==== 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 12-FEB-03 1NYM . 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) . 11327.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 181 68.8 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 . 30 11.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 91 34.6 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 90 0, 0.0 3,-1.6 0, 0.0 4,-1.0 0.000 360.0 360.0 360.0 140.5 3.0 1.5 8.6 2 27 A P H 3> + 0 0 84 0, 0.0 4,-1.6 0, 0.0 5,-0.1 0.782 360.0 68.9 -62.7 -24.4 6.6 1.6 7.2 3 28 A E H 3> S+ 0 0 103 1,-0.2 4,-1.3 2,-0.2 5,-0.1 0.865 96.7 54.0 -57.0 -34.9 6.4 5.4 7.1 4 29 A T H <> S+ 0 0 1 -3,-1.6 4,-2.4 1,-0.2 -1,-0.2 0.881 103.0 55.9 -70.8 -33.5 6.5 5.3 10.9 5 30 A L H X S+ 0 0 25 -4,-1.0 4,-2.9 2,-0.2 5,-0.3 0.837 99.1 61.1 -64.0 -33.3 9.6 3.2 10.8 6 31 A V H X S+ 0 0 87 -4,-1.6 4,-1.9 1,-0.2 -1,-0.2 0.952 109.6 42.5 -52.1 -48.5 11.2 6.0 8.7 7 32 A K H X S+ 0 0 80 -4,-1.3 4,-2.3 2,-0.2 -2,-0.2 0.899 113.2 51.2 -69.6 -40.1 10.6 8.2 11.8 8 33 A V H X S+ 0 0 0 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.932 113.7 42.6 -61.5 -49.2 11.7 5.6 14.3 9 34 A K H X S+ 0 0 105 -4,-2.9 4,-1.8 1,-0.2 -1,-0.2 0.848 112.3 56.2 -72.7 -25.7 15.0 4.9 12.6 10 35 A D H X S+ 0 0 66 -4,-1.9 4,-2.9 -5,-0.3 -1,-0.2 0.899 106.9 50.4 -62.3 -41.7 15.3 8.7 12.0 11 36 A A H X S+ 0 0 0 -4,-2.3 4,-2.9 2,-0.2 6,-0.2 0.905 106.9 52.7 -58.6 -50.1 15.0 9.1 15.8 12 37 A E H X>S+ 0 0 38 -4,-2.0 5,-1.6 1,-0.2 4,-0.7 0.899 114.1 45.0 -58.7 -39.5 17.7 6.5 16.5 13 38 A D H ><5S+ 0 0 129 -4,-1.8 3,-0.9 2,-0.2 -2,-0.2 0.964 113.8 46.8 -63.2 -55.1 19.9 8.5 14.2 14 39 A Q H 3<5S+ 0 0 121 -4,-2.9 -2,-0.2 1,-0.3 -3,-0.2 0.855 117.4 44.4 -56.9 -43.0 19.1 11.9 15.6 15 40 A L H 3<5S- 0 0 13 -4,-2.9 227,-0.5 2,-0.2 228,-0.4 0.571 100.6-133.4 -79.3 -15.4 19.5 10.7 19.2 16 41 A G T <<5S+ 0 0 64 -3,-0.9 2,-0.3 -4,-0.7 -3,-0.2 0.863 75.3 87.2 61.5 35.6 22.8 8.8 18.5 17 42 A A S -A 232 0A 40 5,-2.8 4,-2.4 -2,-0.4 207,-0.3 -0.574 23.7-149.1 -66.8 125.0 -3.3 -4.6 18.1 26 51 A L T 4 S+ 0 0 17 205,-2.3 -1,-0.2 -2,-0.4 206,-0.2 0.883 90.9 41.4 -65.8 -43.5 -5.0 -4.5 21.4 27 52 A N T 4 S+ 0 0 142 204,-0.5 -1,-0.2 1,-0.1 205,-0.1 0.934 128.6 25.6 -71.0 -50.7 -7.8 -7.0 20.5 28 53 A S T 4 S- 0 0 68 2,-0.1 -2,-0.2 1,-0.0 -1,-0.1 0.661 91.8-129.5 -92.7 -20.1 -5.8 -9.5 18.5 29 54 A G < + 0 0 25 -4,-2.4 2,-0.2 1,-0.3 -3,-0.1 0.475 52.1 156.6 76.3 6.6 -2.3 -9.1 19.9 30 55 A K - 0 0 125 -5,-0.1 -5,-2.8 -6,-0.1 2,-0.7 -0.436 46.4-125.9 -66.6 132.2 -1.0 -8.8 16.3 31 56 A I E -B 24 0A 88 -7,-0.2 -7,-0.2 -2,-0.2 3,-0.1 -0.700 28.8-179.2 -73.8 115.7 2.4 -7.0 16.0 32 57 A L E - 0 0 46 -9,-2.7 2,-0.3 -2,-0.7 -8,-0.2 0.829 65.3 -12.6 -85.9 -33.8 1.6 -4.2 13.4 33 58 A E E +B 23 0A 42 -10,-1.3 -10,-2.4 -29,-0.0 -1,-0.4 -0.958 67.7 176.2-166.4 146.3 5.1 -2.7 13.3 34 59 A S E -B 22 0A 41 -2,-0.3 2,-0.3 -12,-0.2 -12,-0.2 -0.983 17.9-165.4-153.2 162.9 8.3 -3.0 15.3 35 60 A F E S-B 21 0A 35 -14,-2.6 -14,-2.8 -2,-0.3 -2,-0.0 -0.926 86.2 -11.7-152.4 129.3 11.9 -2.0 15.7 36 61 A R S > S+ 0 0 68 -2,-0.3 3,-1.4 -16,-0.2 123,-0.1 0.882 80.8 166.7 48.1 45.8 14.4 -3.7 18.0 37 62 A P T 3 + 0 0 36 0, 0.0 122,-2.7 0, 0.0 123,-0.4 0.739 69.7 39.2 -68.0 -22.2 11.3 -5.5 19.5 38 63 A E T 3 S+ 0 0 162 120,-0.2 2,-0.3 119,-0.1 -2,-0.1 0.164 90.2 107.3-116.5 18.9 13.4 -8.1 21.5 39 64 A E S < S- 0 0 66 -3,-1.4 2,-0.2 1,-0.0 120,-0.1 -0.717 73.1-111.4 -91.4 146.5 16.2 -5.9 22.6 40 65 A R + 0 0 73 -2,-0.3 117,-0.2 117,-0.2 110,-0.1 -0.552 36.8 173.6 -82.9 140.9 16.4 -4.9 26.3 41 66 A F E -E 156 0B 0 115,-2.4 115,-2.2 -2,-0.2 2,-0.2 -0.979 41.2 -94.0-137.5 147.4 15.9 -1.4 27.5 42 67 A P E -E 155 0B 14 0, 0.0 113,-0.3 0, 0.0 196,-0.2 -0.437 28.3-148.8 -57.8 131.8 15.6 0.0 31.0 43 68 A M > + 0 0 2 111,-2.3 3,-1.8 -2,-0.2 112,-0.1 0.813 26.9 176.2 -67.2 -37.3 12.0 0.2 32.1 44 69 A M G > S- 0 0 0 110,-0.5 3,-1.8 100,-0.4 4,-0.1 -0.227 70.5 -16.8 53.0-144.5 12.4 3.3 34.3 45 70 A S G > S+ 0 0 9 1,-0.3 3,-2.0 167,-0.3 4,-0.3 0.575 119.2 87.1 -70.0 -8.1 9.1 4.4 35.6 46 71 A T G X> S+ 0 0 0 -3,-1.8 3,-1.2 1,-0.3 4,-0.6 0.803 77.5 70.5 -60.5 -20.9 7.1 2.4 33.1 47 72 A F H <> S+ 0 0 0 -3,-1.8 4,-2.4 1,-0.3 -1,-0.3 0.721 77.6 79.2 -64.2 -22.5 7.4 -0.5 35.6 48 73 A K H <> S+ 0 0 0 -3,-2.0 4,-2.1 1,-0.2 -1,-0.3 0.797 88.6 54.9 -62.9 -27.4 5.0 1.4 37.9 49 74 A V H <> S+ 0 0 0 -3,-1.2 4,-2.1 -4,-0.3 -1,-0.2 0.914 109.2 47.5 -64.6 -44.4 2.0 0.2 35.8 50 75 A L H X S+ 0 0 0 -4,-0.6 