==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/HYDROLASE INHIBITOR 01-FEB-09 3G34 . COMPND 2 MOLECULE: BETA-LACTAMASE CTX-M-9A; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR Y.CHEN,B.K.SHOICHET . 523 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21434.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 376 71.9 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 . 82 15.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 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 . 9 1.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 80 15.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 168 32.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 1.7 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 4 2 6 4 0 0 0 0 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 2 2 0 2 2 2 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 . 4 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 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 T 0 0 95 0, 0.0 2,-0.2 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 126.8 18.4 74.1 1.0 2 27 A S > - 0 0 47 1,-0.1 4,-2.2 410,-0.0 5,-0.1 -0.476 360.0-107.0 -95.0 169.3 20.5 70.9 1.3 3 28 A A H > S+ 0 0 51 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.886 123.2 51.2 -60.6 -41.4 20.9 67.9 -1.0 4 29 A V H > S+ 0 0 21 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.923 109.1 50.1 -61.6 -45.5 18.8 65.9 1.4 5 30 A Q H > S+ 0 0 56 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.877 110.1 50.9 -61.9 -37.6 16.1 68.5 1.4 6 31 A Q H X S+ 0 0 96 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.885 109.9 49.2 -67.7 -38.7 16.1 68.6 -2.4 7 32 A K H X S+ 0 0 96 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.916 111.7 49.2 -64.3 -42.9 15.7 64.8 -2.5 8 33 A L H X S+ 0 0 0 -4,-2.6 4,-2.7 1,-0.2 -2,-0.2 0.890 109.4 52.8 -63.5 -37.8 12.8 65.0 -0.0 9 34 A A H X S+ 0 0 34 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.890 109.5 48.7 -63.1 -39.5 11.2 67.7 -2.2 10 35 A A H X S+ 0 0 55 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.905 111.4 49.5 -67.7 -42.4 11.5 65.5 -5.2 11 36 A L H X S+ 0 0 28 -4,-2.5 4,-0.9 2,-0.2 -2,-0.2 0.943 111.9 49.0 -58.0 -48.7 9.9 62.6 -3.3 12 37 A E H >X S+ 0 0 17 -4,-2.7 4,-0.9 1,-0.2 3,-0.9 0.923 108.3 53.5 -58.3 -45.8 7.1 64.9 -2.2 13 38 A K H >< S+ 0 0 185 -4,-2.5 3,-0.6 1,-0.3 -1,-0.2 0.910 112.0 44.2 -57.7 -43.8 6.5 66.2 -5.7 14 39 A S H 3< S+ 0 0 107 