==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/HYDROLASE INHIBITOR 08-FEB-08 3C7V . COMPND 2 MOLECULE: BETA-LACTAMASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR J.WANG,D.-C.CHOW . 856 4 6 6 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 32609.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 585 68.3 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 . 186 21.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.5 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 . 21 2.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 99 11.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 220 25.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 1.4 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 1 4 0 4 0 5 2 3 2 2 0 0 2 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 . 6 5 3 2 0 6 6 3 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 . 3 1 0 2 0 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 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 61 0, 0.0 3,-1.9 0, 0.0 4,-0.2 0.000 360.0 360.0 360.0 -33.2 30.6 -7.8 66.3 2 27 A P T > + 0 0 87 0, 0.0 3,-1.1 0, 0.0 257,-0.1 0.520 360.0 26.1 -26.0 -90.2 29.1 -10.1 69.0 3 28 A E T >> S+ 0 0 105 1,-0.2 3,-1.1 255,-0.1 4,-0.9 0.480 93.0 96.2 -59.3 -5.8 25.2 -10.7 68.7 4 29 A T H <> S+ 0 0 0 -3,-1.9 4,-2.1 1,-0.2 -1,-0.2 0.772 72.2 66.4 -62.3 -23.8 25.0 -10.1 64.9 5 30 A L H <> S+ 0 0 47 -3,-1.1 4,-1.7 2,-0.2 -1,-0.2 0.766 96.1 53.2 -71.0 -28.0 25.2 -13.8 64.0 6 31 A V H <> S+ 0 0 80 -3,-1.1 4,-3.9 2,-0.2 -1,-0.2 0.883 110.4 49.9 -67.0 -38.6 21.8 -14.8 65.6 7 32 A K H X S+ 0 0 37 -4,-0.9 4,-4.0 2,-0.3 5,-0.2 0.918 108.7 50.4 -66.4 -43.7 20.4 -12.0 63.5 8 33 A V H X S+ 0 0 0 -4,-2.1 4,-1.7 2,-0.2 -1,-0.2 0.872 115.2 45.2 -59.4 -38.8 22.1 -13.4 60.4 9 34 A K H X S+ 0 0 79 -4,-1.7 4,-1.6 2,-0.2 -2,-0.3 0.937 113.4 48.3 -65.8 -50.5 20.6 -16.7 61.4 10 35 A D H >X S+ 0 0 51 -4,-3.9 4,-2.5 1,-0.2 3,-0.5 0.931 110.3 52.4 -55.1 -47.3 17.2 -15.1 62.1 11 36 A A H 3X S+ 0 0 1 -4,-4.0 4,-2.9 1,-0.3 5,-0.3 0.909 106.9 52.3 -57.5 -41.9 17.4 -13.4 58.7 12 37 A E H 3X>S+ 0 0 29 -4,-1.7 4,-0.8 1,-0.2 5,-0.7 0.828 113.6 45.0 -63.2 -30.7 18.0 -16.8 57.1 13 38 A D H <<5S+ 0 0 98 -4,-1.6 -2,-0.2 -3,-0.5 -1,-0.2 0.761 114.0 47.7 -83.7 -28.8 14.9 -18.0 58.9 14 39 A Q H <5S+ 0 0 90 -4,-2.5 -2,-0.2 -5,-0.1 -3,-0.2 0.877 122.2 35.1 -77.3 -40.5 12.8 -15.0 58.0 15 40 A L H <5S- 0 0 12 -4,-2.9 227,-0.7 -5,-0.2 228,-0.4 0.646 96.0-139.2 -88.0 -18.6 13.8 -15.1 54.3 16 41 A G T <5 + 0 0 65 -4,-0.8 2,-0.3 -5,-0.3 -3,-0.2 0.867 69.5 94.3 57.8 38.0 14.0 -18.8 54.1 17 42 A A S -A 232 0A 38 5,-2.2 4,-2.3 -2,-0.3 207,-0.3 -0.822 22.4-147.1 -88.5 117.2 38.9 -5.1 60.3 26 51 A L T 4 S+ 0 0 9 205,-1.9 206,-0.2 -2,-0.7 -1,-0.2 0.889 92.3 42.2 -51.0 -45.9 39.9 -2.4 57.8 27 52 A N T 4 S+ 0 0 131 204,-0.6 -1,-0.2 1,-0.1 205,-0.1 