==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-MAR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 24-AUG-12 4B88 . COMPND 2 MOLECULE: BETA-LACTAMASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SYNTHETIC CONSTRUCT; . AUTHOR J.A.GAVIRA,V.A.RISSO,J.M.SANCHEZ-RUIZ . 260 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10617.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 184 70.8 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 14.6 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 . 5 1.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 91 35.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 2.7 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 2 1 1 0 0 0 1 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 1 1 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 28 A Q > 0 0 143 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -46.6 77.1 25.1 -29.3 2 29 A L H > + 0 0 13 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.961 360.0 54.3 -56.5 -47.6 79.9 23.6 -27.1 3 30 A S H > S+ 0 0 56 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.870 108.7 47.3 -50.4 -42.2 82.0 26.6 -28.3 4 31 A E H > S+ 0 0 62 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.855 110.8 50.9 -73.2 -35.4 79.3 29.0 -27.1 5 32 A Q H X S+ 0 0 75 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.849 106.1 55.9 -68.5 -33.6 78.9 27.3 -23.7 6 33 A L H X S+ 0 0 1 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.891 103.8 54.3 -67.7 -36.4 82.6 27.5 -23.2 7 34 A A H X S+ 0 0 23 -4,-1.4 4,-1.3 2,-0.2 -1,-0.2 0.869 109.4 47.4 -64.3 -36.8 82.6 31.2 -23.7 8 35 A E H X S+ 0 0 73 -4,-1.4 4,-1.4 1,-0.2 -1,-0.2 0.909 110.3 52.9 -70.0 -39.8 79.9 31.6 -21.0 9 36 A L H X S+ 0 0 6 -4,-2.3 4,-1.2 1,-0.2 -2,-0.2 0.891 102.7 58.4 -60.9 -37.3 81.9 29.3 -18.7 10 37 A E H >X>S+ 0 0 21 -4,-2.1 5,-0.8 1,-0.2 4,-0.7 0.901 101.5 54.9 -62.4 -37.5 85.0 31.5 -19.2 11 38 A K H ><5S+ 0 0 165 -4,-1.3 3,-0.8 1,-0.2 -1,-0.2 0.906 108.2 49.5 -59.6 -40.6 83.0 34.5 -17.8 12 39 A R H 3<5S+ 0 0 143 -4,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.694 103.8 62.0 -66.8 -24.3 82.3 32.4 -14.7 13 40 A S H <<5S- 0 0 0 -4,-1.2 227,-0.7 -3,-0.6 -1,-0.2 0.613 95.0-137.3 -82.9 -16.3 86.0 31.5 -14.3 14 41 A G T <<5S+ 0 0 38 -3,-0.8 225,-0.9 -4,-0.7 2,-0.2 0.656 75.7 52.8 67.2 16.9 87.3 35.0 -13.8 15 42 A G S -A 229 0A 5 5,-2.9 4,-2.7 -2,-0.6 3,-0.4 -0.784 5.4-168.6 -90.2 110.0 87.0 13.2 -31.2 24 51 A T T 4 S+ 0 0 31 204,-1.7 -1,-0.1 -2,-0.8 205,-0.1 