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.603 106.7 63.2 -75.1 -13.1 6.1 62.6 -7.0 15 40 A S H << S- 0 0 9 -4,-0.9 -1,-0.2 -3,-0.9 -2,-0.2 0.686 94.8-135.8 -86.2 -22.5 3.9 61.6 -4.1 16 41 A G S << S+ 0 0 57 -4,-0.9 -3,-0.1 -3,-0.6 -4,-0.1 0.189 74.7 77.5 83.4 -14.7 1.0 64.0 -4.8 17 42 A G S S- 0 0 14 -5,-0.4 2,-0.5 222,-0.1 -1,-0.3 -0.178 88.0 -84.6-112.2-160.3 0.9 64.9 -1.1 18 43 A R E -A 238 0A 68 220,-3.1 220,-2.1 -3,-0.1 2,-0.4 -0.972 38.4-161.3-119.7 126.4 2.6 67.0 1.6 19 44 A L E -A 237 0A 0 -2,-0.5 2,-0.4 218,-0.2 218,-0.2 -0.873 7.7-171.4-114.4 135.0 5.6 65.6 3.4 20 45 A G E +A 236 0A 0 216,-3.0 216,-3.1 -2,-0.4 2,-0.4 -0.997 10.0 177.8-126.4 131.8 7.1 66.7 6.8 21 46 A V E +AB 235 34A 0 13,-2.7 13,-2.7 -2,-0.4 2,-0.4 -0.993 10.8 177.7-134.5 137.1 10.4 65.3 8.1 22 47 A A E -AB 234 33A 1 212,-2.0 212,-2.5 -2,-0.4 2,-0.4 -0.947 6.2-176.9-138.2 125.6 12.5 66.0 11.1 23 48 A L E -AB 233 32A 6 9,-2.6 9,-1.5 -2,-0.4 2,-0.5 -0.949 8.4-169.2-112.4 134.7 15.7 64.2 12.0 24 49 A I E -AB 232 31A 3 208,-2.6 208,-2.4 -2,-0.4 2,-0.8 -0.994 8.7-160.1-115.7 122.2 17.8 64.7 15.1 25 50 A D E >>> -AB 231 30A 7 5,-2.7 4,-2.2 -2,-0.5 3,-1.3 -0.893 2.2-161.9 -97.3 108.6 21.1 63.0 14.9 26 51 A T T 345S+ 0 0 27 204,-2.0 205,-0.1 -2,-0.8 -1,-0.1 0.533 79.5 82.0 -73.9 -1.9 22.3 62.6 18.5 27 52 A A T 345S- 0 0 61 202,-0.3 -1,-0.3 203,-0.2 204,-0.1 0.855 125.5 -6.3 -61.4 -35.1 25.9 62.1 17.3 28 53 A D T <45S- 0 0 90 -3,-1.3 -2,-0.2 2,-0.1 -1,-0.1 0.317 95.7-112.4-143.1 1.1 26.2 65.9 17.0 29 54 A N T <5 + 0 0 92 -4,-2.2 -3,-0.2 1,-0.2 2,-0.1 0.618 67.2 147.0 67.6 16.4 22.6 67.2 17.7 30 55 A T E < -B 25 0A 75 -5,-0.7 -5,-2.7 -6,-0.1 2,-0.3 -0.383 33.5-146.3 -79.7 163.1 22.3 68.4 14.2 31 56 A Q E -B 24 0A 86 -7,-0.2 2,-0.5 -3,-0.1 -7,-0.2 -0.944 15.8-155.7-134.3 146.6 18.9 68.3 12.4 32 57 A V E -B 23 0A 36 -9,-1.5 -9,-2.6 -2,-0.3 2,-0.4 -0.999 24.5-174.7-119.0 125.5 17.4 67.8 9.0 33 59 A L E +B 22 0A 27 -2,-0.5 2,-0.4 -11,-0.2 -11,-0.2 -0.956 18.6 179.1-122.2 139.3 14.0 69.5 8.5 34 60 A Y E S-B 21 0A 27 -13,-2.7 -13,-2.7 -2,-0.4 4,-0.1 -0.950 90.6 -17.8-135.2 117.0 11.6 69.4 5.6 35 61 A R S > S+ 0 0 88 -2,-0.4 3,-1.6 -15,-0.2 123,-0.1 0.885 90.5 163.2 49.6 41.6 8.4 71.4 6.3 36 62 A G T 3 + 0 0 5 1,-0.3 122,-2.4 121,-0.1 123,-0.4 0.702 67.2 42.2 -65.9 -21.0 9.7 71.1 9.9 37 63 A D T 3 S+ 0 0 100 120,-0.1 2,-0.3 119,-0.1 -1,-0.3 0.216 91.4 103.2-113.2 13.1 7.5 73.9 11.2 38 64 A E S < S- 0 0 66 -3,-1.6 2,-0.2 -4,-0.1 120,-0.1 -0.725 74.0-113.4 -92.0 148.4 4.3 