K H X S+ 0 0 28 -4,-1.4 4,-2.6 2,-0.2 -2,-0.2 0.867 111.4 53.6 -69.0 -36.8 10.5 8.4 11.7 8 33 A V H X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.926 112.7 43.2 -64.3 -44.4 11.7 5.9 14.3 9 34 A K H X S+ 0 0 103 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.896 111.4 54.6 -69.3 -36.0 15.0 5.4 12.4 10 35 A D H X S+ 0 0 54 -4,-2.2 4,-2.7 -5,-0.3 5,-0.2 0.929 106.4 54.4 -60.1 -41.1 15.2 9.1 11.9 11 36 A A H X S+ 0 0 0 -4,-2.6 4,-2.7 1,-0.2 5,-0.3 0.932 105.4 50.1 -58.5 -47.4 14.8 9.3 15.7 12 37 A E H X>S+ 0 0 27 -4,-2.1 4,-1.6 1,-0.2 5,-1.1 0.918 112.1 50.6 -57.3 -40.3 17.8 7.0 16.3 13 38 A D H <5S+ 0 0 91 -4,-2.3 -2,-0.2 2,-0.2 -1,-0.2 0.940 113.0 42.6 -63.1 -50.4 19.8 9.2 13.9 14 39 A Q H <5S+ 0 0 91 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.893 120.7 41.7 -65.9 -37.6 19.0 12.4 15.6 15 40 A L H <5S- 0 0 13 -4,-2.7 227,-0.5 -5,-0.2 228,-0.4 0.636 95.7-138.3 -85.2 -12.6 19.4 11.1 19.1 16 41 A G T <5S+ 0 0 62 -4,-1.6 2,-0.3 -5,-0.3 -3,-0.2 0.898 71.6 94.3 56.7 39.0 22.5 9.1 18.3 17 42 A A S -A 232 0A 42 5,-3.0 4,-2.1 -2,-0.4 207,-0.3 -0.614 22.5-149.6 -73.6 123.6 -3.4 -4.4 18.1 26 51 A L T 4 S+ 0 0 19 205,-1.9 -1,-0.2 -2,-0.5 206,-0.2 0.875 89.4 41.6 -62.9 -41.6 -5.2 -4.5 21.4 27 52 A N T 4 S+ 0 0 144 204,-0.5 -1,-0.2 1,-0.1 205,-0.1 0.942 128.2 25.0 -72.5 -52.2 -7.9 -6.9 20.5 28 53 A S T 4 S- 0 0 69 2,-0.1 -2,-0.2 1,-0.0 -1,-0.1 0.680 93.1-129.6 -89.6 -21.0 -6.0 -9.5 18.5 29 54 A G < + 0 0 25 -4,-2.1 2,-0.3 1,-0.3 -3,-0.1 0.598 52.5 155.6 80.3 10.1 -2.6 -9.0 20.0 30 55 A K - 0 0 134 -5,-0.1 -5,-3.0 -6,-0.1 2,-0.6 -0.545 47.1-124.6 -76.3 135.0 -1.1 -8.7 16.5 31 56 A I E -B 24 0A 82 -2,-0.3 -7,-0.2 -7,-0.2 3,-0.1 -0.672 28.1-177.7 -77.8 117.3 2.2 -6.8 16.1 32 57 A L E - 0 0 51 -9,-3.0 2,-0.3 -2,-0.6 -1,-0.2 0.797 65.6 -9.0 -86.6 -30.7 1.5 -4.1 13.5 33 58 A E E +B 23 0A 41 -10,-1.2 -10,-2.5 -29,-0.0 -1,-0.3 -0.961 66.8 179.8-164.8 147.0 5.0 -2.6 13.4 34 59 A S E -B 22 0A 42 -2,-0.3 2,-0.3 -12,-0.2 -12,-0.2 -0.991 18.2-167.1-154.0 162.3 8.2 -2.9 