4,-2.3 -3,-0.3 -2,-0.2 0.910 110.3 53.4 -61.0 -45.3 3.2 -3.4 36.2 51 76 A L H X S+ 0 0 0 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.931 109.9 45.8 -53.1 -52.5 3.6 -2.8 40.0 52 77 A a H X S+ 0 0 0 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.838 108.4 57.6 -71.5 -24.4 0.1 -1.6 40.3 53 78 A G H X S+ 0 0 0 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.932 107.7 47.6 -60.3 -43.3 -1.2 -4.5 38.3 54 79 A A H X S+ 0 0 4 -4,-2.3 4,-1.7 2,-0.2 -2,-0.2 0.887 111.4 50.9 -65.4 -40.7 0.5 -6.8 40.8 55 80 A V H X S+ 0 0 0 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.953 110.1 48.9 -60.8 -45.3 -1.2 -4.8 43.6 56 81 A L H X S+ 0 0 0 -4,-2.6 4,-2.7 1,-0.2 -2,-0.2 0.867 106.1 57.3 -67.4 -32.4 -4.6 -5.1 42.0 57 82 A S H X S+ 0 0 35 -4,-2.1 4,-1.7 2,-0.2 -1,-0.2 0.907 108.2 48.2 -62.0 -38.0 -4.1 -8.9 41.5 58 83 A R H <>S+ 0 0 62 -4,-1.7 5,-2.9 2,-0.2 6,-0.8 0.924 109.4 52.0 -69.4 -40.4 -3.6 -9.0 45.3 59 84 A V H ><5S+ 0 0 33 -4,-2.5 3,-1.8 4,-0.2 -2,-0.2 0.942 108.9 50.5 -56.6 -49.7 -6.7 -6.9 45.9 60 85 A D H 3<5S+ 0 0 55 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.855 111.1 49.6 -58.8 -34.9 -8.7 -9.3 43.7 61 86 A A T 3<5S- 0 0 64 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.493 117.7-111.0 -81.8 -0.8 -7.4 -12.3 45.7 62 87 A G T < 5S+ 0 0 59 -3,-1.8 -3,-0.2 -4,-0.4 -2,-0.1 0.770 90.7 112.3 74.1 25.1 -8.3 -10.7 49.0 63 88 A Q S - 0 0 100 -2,-0.3 3,-1.7 1,-0.1 29,-0.4 -0.997 13.8-142.3-129.3 132.6 -7.2 -3.6 50.1 66 91 A L T 3 S+ 0 0 23 -2,-0.4 29,-2.9 1,-0.3 30,-0.3 0.811 104.8 53.1 -63.5 -27.2 -7.2 -0.4 48.0 67 92 A G T 3 S+ 0 0 44 27,-0.2 -1,-0.3 26,-0.2 2,-0.2 0.450 78.9 121.0 -86.6 1.2 -8.3 1.6 51.1 68 93 A R < - 0 0 90 -3,-1.7 26,-1.9 25,-0.1 2,-0.4 -0.452 60.5-131.8 -67.7 135.1 -5.6 0.3 53.4 69 94 A R E -F 93 0C 109 24,-0.2 2,-0.5 -2,-0.2 24,-0.3 -0.735 16.1-160.8 -94.0 130.4 -3.5 3.1 54.8 70 95 A I E -F 92 0C 24 22,-3.1 22,-2.1 -2,-0.4 2,-0.4 -0.964 6.5-153.4-110.9 131.5 0.3 3.0 54.8 71 96 A H + 0 0 131 -2,-0.5 2,-0.2 20,-0.2 17,-0.1 -0.855 20.9 169.6-101.8 134.9 2.2 5.3 57.1 72 97 A Y - 0 0 10 -2,-0.4 2,-0.2 15,-0.3 19,-0.1 -0.775 18.4-138.5-142.8 173.2 5.7 6.5 56.2 73 98 A S >> - 0 0 58 -2,-0.2 3,-1.9 1,-0.0 4,-0.5 -0.768 