73.1 9.3 39 65 A R + 0 0 91 -2,-0.3 117,-0.2 117,-0.2 110,-0.2 -0.573 33.8 179.2 -84.2 142.1 1.4 71.4 11.1 40 66 A F E -E 155 0B 1 115,-2.4 115,-1.8 -2,-0.2 2,-0.3 -0.981 37.9-100.2-135.9 148.3 0.3 67.8 10.3 41 67 A P E -E 154 0B 10 0, 0.0 113,-0.3 0, 0.0 196,-0.2 -0.538 29.4-153.4 -68.6 130.8 -2.4 65.7 11.8 42 68 A M > + 0 0 0 111,-2.5 3,-1.9 -2,-0.3 112,-0.1 0.816 22.2 175.0 -74.6 -33.4 -0.8 63.3 14.3 43 69 A C G > S- 0 0 0 110,-0.5 3,-2.0 100,-0.5 -1,-0.2 -0.274 73.3 -10.7 47.8-139.0 -3.3 60.5 14.1 44 70 A S G > S+ 0 0 7 167,-0.3 3,-1.9 1,-0.3 4,-0.3 0.584 120.2 82.3 -69.7 -6.8 -2.0 57.5 16.2 45 71 A T G X S+ 0 0 0 -3,-1.9 3,-1.4 1,-0.3 4,-0.5 0.797 79.9 71.3 -63.2 -21.2 1.4 59.0 16.7 46 72 A S G <> S+ 0 0 0 -3,-2.0 4,-1.7 1,-0.3 3,-0.3 0.679 76.8 79.6 -64.9 -16.7 -0.3 61.0 19.5 47 73 A K H <> S+ 0 0 0 -3,-1.9 4,-2.7 1,-0.2 -1,-0.3 0.797 84.0 62.4 -62.4 -28.0 -0.5 57.7 21.4 48 74 A V H <> S+ 0 0 2 -3,-1.4 4,-2.5 -4,-0.3 -1,-0.2 0.936 103.8 46.8 -61.6 -45.3 3.2 58.2 22.4 49 75 A M H > S+ 0 0 1 -4,-0.5 4,-2.0 -3,-0.3 -2,-0.2 0.908 114.0 47.7 -64.3 -41.7 2.4 61.4 24.2 50 76 A A H X S+ 0 0 0 -4,-1.7 4,-1.9 2,-0.2 -2,-0.2 0.930 113.5 46.4 -65.8 -45.5 -0.5 59.8 26.0 51 77 A A H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.917 113.3 50.2 -62.5 -40.7 1.4 56.7 27.1 52 78 A A H X S+ 0 0 0 -4,-2.5 4,-2.5 -5,-0.2 -1,-0.2 0.873 107.2 54.5 -64.9 -36.8 4.3 58.9 28.2 53 79 A A H X S+ 0 0 3 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.893 109.6 46.7 -65.7 -39.4 2.0 61.1 30.2 54 80 A V H X S+ 0 0 0 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.907 110.1 53.8 -68.2 -41.2 0.7 58.0 32.1 55 81 A L H X S+ 0 0 1 -4,-2.5 4,-0.6 2,-0.2 -2,-0.2 0.918 107.3 51.9 -55.5 -42.7 4.3 56.8 32.6 56 82 A K H >< S+ 0 0 66 -4,-2.5 3,-1.4 1,-0.2 4,-0.4 0.935 107.8 50.9 -60.5 -45.3 5.0 60.2 34.2 57 83 A Q H >X S+ 0 0 54 -4,-2.1 3,-1.4 1,-0.3 4,-0.6 0.877 103.2 60.9 -57.5 -37.3 2.0 59.8 36.5 58 84 A S H 3< S+ 0 0 9 -4,-2.1 -1,-0.3 1,-0.3 6,-0.2 0.656 86.4 75.0 -67.6 -14.8 3.4 56.4 37.5 59 85 A E T << S+ 0 0 67 -3,-1.4 -1,-0.3 -4,-0.6 3,-0.2 0.796 108.4 31.6 -66.4 -27.8 6.6 58.0 38.8 60 86 A T T <4 S+ 0 0 129 -3,-1.4 2,-0.3 -4,-0.4 -1,-0.2 0.438 123.3 50.4-108.9 -3.0 4.6 59.2 41.8 61 87 A Q >< - 0 0 88 -4,-0.6 3,-2.2 1,-0.1 4,-0.3 -0.803 66.9-172.3-132.5 91.6 2.2 56.2 41.9 62 88 A K T 3 S+ 0 0 184 -2,-0.3 3,-0.2 1,-0.3 -1,-0.1 0.708 86.1 45.7 -61.0 -22.8 4.3 53.1 41.7 63 89 A Q T > S+ 0 0 127 1,-0.1 3,-1.5 2,-0.1 4,-0.3 0.372 81.1 