15.3 35 60 A F E S-B 21 0A 38 -14,-2.5 -14,-2.8 -2,-0.3 -2,-0.0 -0.919 88.4 -15.7-151.7 117.2 11.8 -1.7 15.7 36 61 A R S > S+ 0 0 83 -2,-0.3 3,-1.7 -16,-0.2 123,-0.1 0.881 81.7 169.0 50.3 42.2 14.3 -3.6 18.0 37 62 A P T 3 S+ 0 0 33 0, 0.0 122,-3.0 0, 0.0 123,-0.4 0.792 70.4 39.6 -54.9 -32.8 11.2 -5.3 19.5 38 63 A E T 3 S+ 0 0 169 120,-0.2 2,-0.4 119,-0.2 -2,-0.1 0.125 89.8 107.0-107.9 21.7 13.2 -7.9 21.4 39 64 A E S < S- 0 0 66 -3,-1.7 2,-0.1 1,-0.0 117,-0.1 -0.820 72.8-111.0 -98.1 140.7 16.1 -5.8 22.6 40 65 A R + 0 0 70 -2,-0.4 117,-0.2 117,-0.2 110,-0.1 -0.405 37.0 172.2 -74.1 144.6 16.3 -4.8 26.3 41 66 A F E -E 156 0B 0 115,-2.4 115,-1.9 -2,-0.1 198,-0.1 -0.979 42.7 -94.1-143.8 148.1 15.8 -1.2 27.5 42 67 A P E -E 155 0B 13 0, 0.0 113,-0.3 0, 0.0 196,-0.1 -0.348 27.9-147.0 -60.7 150.6 15.6 0.1 31.1 43 68 A M > + 0 0 2 111,-2.1 3,-1.9 101,-0.2 4,-0.1 0.757 27.7 176.7 -87.9 -30.0 11.9 0.4 32.1 44 69 A M G > S- 0 0 0 110,-0.5 3,-1.7 100,-0.5 4,-0.1 -0.228 70.7 -17.0 52.9-150.4 12.4 3.4 34.4 45 70 A S G > S+ 0 0 8 167,-0.3 3,-1.7 1,-0.3 4,-0.3 0.529 118.4 87.4 -60.8 -9.9 9.0 4.5 35.7 46 71 A T G X> S+ 0 0 0 -3,-1.9 3,-1.1 1,-0.3 4,-0.6 0.768 78.5 71.4 -63.3 -16.0 7.0 2.6 33.1 47 72 A F H <> S+ 0 0 0 -3,-1.7 4,-2.5 1,-0.2 3,-0.4 0.754 75.7 79.0 -69.3 -23.5 7.3 -0.3 35.7 48 73 A K H <> S+ 0 0 0 -3,-1.7 4,-2.3 1,-0.3 -1,-0.2 0.808 89.0 55.9 -56.5 -28.2 4.9 1.5 38.1 49 74 A V H <> S+ 0 0 0 -3,-1.1 4,-1.8 -4,-0.3 -1,-0.3 0.909 108.7 45.6 -70.7 -41.0 2.0 0.3 35.9 50 75 A L H X S+ 0 0 0 -4,-0.6 4,-2.1 -3,-0.4 -2,-0.2 0.877 110.2 57.0 -68.0 -36.0 3.1 -3.4 36.3 51 76 A L H X S+ 0 0 0 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.951 110.0 42.0 -58.1 -53.2 3.6 -2.7 40.1 52 77 A a H X S+ 0 0 0 -4,-2.3 4,-2.9 2,-0.2 5,-0.2 0.807 108.2 61.2 -67.3 -28.4 -0.1 -1.5 40.5 53 78 A G H X S+ 0 0 0 -4,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.959 107.5 44.8 -59.4 -46.3 -1.2 -4.4 38.3 54 79 A A H X S+ 0 0 5 -4,-2.1 4,-1.7 1,-0.2 -2,-0.2 0.865 111.8 53.1 -65.1 -37.1 0.3 -6.8 40.9 55 80 A V H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.940 110.4 45.9 -64.2 -45.2 -1.2 -4.8 43.7 56 81 A L H X S+ 0 0 1 -4,-2.9 4,-2.7 1,-0.2 -2,-0.2 0.847 107.2 59.1 -66.2 -33.0 -4.7 -5.0 42.1 57 82 A S H X S+ 0 0 33 -4,-2.1 4,-1.5 -5,-0.2 -1,-0.2 0.904 107.7 47.0 -59.7 -40.5 -4.1 -8.7 41.6 58 83 A R H <>S+ 0 0 60 -4,-1.7 5,-2.0 2,-0.2 6,-0.8 0.891 109.5 52.6 -67.2 -44.0 -3.6 -9.0 45.4 59 84 A V H ><5S+ 0 0 32 -4,-2.2 3,-2.4 4,-0.3 5,-0.2 0.958 107.5 51.5 -57.9 -51.4 -6.7 -7.0 46.1 60 85 A D H 3<5S+ 0 0 58 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.879 110.0 50.2 -53.5 -39.1 -8.9 -9.2 43.9 61 86 A A T 3<5S- 0 0 70 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.318 118.4-112.9 -83.5 8.2 -7.5 -12.3 45.8 62 87 A G T < 5S+ 0 0 53 -3,-2.4 -3,-0.2 2,-0.2 -2,-0.1 0.431 89.1 114.6 76.9 -0.7 -8.3 -10.6 49.1 63 88 A Q S - 0 0 98 -2,-0.3 3,-0.8 1,-0.1 29,-0.4 -0.968 10.4-147.1-122.6 135.0 -7.3 -3.6 50.5 66 91 A L T 3 S+ 0 0 27 -2,-0.4 29,-2.6 1,-0.2 30,-0.3 0.846 103.0 51.1 -68.8 -30.3 -7.4 -0.4 48.4 67 92 A G T 3 S+ 0 0 47 27,-0.2 -1,-0.2 26,-0.2 2,-0.1 0.557 81.3 122.6 -82.9 -7.3 -8.5 1.6 51.4 68 93 A R < - 0 0 93 -3,-0.8 26,-2.1 25,-0.1 2,-0.4 -0.331 60.3-131.7 -58.4 129.7 -5.7 0.3 53.6 69 94 A R E -F 93 0C 111 24,-0.2 2,-0.5 25,-0.1 24,-0.3 -0.698 15.0-157.7 -92.8 131.8 -3.6 3.1 55.0 70 95 A I E -F 92 0C 21 22,-2.9 22,-1.8 -2,-0.4 2,-0.4 -0.906 4.9-155.9-108.0 125.6 0.2 3.1 54.8 71 96 A H + 0 0 139 -2,-0.5 2,-0.3 20,-0.2 17,-0.1 -0.837 22.0 162.2-100.6 134.9 2.2 5.2 57.2 72 97 A Y - 0 0 15 -2,-0.4 2,-0.3 16,-0.3 19,-0.1 -0.844 19.6-143.4-139.5 175.9 5.7 6.3 56.3 73 98 A S >> - 0 0 49 -2,-0.3 3,-2.4 1,-0.0 4,-0.6 -0.833 39.6 -81.8-139.4 176.9 8.2 8.9 57.4 74 99 A Q G >4 S+ 0 0 131 1,-0.3 3,-1.0 -2,-0.3 -1,-0.0 0.797 120.4 67.2 -47.5 -36.7 10.9 11.3 56.1 75 100 A N G 34 S+ 0 0 149 1,-0.3 -1,-0.3 3,-0.0 -3,-0.0 0.816 98.6 53.8 -56.7 -31.3 13.4 8.4 56.2 76 101 A D G <4 S+ 0 0 68 -3,-2.4 -1,-0.3 2,-0.0 -2,-0.2 0.739 82.5 110.1 -78.1 -22.4 