0.666 82.0 65.2 -75.5 -12.9 88.9 10.2 -32.6 25 52 A A T 4 S+ 0 0 56 203,-0.3 -1,-0.2 202,-0.2 204,-0.1 0.919 125.9 9.5 -68.9 -39.5 85.7 8.5 -33.8 26 53 A T T 4 S- 0 0 97 -3,-0.4 -2,-0.2 2,-0.1 -1,-0.1 0.532 94.0-121.0-118.7 -12.8 85.1 11.2 -36.3 27 54 A G < + 0 0 41 -4,-2.7 -3,-0.2 1,-0.3 2,-0.1 0.431 61.4 149.5 76.1 1.6 88.2 13.4 -36.4 28 55 A R - 0 0 134 -5,-0.3 -5,-2.9 -6,-0.1 2,-0.4 -0.385 30.7-158.5 -63.8 138.2 86.0 16.4 -35.4 29 56 A R E -B 22 0A 141 -7,-0.2 2,-0.4 -3,-0.1 -7,-0.2 -0.976 10.1-171.3-124.1 135.3 87.8 19.1 -33.3 30 57 A I E +B 21 0A 19 -9,-2.7 -9,-3.0 -2,-0.4 2,-0.3 -0.986 16.2 173.4-121.8 135.9 86.2 21.6 -31.1 31 58 A A E -B 20 0A 28 -2,-0.4 2,-0.4 -11,-0.2 -11,-0.2 -0.997 26.4-165.6-146.5 149.7 88.3 24.4 -29.6 32 60 A Y E S-B 19 0A 40 -13,-2.7 -13,-2.3 -2,-0.3 -2,-0.0 -0.985 94.2 -12.1-134.8 119.8 88.0 27.6 -27.6 33 61 A R S > S+ 0 0 88 -2,-0.4 3,-1.3 -15,-0.2 123,-0.1 0.870 90.0 161.3 50.3 39.8 91.1 29.8 -27.6 34 62 A G T 3 + 0 0 8 1,-0.3 122,-2.3 121,-0.1 123,-0.5 0.743 66.2 42.1 -63.4 -25.9 92.7 26.7 -29.2 35 63 A D T 3 S+ 0 0 124 120,-0.1 -1,-0.3 119,-0.1 2,-0.3 0.374 90.4 103.9-107.2 8.0 95.7 28.5 -30.6 36 64 A E S < S- 0 0 69 -3,-1.3 2,-0.2 1,-0.1 120,-0.1 -0.624 75.1-111.1 -84.3 147.9 96.5 30.7 -27.7 37 65 A R + 0 0 91 -2,-0.3 117,-0.2 117,-0.2 110,-0.2 -0.560 36.6 177.4 -79.5 142.8 99.5 29.9 -25.5 38 66 A F E -E 153 0B 0 115,-2.5 115,-2.2 -2,-0.2 2,-0.2 -0.977 37.8 -97.1-139.8 148.2 98.9 28.8 -21.9 39 67 A P E -E 152 0B 13 0, 0.0 113,-0.2 0, 0.0 196,-0.1 -0.484 27.5-154.2 -66.0 129.2 101.4 27.7 -19.2 40 68 A M > + 0 0 2 111,-2.3 3,-1.9 -2,-0.2 112,-0.1 0.832 22.6 173.9 -72.1 -36.5 101.6 23.9 -19.0 41 69 A C G > S- 0 0 0 110,-0.5 3,-1.6 100,-0.4 -1,-0.2 -0.294 74.0 -14.2 44.6-137.9 102.7 23.5 -15.4 42 70 A S G > S+ 0 0 11 1,-0.3 3,-1.7 167,-0.2 4,-0.3 0.539 117.8 88.1 -73.7 -1.2 102.7 19.8 -14.6 43 71 A T G X> S+ 0 0 0 -3,-1.9 3,-1.3 1,-0.3 4,-0.5 0.803 77.2 70.3 -61.3 -24.4 100.7 18.8 -17.6 44 72 A F H X> S+ 0 0 0 -3,-1.6 4,-2.1 1,-0.2 3,-0.7 0.726 78.8 78.4 -63.5 -20.6 104.1 18.6 -19.4 45 73 A K H <> S+ 0 0 1 -3,-1.7 4,-2.0 1,-0.3 -1,-0.2 0.791 85.8 58.8 -63.6 -26.8 104.9 15.5 -17.2 46 74 A A H <> S+ 0 0 3 -3,-1.3 4,-1.5 -4,-0.3 -1,-0.3 0.891 108.7 45.2 -65.1 -38.0 102.8 13.3 -19.5 47 75 A L H S+ 0 0 90 -4,-1.2 5,-2.7 -3,-0.2 6,-0.8 0.886 108.3 52.4 -70.7 -37.6 113.9 5.9 -25.7 56 84 A V H ><5S+ 0 0 34 -4,-1.8 3,-1.7 4,-0.2 -2,-0.2 0.939 106.9 53.8 -59.0 -48.0 113.0 2.6 -24.2 57 85 A D H 3<5S+ 0 0 61 