103.3 -99.1 4.0 1.2 50.8 41.3 64 90 A L G X S+ 0 0 2 -3,-2.2 3,-2.0 1,-0.3 29,-0.5 0.869 74.6 57.5 -58.8 -41.4 -0.5 53.0 38.6 65 91 A L G 3 S+ 0 0 30 -4,-0.3 29,-2.6 1,-0.3 30,-0.4 0.709 105.4 52.9 -65.9 -17.7 0.4 50.7 35.7 66 92 A N G < S+ 0 0 94 -3,-1.5 -1,-0.3 27,-0.2 -2,-0.2 0.430 81.4 120.2 -93.0 -0.4 -1.4 47.8 37.5 67 93 A Q < - 0 0 78 -3,-2.0 26,-1.3 -4,-0.3 2,-0.1 -0.475 63.7-126.8 -69.6 126.1 -4.6 49.8 38.0 68 94 A P E -F 92 0C 83 0, 0.0 2,-0.4 0, 0.0 24,-0.2 -0.462 20.4-163.7 -76.6 146.5 -7.6 48.1 36.3 69 95 A V E -F 91 0C 28 22,-2.0 22,-2.2 -2,-0.1 2,-0.2 -1.000 22.0-121.1-129.7 128.8 -9.8 50.0 33.8 70 96 A E E -F 90 0C 123 -2,-0.4 2,-0.6 20,-0.2 20,-0.2 -0.461 18.6-156.0 -72.1 135.9 -13.2 48.7 32.9 71 97 A I E -F 89 0C 0 18,-2.6 17,-2.8 15,-0.4 18,-0.6 -0.969 16.0-174.2-113.4 115.7 -13.8 48.0 29.2 72 98 A K >> - 0 0 83 -2,-0.6 3,-2.0 15,-0.2 4,-0.6 -0.748 38.8-110.3-108.1 155.8 -17.5 48.2 28.2 73 99 A P G >4 S+ 0 0 74 0, 0.0 3,-1.3 0, 0.0 -1,-0.1 0.881 119.6 57.1 -49.0 -41.1 -19.2 47.4 24.9 74 100 A A G 34 S+ 0 0 96 1,-0.2 -3,-0.0 -3,-0.0 0, 0.0 0.675 95.9 66.6 -64.8 -18.7 -19.9 51.1 24.5 75 101 A D G <4 S+ 0 0 46 -3,-2.0 -1,-0.2 8,-0.1 35,-0.1 0.722 75.2 105.1 -76.2 -23.4 -16.2 51.9 24.8 76 102 A L << + 0 0 55 -3,-1.3 2,-0.1 -4,-0.6 4,-0.0 -0.377 46.6 175.4 -64.6 131.4 -15.3 50.1 21.5 77 103 A V - 0 0 47 -2,-0.1 3,-0.2 2,-0.0 -1,-0.1 0.067 51.2 -55.4-109.7-134.5 -14.5 52.5 18.7 78 104 A N S S+ 0 0 100 1,-0.3 2,-0.2 -2,-0.1 -2,-0.1 0.499 122.1 28.4 -97.4 -6.2 -13.2 51.8 15.1 79 105 A Y + 0 0 123 1,-0.0 27,-3.0 0, 0.0 28,-0.6 -0.710 62.4 147.7-158.7 100.7 -10.1 49.8 15.7 80 106 A N > + 0 0 17 25,-0.2 4,-2.2 -2,-0.2 5,-0.2 -0.400 2.2 156.3-138.1 53.2 -9.8 47.7 18.9 81 107 A P T 4 S+ 0 0 33 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.775 86.4 24.8 -60.6 -28.3 -7.7 44.6 18.2 82 108 A I T >4 S+ 0 0 26 -3,-0.1 3,-1.5 2,-0.1 4,-0.4 0.847 119.3 54.6 -99.4 -48.6 -6.8 44.1 21.9 83 109 A A G >4 S+ 0 0 0 1,-0.3 3,-1.8 2,-0.2 4,-0.3 0.822 97.0 65.8 -59.7 -33.1 -9.7 45.9 23.8 84 110 A E G >< S+ 0 0 115 -4,-2.2 3,-0.7 1,-0.3 -1,-0.3 0.794 96.8 57.3 -61.7 -25.5 -12.4 43.8 22.0 85 111 A K G < S+ 0 0 150 -3,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.671 109.3 45.8 -74.8 -16.6 -11.0 40.7 23.8 86 112 A H G X S+ 0 0 52 -3,-1.8 3,-2.1 -4,-0.4 -15,-0.4 0.240 75.5 139.9-114.8 9.9 -11.5 42.4 27.2 87 113 A V T < S+ 0 0 36 -3,-0.7 -15,-0.2 -4,-0.3 3,-0.1 -0.297 76.8 19.1 -57.3 138.8 -15.0 43.8 26.8 88 114 A N T 3 