40.3 -92.5-129.1 170.5 8.4 8.9 57.3 74 99 A Q G >4 S+ 0 0 131 1,-0.3 3,-1.0 -2,-0.2 -1,-0.0 0.807 121.5 72.3 -52.5 -30.1 10.9 11.3 55.9 75 100 A N G 34 S+ 0 0 150 1,-0.2 -1,-0.3 3,-0.0 -3,-0.0 0.785 96.8 47.5 -59.9 -24.7 13.1 8.3 56.2 76 101 A D G <4 S+ 0 0 72 -3,-1.9 2,-0.3 2,-0.1 -1,-0.2 0.592 84.4 111.6 -92.2 -14.5 11.3 6.7 53.2 77 102 A L << + 0 0 35 -3,-1.0 2,-0.2 -4,-0.5 3,-0.1 -0.481 41.7 178.5 -73.0 131.0 11.4 9.7 50.9 78 103 A V - 0 0 40 -2,-0.3 30,-0.3 1,-0.1 29,-0.1 -0.691 43.6 -59.3-116.2 172.9 13.5 9.3 47.8 79 104 A E S S+ 0 0 132 -2,-0.2 28,-0.2 1,-0.2 -1,-0.1 -0.235 114.8 22.2 -58.6 141.1 14.1 11.8 45.0 80 105 A Y S S+ 0 0 104 1,-0.1 27,-2.7 27,-0.1 28,-0.2 0.993 71.1 143.4 66.0 74.6 11.1 12.9 42.9 81 106 A S > + 0 0 2 25,-0.2 4,-2.1 26,-0.2 5,-0.2 -0.521 10.0 161.2-137.1 61.3 8.2 12.3 45.3 82 107 A P T 4 S+ 0 0 33 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.735 77.3 33.2 -68.5 -24.6 5.9 15.2 44.6 83 108 A V T >4 S+ 0 0 32 2,-0.1 3,-2.1 -3,-0.1 4,-0.3 0.871 117.2 49.0 -92.2 -53.8 2.8 13.6 46.1 84 109 A T G >4 S+ 0 0 0 1,-0.3 3,-1.6 2,-0.2 7,-0.1 0.824 100.5 65.8 -61.1 -31.2 4.2 11.5 48.9 85 110 A E G 3< S+ 0 0 115 -4,-2.1 3,-0.4 1,-0.3 -1,-0.3 0.710 100.2 54.9 -63.8 -15.6 6.3 14.3 50.4 86 111 A K G < S+ 0 0 157 -3,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.459 104.9 51.1 -93.6 -5.5 3.0 16.1 51.1 87 112 A H <> + 0 0 74 -3,-1.6 4,-1.9 -4,-0.3 -15,-0.3 -0.074 63.3 121.8-125.9 32.7 1.4 13.3 53.2 88 113 A L T 4 S+ 0 0 55 -3,-0.4 -16,-0.3 1,-0.2 -1,-0.1 0.874 74.6 53.5 -64.2 -36.1 4.0 12.4 55.8 89 114 A T T 4 S+ 0 0 122 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.1 0.943 125.8 14.7 -68.1 -49.6 1.7 13.1 58.8 90 115 A D T 4 S- 0 0 115 1,-0.2 -1,-0.2 -19,-0.0 -2,-0.2 0.409 97.5-137.4-113.2 -1.5 -1.3 11.0 57.9 91 116 A G < - 0 0 2 -4,-1.9 2,-0.3 -19,-0.1 -1,-0.2 -0.156 17.4 -91.4 79.2-171.2 -0.1 8.6 55.2 92 117 A M E -F 70 0C 4 -22,-2.1 -22,-3.1 -4,-0.1 2,-0.1 -0.985 27.6-115.6-144.9 149.2 -1.7 7.5 52.0 93 118 A T E > -F 69 0C 12 -2,-0.3 4,-2.5 -24,-0.3 -24,-0.2 -0.433 34.0-106.8 -81.4 165.0 -3.9 4.6 51.0 94 119 A V H > S+ 0 0 0 -26,-1.9 4,-2.4 -29,-0.4 5,-0.2 0.913 122.9 51.4 -54.0 -47.6 -2.9 1.9 48.5 95 120 A R H > S+ 0 0 106 -29,-2.9 4,-2.5 1,-0.2 -1,-0.2 0.926 110.0 48.4 -52.7 -51.3 -5.2 3.5 46.0 96 121 A E H > S+ 0 0 85 -30,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.838 109.9 53.3 -60.8 -36.8 -3.7 6.9 46.5 97 122 A L H X S+ 0 0 0 -4,-2.5 4,-2.7 2,-0.2 -1,-0.2 0.893 108.7 47.8 -68.2 -43.1 -0.2 5.5 46.2 98 123 A a H X S+ 0 0 0 -4,-2.4 4,-2.5 2,-0.2 5,-0.4 0.916 111.2 51.9 -64.4 -38.8 -1.0 3.8 42.9 99 124 A S H X>S+ 0 0 44 -4,-2.5 4,-2.6 -5,-0.2 5,-0.7 0.945 113.7 44.3 -57.0 -47.3 -2.5 7.1 41.6 100 125 A A H X5S+ 0 0 2 -4,-2.2 6,-2.2 1,-0.2 4,-1.2 0.913 113.2 50.1 -64.0 -44.5 0.6 8.9 42.7 101 126 A A H <5S+ 0 0 0 -4,-2.7 -1,-0.2 4,-0.3 -2,-0.2 0.878 122.2 31.8 -63.8 -39.0 3.0 6.3 41.2 102 127 A I H <5S+ 0 0 5 -4,-2.5 108,-0.2 -5,-0.2 -2,-0.2 0.926 125.8 36.0 -87.3 -52.4 1.2 6.3 37.9 103 128 A T H <5S+ 0 0 16 -4,-2.6 87,-1.8 -5,-0.4 88,-0.4 0.897 135.6 22.0 -72.8 -37.0 -0.2 9.8 37.3 104 129 A M S < - 0 0 0 -6,-2.2 4,-1.4 1,-0.1 -25,-0.2 -0.325 15.2-158.7 -63.2 123.9 6.1 9.4 42.4 107 132 A N H > S+ 0 0 11 -27,-2.7 4,-2.1 2,-0.2 34,-0.2 0.879 88.2 50.1 -77.0 -38.7 9.1 7.4 43.4 108 133 A T H > S+ 0 0 0 -30,-0.3 4,-2.8 2,-0.2 5,-0.2 0.911 108.1 56.3 -64.0 -40.8 8.5 7.0 47.1 109 134 A A H > S+ 0 0 0 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.926 106.9 50.0 -54.0 -45.5 5.0 5.8 46.2 110 135 A A H X S+ 0 0 0 -4,-1.4 4,-2.8 1,-0.2 -1,-0.2 0.921 110.2 49.2 -61.5 -42.9 6.5 3.1 44.0 111 136 A N H X S+ 0 0 21 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.920 111.0 49.9 -63.5 -42.0 8.9 2.0 46.8 112 137 A L H X S+ 0 0 16 -4,-2.8 4,-1.5 1,-0.2 -2,-0.2 0.929 112.9 46.8 -62.6 -40.9 6.0 1.8 49.3 113 138 A L H X S+ 0 0 0 -4,-2.4 4,-1.0 -5,-0.2 -2,-0.2 0.907 109.1 54.3 -67.2 -41.7 3.9 -0.3 46.9 114 139 A L H >X>S+ 0 0 0 -4,-2.8 5,-2.7 1,-0.2 4,-0.9 0.927 105.0 55.5 -55.8 -42.3 6.9 -2.6 46.1 115 140 A T H ><5S+ 0 0 88 -4,-2.2 3,-0.9 1,-0.3 -1,-0.2 0.910 101.6 57.9 -59.2 -38.9 7.2 -3.2 49.8 116 141 A T H 3<5S+ 0 0 24 -4,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.768 110.4 41.3 -61.5 -31.5 3.6 -4.3 50.0 117 142 A I H <<5S- 0 0 17 -4,-1.0 -1,-0.2 -3,-0.9 -2,-0.2 0.462 126.6 -92.5 -99.3 -0.4 4.1 -7.1 47.4 118 143 A G T <<5 - 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