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.847 108.8 49.3 -54.2 -34.7 111.4 1.6 -27.5 58 86 A Q T 3<5S- 0 0 129 -4,-1.3 -1,-0.3 -5,-0.2 -2,-0.2 0.494 117.3-113.1 -86.7 -2.5 114.7 2.4 -29.3 59 87 A G T < 5S+ 0 0 67 -3,-1.7 -3,-0.2 -4,-0.4 -2,-0.1 0.647 89.4 112.9 78.7 17.6 116.7 0.3 -26.8 60 88 A K S - 0 0 138 -2,-0.3 3,-1.4 1,-0.1 29,-0.4 -0.996 12.5-141.4-128.1 139.1 115.5 0.6 -19.7 63 91 A L T 3 S+ 0 0 58 -2,-0.4 29,-2.5 1,-0.3 30,-0.3 0.793 104.9 50.0 -64.2 -29.1 112.4 0.7 -17.4 64 92 A D T 3 S+ 0 0 111 27,-0.2 2,-0.3 26,-0.2 -1,-0.3 0.312 79.0 123.8 -97.2 11.0 114.3 -1.2 -14.7 65 93 A R < - 0 0 75 -3,-1.4 26,-1.9 1,-0.1 2,-0.4 -0.554 59.4-131.6 -72.4 132.9 117.3 1.0 -14.7 66 94 A R E -F 90 0C 127 -2,-0.3 2,-0.5 24,-0.2 24,-0.3 -0.706 16.9-161.7 -91.2 129.7 117.9 2.4 -11.2 67 95 A I E -F 89 0C 20 22,-3.3 22,-2.2 -2,-0.4 2,-0.3 -0.943 7.8-157.2-110.8 129.4 118.6 6.1 -10.7 68 96 A T + 0 0 109 -2,-0.5 2,-0.3 20,-0.2 17,-0.1 -0.789 18.8 161.6-108.1 150.6 120.2 7.2 -7.5 69 97 A Y - 0 0 21 16,-0.4 2,-0.2 -2,-0.3 19,-0.2 -0.951 23.9-126.1-157.2 170.1 120.0 10.7 -6.0 70 98 A G >> - 0 0 9 -2,-0.3 3,-1.8 1,-0.0 4,-0.5 -0.647 37.7 -92.5-121.3 177.6 120.5 12.7 -2.7 71 99 A K G >4 S+ 0 0 164 1,-0.3 3,-1.0 -2,-0.2 -1,-0.0 0.786 120.3 66.0 -58.5 -25.8 118.7 15.1 -0.4 72 100 A E G 34 S+ 0 0 162 1,-0.3 -1,-0.3 3,-0.0 -3,-0.0 0.727 96.3 55.9 -72.4 -19.8 120.2 17.9 -2.4 73 101 A D G <4 S+ 0 0 64 -3,-1.8 -1,-0.3 2,-0.0 2,-0.2 0.637 83.4 107.3 -83.7 -17.1 118.2 16.9 -5.4 74 102 A L << - 0 0 50 -3,-1.0 2,-0.2 -4,-0.5 3,-0.0 -0.457 45.7-176.8 -69.5 127.5 114.9 17.1 -3.7 75 103 A V - 0 0 37 -2,-0.2 30,-0.2 1,-0.1 29,-0.1 -0.647 43.8 -70.8-109.4 174.1 112.7 20.0 -4.6 76 104 A D S S+ 0 0 150 -2,-0.2 28,-0.1 1,-0.2 -1,-0.1 -0.346 112.0 35.3 -75.4 158.6 109.3 20.7 -2.9 77 105 A Y + 0 0 101 1,-0.1 27,-2.8 27,-0.1 28,-0.3 0.992 68.2 140.4 53.9 75.8 106.4 18.4 -3.6 78 106 A S > + 0 0 4 25,-0.2 4,-1.8 26,-0.2 5,-0.2 -0.556 13.3 162.6-137.0 62.6 108.2 15.1 -3.9 79 107 A P T 4 S+ 0 0 34 0, 0.0 4,-0.2 0, 0.0 -1,-0.1 0.827 79.6 29.0 -58.1 -38.5 105.8 12.7 -2.0 80 108 A V T >4 S+ 0 0 32 2,-0.1 3,-1.3 1,-0.1 4,-0.1 0.920 118.7 50.2 -88.8 -50.5 107.4 9.6 -3.5 81 109 A T G >4 S+ 0 0 0 1,-0.3 3,-1.7 2,-0.2 7,-0.1 0.788 100.7 63.8 -64.6 -28.3 111.0 10.5 -4.2 82 110 A E G >< S+ 0 0 114 -4,-1.8 3,-0.6 1,-0.3 -1,-0.3 0.793 98.3 57.9 -68.3 -24.3 111.7 11.9 -0.7 83 111 A K G < S+ 0 0 156 -3,-1.3 -1,-0.3 -4,-0.2 -2,-0.2 0.376 108.7 45.4 -81.6 1.4 111.0 8.4 0.6 84 112 A H G <> + 0 0 53 -3,-1.7 