S+ 0 0 116 -17,-2.8 -1,-0.3 1,-0.3 2,-0.2 0.534 125.6 67.3 68.3 10.0 -17.0 43.4 30.1 89 115 A G E < S-F 71 0C 30 -3,-2.1 -18,-2.6 -18,-0.6 -1,-0.3 -0.397 85.7 -96.0-128.3-151.2 -13.7 42.9 31.9 90 116 A T E -F 70 0C 68 -20,-0.2 2,-0.3 -2,-0.2 -20,-0.2 -0.924 15.8-158.6-135.0 158.8 -10.7 45.1 32.6 91 117 A M E -F 69 0C 0 -22,-2.2 -22,-2.0 -2,-0.3 2,-0.1 -0.985 26.5-122.3-130.2 143.1 -7.3 46.0 31.3 92 118 A T E > -F 68 0C 31 -2,-0.3 4,-2.7 -24,-0.2 5,-0.2 -0.408 29.3-108.1 -75.2 162.8 -4.5 47.5 33.4 93 119 A L H > S+ 0 0 0 -26,-1.3 4,-2.3 -29,-0.5 -27,-0.2 0.862 123.3 53.5 -60.4 -32.8 -3.0 50.9 32.4 94 120 A A H > S+ 0 0 24 -29,-2.6 4,-2.8 2,-0.2 5,-0.2 0.939 109.6 47.4 -62.0 -46.8 0.2 48.9 31.4 95 121 A E H > S+ 0 0 87 -30,-0.4 4,-2.4 1,-0.2 -2,-0.2 0.893 113.1 48.7 -62.8 -38.8 -1.9 46.7 29.2 96 122 A L H X S+ 0 0 0 -4,-2.7 4,-2.7 2,-0.2 -1,-0.2 0.898 111.4 49.4 -67.8 -40.1 -3.7 49.7 27.7 97 123 A S H X S+ 0 0 0 -4,-2.3 4,-2.7 -5,-0.2 5,-0.3 0.933 113.5 46.0 -63.8 -46.4 -0.4 51.5 27.1 98 124 A A H X S+ 0 0 21 -4,-2.8 4,-3.0 2,-0.2 5,-0.5 0.907 113.9 49.0 -62.7 -41.9 1.1 48.4 25.4 99 125 A A H X S+ 0 0 4 -4,-2.4 6,-1.9 -5,-0.2 4,-1.6 0.921 113.8 46.2 -65.4 -44.5 -2.1 47.9 23.3 100 126 A A H X S+ 0 0 0 -4,-2.7 4,-0.9 4,-0.3 -2,-0.2 0.949 121.6 36.2 -59.3 -50.3 -2.1 51.5 22.2 101 127 A L H < S+ 0 0 1 -4,-2.7 108,-0.2 -5,-0.2 -2,-0.2 0.925 126.1 33.9 -74.5 -44.4 1.6 51.7 21.3 102 128 A Q H < S+ 0 0 35 -4,-3.0 87,-2.1 -5,-0.3 88,-0.3 0.734 134.9 21.7 -91.6 -22.4 2.2 48.2 19.9 103 129 A Y H < S- 0 0 92 -4,-1.6 -3,-0.2 -5,-0.5 -2,-0.2 0.373 96.4-123.2-121.0 -3.4 -1.2 47.5 18.2 104 130 A S < - 0 0 14 -4,-0.9 2,-0.4 -5,-0.3 -4,-0.3 0.856 40.7-175.8 58.9 38.0 -2.5 51.1 17.8 105 131 A D > - 0 0 0 -6,-1.9 4,-1.8 1,-0.2 -25,-0.2 -0.520 15.6-161.2 -69.8 120.0 -5.6 50.1 19.7 106 132 A N H > S+ 0 0 10 -27,-3.0 4,-1.9 -2,-0.4 34,-0.3 0.807 88.9 54.0 -78.4 -30.9 -7.9 53.1 19.6 107 133 A T H > S+ 0 0 0 -28,-0.6 4,-1.8 2,-0.2 -1,-0.2 0.924 108.0 52.4 -63.7 -43.9 -10.1 52.1 22.6 108 134 A A H > S+ 0 0 0 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.925 107.1 52.4 -58.0 -44.6 -6.9 51.7 24.6 109 135 A M H X S+ 0 0 0 -4,-1.8 4,-2.8 1,-0.2 -1,-0.2 0.923 105.6 54.5 -56.1 -44.8 -5.9 55.3 23.6 110 136 A N H X S+ 0 0 32 -4,-1.9 4,-2.4 1,-0.2 -1,-0.2 0.875 107.1 51.1 -60.7 -34.1 -9.3 56.6 24.8 111 137 A K H X S+ 0 0 37 -4,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.888 109.7 49.6 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