11.4 6.9 53.3 77 102 A L << + 0 0 41 -3,-1.0 2,-0.3 -4,-0.6 3,-0.1 -0.327 42.9 176.8 -63.9 126.4 11.5 9.9 51.1 78 103 A V - 0 0 37 1,-0.2 30,-0.3 -2,-0.1 29,-0.1 -0.782 44.8 -55.6-121.2 169.3 13.6 9.6 47.9 79 104 A E S S+ 0 0 139 -2,-0.3 28,-0.2 1,-0.2 -1,-0.2 -0.056 116.8 18.6 -46.8 140.0 14.2 11.9 45.0 80 105 A Y + 0 0 105 1,-0.1 27,-2.5 27,-0.1 28,-0.3 0.987 69.6 145.5 59.1 71.4 11.0 13.1 43.2 81 106 A S > + 0 0 5 25,-0.2 4,-1.9 26,-0.2 5,-0.1 -0.555 7.5 158.6-132.0 67.1 8.1 12.5 45.6 82 107 A P T 4 S+ 0 0 29 0, 0.0 -1,-0.1 0, 0.0 23,-0.0 0.705 79.0 31.5 -64.6 -25.0 5.7 15.4 44.9 83 108 A V T >4 S+ 0 0 32 -3,-0.1 3,-1.4 2,-0.1 4,-0.1 0.853 119.9 47.1-100.8 -48.1 2.7 13.7 46.4 84 109 A T G >4 S+ 0 0 0 1,-0.3 3,-2.0 2,-0.2 7,-0.1 0.855 103.4 62.9 -63.8 -34.2 4.1 11.5 49.1 85 110 A E G 3< S+ 0 0 100 -4,-1.9 3,-0.3 1,-0.3 -1,-0.3 0.673 101.1 54.9 -66.6 -12.9 6.3 14.2 50.6 86 111 A K G < S+ 0 0 151 -3,-1.4 -1,-0.3 1,-0.2 -2,-0.2 0.335 105.1 52.4 -99.4 4.6 3.1 16.1 51.4 87 112 A H <> + 0 0 73 -3,-2.0 4,-2.2 -4,-0.1 -15,-0.2 0.105 62.4 120.9-129.0 24.2 1.4 13.3 53.4 88 113 A L T 4 S+ 0 0 47 -3,-0.3 -16,-0.3 1,-0.2 -1,-0.1 0.858 74.5 57.0 -56.3 -38.3 4.0 12.4 56.0 89 114 A T T 4 S+ 0 0 122 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.1 0.958 124.4 13.1 -60.1 -57.4 1.6 13.2 58.8 90 115 A D T 4 S- 0 0 109 1,-0.2 -2,-0.2 -19,-0.0 -1,-0.2 0.421 95.0-138.1-106.5 1.9 -1.3 10.9 58.0 91 116 A G < - 0 0 2 -4,-2.2 2,-0.3 -19,-0.1 -1,-0.2 -0.191 21.0 -97.1 72.6-169.9 0.0 8.6 55.3 92 117 A M E -F 70 0C 4 -22,-1.8 -22,-2.9 -4,-0.1 2,-0.1 -0.985 28.3-106.7-149.3 153.5 -1.9 7.5 52.2 93 118 A T E > -F 69 0C 13 -2,-0.3 4,-2.1 -24,-0.3 -24,-0.2 -0.374 34.9-107.1 -80.5 161.5 -4.0 4.5 51.2 94 119 A V H > S+ 0 0 0 -26,-2.1 4,-1.9 -29,-0.4 5,-0.2 0.907 123.4 52.3 -50.4 -44.2 -2.9 1.8 48.8 95 120 A R H > S+ 0 0 109 -29,-2.6 4,-1.8 1,-0.2 -1,-0.2 0.901 108.7 47.8 -61.6 -44.6 -5.3 3.4 46.3 96 121 A E H > S+ 0 0 80 -30,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.784 109.0 55.5 -69.9 -25.9 -3.9 6.8 46.7 97 122 A L H X S+ 0 0 1 -4,-2.1 4,-2.8 2,-0.2 -2,-0.2 0.896 106.9 47.8 -74.7 -37.7 -0.3 5.5 46.4 98 123 A a H X S+ 0 0 0 -4,-1.9 4,-2.6 2,-0.2 5,-0.3 0.892 110.8 53.2 -67.8 -36.9 -1.0 3.9 43.0 99 124 A S H X>S+ 0 0 45 -4,-1.8 4,-2.6 -5,-0.2 5,-0.6 0.955 112.8 44.0 -59.2 -48.3 -2.6 7.1 41.9 100 125 A A H X5S+ 0 0 2 -4,-2.1 6,-2.2 1,-0.2 4,-1.2 0.891 113.5 50.6 -61.4 -43.3 0.5 9.0 42.9 101 126 A A H <5S+ 0 0 0 -4,-2.8 -1,-0.2 4,-0.3 -2,-0.2 0.881 121.4 31.7 -65.3 -40.6 2.8 6.4 41.3 102 127 A I H <5S+ 0 0 0 -4,-2.6 108,-0.2 -5,-0.2 -2,-0.2 0.932 124.6 38.2 -85.2 -50.4 1.0 6.4 38.0 103 128 A T H <5S+ 0 0 10 -4,-2.6 87,-2.2 -5,-0.3 88,-0.4 0.851 136.9 18.2 -72.3 -35.0 -0.3 9.9 37.5 104 129 A M S < - 0 0 0 -6,-2.2 4,-1.4 1,-0.1 -25,-0.2 -0.370 13.1-155.8 -57.3 120.4 5.9 9.6 42.6 107 132 A N H > S+ 0 0 13 -27,-2.5 4,-2.2 -28,-0.2 34,-0.2 0.874 88.6 50.6 -71.9 -40.2 9.0 7.5 43.5 108 133 A T H > S+ 0 0 1 -30,-0.3 4,-2.5 -28,-0.3 5,-0.2 0.896 107.4 56.1 -65.4 -36.6 8.4 7.1 47.2 109 134 A A H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.927 106.9 50.2 -59.4 -41.3 4.9 5.9 46.4 110 135 A A H X S+ 0 0 0 -4,-1.4 4,-2.6 1,-0.2 5,-0.2 0.947 109.7 50.2 -60.4 -49.9 6.4 3.2 44.2 111 136 A N H X S+ 0 0 22 -4,-2.2 4,-1.8 1,-0.2 -1,-0.2 0.864 110.3 50.0 -55.9 -40.8 8.8 2.1 46.9 112 137 A L H X S+ 0 0 19 -4,-2.5 4,-1.6 1,-0.2 -1,-0.2 0.907 112.2 46.5 -67.2 -41.8 6.0 1.8 49.5 113 138 A L H X S+ 0 0 0 -4,-2.3 4,-1.2 2,-0.2 -2,-0.2 0.876 109.2 54.8 -67.9 -38.6 3.8 -0.3 47.1 114 139 A L H >X>S+ 0 0 0 -4,-2.6 5,-3.4 1,-0.2 4,-0.9 0.904 105.9 53.9 -59.1 -41.9 6.8 -2.5 46.2 115 140 A T H ><5S+ 0 0 89 -4,-1.8 3,-0.7 1,-0.2 -1,-0.2 0.900 103.4 56.3 -60.6 -39.7 7.2 -3.1 49.9 116 141 A T H 3<5S+ 0 0 23 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.792 111.7 41.6 -65.0 -28.2 3.6 -4.2 50.2 117 142 A I H <<5S- 0 0 18 -4,-1.2 -1,-0.2 -3,-0.5 -2,-0.2 0.500 126.3 -91.9 -98.9 -2.0 4.0 -6.9 47.5 118 143 A G T <<5 - 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