4,-2.5 -4,-0.1 -15,-0.2 0.119 63.2 118.0-137.5 20.6 113.8 6.8 -1.5 85 113 A V T <4 S+ 0 0 33 -3,-0.6 -16,-0.4 1,-0.2 -2,-0.1 0.836 85.3 51.5 -56.1 -30.8 116.9 9.0 -1.2 86 114 A G T 4 S+ 0 0 81 1,-0.1 -1,-0.2 2,-0.1 -2,-0.1 0.948 122.6 22.0 -70.6 -51.4 118.5 5.9 0.3 87 115 A D T 4 S- 0 0 85 1,-0.2 -2,-0.2 -4,-0.1 -1,-0.1 0.539 95.9-135.9-101.7 -8.7 117.7 3.2 -2.2 88 116 A G < - 0 0 1 -4,-2.5 2,-0.3 -19,-0.2 -20,-0.2 -0.162 19.6-105.0 74.8-177.6 117.1 5.2 -5.5 89 117 A M E -F 67 0C 2 -22,-2.2 -22,-3.3 -4,-0.1 2,-0.1 -0.982 22.4-110.9-145.1 152.9 114.2 4.4 -7.9 90 118 A T E > -F 66 0C 17 -2,-0.3 4,-2.4 -24,-0.3 -24,-0.2 -0.433 33.7-108.7 -81.2 164.1 113.8 2.8 -11.3 91 119 A V H > S+ 0 0 0 -26,-1.9 4,-2.3 -29,-0.4 5,-0.2 0.911 121.9 51.4 -55.2 -45.9 113.0 4.7 -14.4 92 120 A A H > S+ 0 0 27 -29,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.908 109.4 50.0 -58.0 -45.1 109.5 3.1 -14.4 93 121 A E H > S+ 0 0 77 -30,-0.3 4,-2.3 1,-0.2 -1,-0.2 0.863 110.0 50.5 -64.8 -37.0 109.0 4.1 -10.7 94 122 A L H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.893 109.6 50.4 -67.2 -38.9 110.0 7.7 -11.5 95 123 A C H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 5,-0.2 0.945 112.4 47.3 -62.7 -45.8 107.5 7.9 -14.5 96 124 A E H X S+ 0 0 94 -4,-2.4 4,-2.8 1,-0.2 5,-0.5 0.909 113.4 47.1 -63.4 -45.5 104.7 6.6 -12.3 97 125 A A H X S+ 0 0 3 -4,-2.3 6,-2.1 1,-0.2 4,-1.4 0.909 112.3 50.5 -59.8 -44.9 105.5 9.0 -9.4 98 126 A A H < S+ 0 0 1 -4,-2.6 -2,-0.2 4,-0.3 -1,-0.2 0.868 120.4 34.7 -63.4 -38.2 105.8 11.9 -11.9 99 127 A I H < S+ 0 0 0 -4,-2.2 108,-0.3 -5,-0.2 -2,-0.2 0.943 122.7 38.0 -81.2 -53.5 102.4 11.1 -13.5 100 128 A T H < S+ 0 0 6 -4,-2.8 87,-2.1 -5,-0.2 88,-0.3 0.742 135.6 17.6 -82.7 -22.8 100.2 9.8 -10.7 101 129 A L S < S- 0 0 40 -4,-1.4 -1,-0.2 -5,-0.5 -3,-0.2 0.345 97.7-121.9-125.7 3.2 101.3 12.0 -7.9 102 130 A S - 0 0 12 -5,-0.3 -4,-0.3 -6,-0.2 2,-0.1 0.840 37.4-168.5 60.0 34.5 103.0 14.8 -9.8 103 131 A D > - 0 0 0 -6,-2.1 4,-1.3 1,-0.2 -25,-0.2 -0.361 10.5-158.0 -59.4 120.6 106.2 14.2 -8.0 104 132 A N H > S+ 0 0 18 -27,-2.8 4,-2.0 2,-0.2 34,-0.2 0.865 88.1 50.2 -74.3 -36.9 108.5 17.2 -8.9 105 133 A T H > S+ 0 0 1 -28,-0.3 4,-2.5 -30,-0.2 5,-0.2 0.906 106.4 56.2 -69.0 -40.4 111.8 15.6 -8.1 106 134 A A H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.919 107.2 50.7 -55.4 -42.6 110.9 12.6 -10.2 107 135 A A H X S+ 0 0 0 -4,-1.3 4,-2.6 1,-0.2 -2,-0.2 0.929 109.8 48.8 -62.7 -44.9 110.3 15.0 -13.2 108 136 A N H X S+ 0 0 26 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.892 111.3 50.1 -61.3 -39.1 113.7 16.7 -12.7 109 137 A L H X S+ 0 0 13 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.917 112.6 46.3 -67.4 -41.1 115.5 13.3 -12.6 110 138 A L H X S+ 0 0 1 -4,-2.3 4,-1.6 -5,-0.2 -2,-0.2 0.897 110.7 53.4 -66.8 -40.3 113.8 12.1 -15.7 111 139 A L H X>S+ 0 0 0 -4,-2.6 5,-3.1 -5,-0.2 4,-1.5 0.899 108.5 49.9 -59.7 -42.8 114.6 15.5 -17.4 112 140 A E H <5S+ 0 0 133 -4,-2.1 3,-0.5 1,-0.2 -2,-0.2 0.940 108.2 52.6 -63.4 -43.5 118.3 15.0 -16.5 113 141 A A H <5S+ 0 0 38 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.827 112.0 47.7 -58.7 -31.0 118.2 11.5 -18.0 114 142 A L H <5S- 0 0 10 -4,-1.6 -1,-0.2 -5,-0.1 -2,-0.2 0.757 124.8 -98.7 -79.2 -27.8 116.8 13.0 -21.2 115 143 A G T <5 - 0 0 58 -4,-1.5 3,-0.2 -3,-0.5 -3,-0.2 0.500 67.8 -78.2 113.7 8.4 119.2 15.8 -21.6 116 144 A G S >> S+ 0 0 11 0, 0.0 4,-2.5 0, 0.0 17,-0.4 0.844 132.8 56.4 -51.8 -38.8 114.2 20.9 -21.2 118 146 A A H 3> S+ 0 0 78 -3,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.845 105.9 50.7 -62.5 -35.2 115.8 21.4 -24.6 119 147 A A H <> S+ 0 0 22 -3,-0.9 4,-2.1 2,-0.2 -1,-0.2 0.897 110.4 48.9 -71.9 -37.9 115.9 17.7 -25.2 120 148 A L H X S+ 0 0 2 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.936 111.7 49.7 -65.1 -43.4 112.3 17.3 -24.4 121 149 A T H X S+ 0 0 22 -4,-2.5 4,-2.2 13,-0.3 -2,-0.2 0.913 109.1 52.4 -62.6 -40.6 111.4 20.2 -26.7 122 150 A A H X S+ 0 0 58 -4,-2.3 4,-1.9 2,-0.2 -1,-0.2 0.876 105.6 54.3 -62.0 -40.5 113.5 18.6 -29.5 123 151 A F H X S+ 0 0 33 -4,-2.1 4,-1.1 2,-0.2 -1,-0.2 0.933 108.2 50.0 -58.5 -44.9 111.6 15.3 -29.0 124 152 A L H ><>S+ 0 0 2 -4,-2.1 5,-2.6 1,-0.2 3,-0.6 0.908 109.3 50.8 -59.9 -43.8 108.3 17.3 -29.5 125 153 A R H ><5S+ 0 0 84 -4,-2.2 3,-1.1 1,-0.2 -1,-0.2 0.868 106.1 56.6 -58.9 -36.3 109.6 18.9 -32.7 126 154 A S H 3<5S+ 0 0 88 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.785 106.2 49.6 -70.3 -23.0 110.6 15.5 -34.0 127 155 A I T <<5S- 0 0 50 -4,-1.1 -1,-0.2 -3,-0.6 -2,-0.2 0.363 127.3 -95.6 -96.2 2.0 107.0 14.3 -33.6 128 156 A G T < 5S+ 0 0 55 -3,-1.1 2,-0.8 -4,-0.3 -3,-0.2 0.526 81.5 133.4 99.3 5.9 105.5 17.2 -35.4 129 157 A D < + 0 0 6 -5,-2.6 -1,-0.3 -6,-0.2 -2,-0.2 -0.823 22.3 171.6 -90.7 112.5 104.6 19.5 -32.5 130 158 A E + 0 0 146 -2,-0.8 -1,-0.1 -3,-0.1 -5,-0.1 0.371 69.7 48.1 -97.9 -0.8 106.0 22.9 -33.5 131 159 A V S S+ 0 0 43 -7,-0.1 21,-0.2 23,-0.1 -1,-0.1 0.827 81.0 88.1-110.7 -49.4 104.4 24.8 -30.7 132 160 A T - 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