0.972 125.9 27.2 -69.9 -59.0 43.3 -1.8 59.4 28 53 A S T 4 S- 0 0 62 2,-0.1 -2,-0.2 1,-0.0 -1,-0.1 0.867 90.0-135.3 -74.3 -38.9 44.5 -5.3 60.2 29 54 A G < + 0 0 24 -4,-2.3 2,-0.2 1,-0.4 -3,-0.1 0.475 56.0 143.2 92.2 2.8 42.6 -7.2 57.5 30 55 A K - 0 0 156 -5,-0.2 -5,-2.2 1,-0.1 -1,-0.4 -0.568 57.6-112.2 -77.7 141.7 41.7 -9.8 60.2 31 56 A I E -B 24 0A 90 -2,-0.2 -7,-0.2 -7,-0.2 3,-0.1 -0.572 27.4-172.5 -73.8 131.1 38.3 -11.4 60.0 32 57 A L E - 0 0 47 -9,-3.0 2,-0.3 1,-0.4 -8,-0.2 0.800 66.7 -24.7 -92.9 -37.4 36.2 -10.3 63.0 33 58 A E E -B 23 0A 23 -10,-1.4 -10,-2.6 -32,-0.0 -1,-0.4 -0.949 62.9-174.8-169.9 155.9 33.3 -12.7 62.4 34 59 A S E -B 22 0A 47 -2,-0.3 2,-0.3 -12,-0.2 -12,-0.2 -0.992 16.3-161.8-157.8 162.2 31.6 -14.6 59.5 35 60 A F E S-B 21 0A 52 -14,-2.9 -14,-3.2 -2,-0.3 -2,-0.0 -0.931 87.5 -16.5-149.3 119.6 28.7 -16.8 58.4 36 61 A R S > S+ 0 0 81 -2,-0.3 3,-1.0 -16,-0.2 123,-0.1 0.931 80.5 162.7 45.5 50.4 28.9 -18.8 55.2 37 62 A P T 3 + 0 0 25 0, 0.0 122,-2.4 0, 0.0 123,-0.4 0.695 68.1 49.4 -70.8 -16.9 31.8 -16.6 54.2 38 63 A E T 3 S+ 0 0 137 120,-0.2 2,-0.3 119,-0.1 -2,-0.1 -0.023 84.6 101.0-117.0 30.2 32.9 -19.1 51.6 39 64 A E S < S- 0 0 62 -3,-1.0 2,-0.3 117,-0.0 120,-0.1 -0.853 74.9-108.9-106.7 150.3 29.7 -19.8 49.7 40 65 A R + 0 0 57 -2,-0.3 117,-0.2 117,-0.2 110,-0.1 -0.595 37.6 173.9 -82.1 138.9 29.0 -18.2 46.3 41 66 A F E -E 156 0B 1 115,-2.3 115,-2.0 -2,-0.3 2,-0.2 -0.969 41.8 -94.4-137.8 149.5 26.4 -15.5 45.9 42 67 A P E -E 155 0B 12 0, 0.0 113,-0.3 0, 0.0 196,-0.2 -0.500 28.9-147.9 -64.9 129.5 25.5 -13.4 42.8 43 68 A M > + 0 0 2 111,-2.2 3,-1.6 -2,-0.2 112,-0.1 0.839 27.5 176.4 -66.0 -37.9 27.4 -10.1 43.0 44 69 A M G > - 0 0 1 110,-0.5 3,-1.5 100,-0.5 4,-0.2 -0.301 69.6 -17.9 60.8-147.8 24.8 -8.1 41.3 45 70 A S G > S+ 0 0 3 1,-0.3 3,-1.7 167,-0.2 4,-0.3 0.566 120.1 86.4 -66.3 -9.5 25.7 -4.4 41.2 46 71 A T G X> S+ 0 0 0 -3,-1.6 3,-1.1 1,-0.3 4,-0.6 0.762 77.6 70.5 -64.2 -18.7 28.3 -4.7 44.0 47 72 A F H X> S+ 0 0 0 -3,-1.5 4,-2.5 1,-0.2 3,-0.7 0.790 79.0 77.4 -67.1 -25.4 30.7 -5.7 41.2 48 73 A K H <> S+ 0 0 0 -3,-1.7 4,-2.3 1,-0.3 -1,-0.2 0.761 88.7 55.1 -59.6 -25.2 30.7 -2.1 39.9 49 74 A V H <> S+ 0 0 0 -3,-1.1 4,-1.3 -4,-0.3 -1,-0.3 0.867 109.4 47.5 -72.8 -37.3 33.0 -1.0 42.7 50 75 A L H S+ 0 0 70 -4,-1.7 5,-2.8 2,-0.2 6,-1.0 0.903 108.8 51.2 -65.9 -38.1 44.4 1.8 34.7 59 84 A I H ><5S+ 0 0 34 -4,-2.1 3,-1.6 4,-0.2 -2,-0.2 0.917 107.8 53.2 -60.9 -46.4 44.3 5.6 35.3 60 85 A D H 3<5S+ 0 0 59 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.832 109.4 48.7 -55.8 -39.2 47.2 5.2 37.8 61 86 A A T 3<5S- 0 0 70 -4,-1.5 -1,-0.3 -5,-0.1 -2,-0.2 0.188 118.3-109.3 -90.3 14.8 49.3 3.4 35.2 62 87 A G T < 5S+ 0 0 65 -3,-1.6 -3,-0.2 2,-0.2 -2,-0.1 0.619 90.5 114.5 69.7 11.9 48.6 6.0 32.4 63 88 A Q S - 0 0 121 -2,-0.3 3,-2.0 1,-0.1 29,-0.5 -0.982 6.9-151.0-126.4 121.8 42.0 9.1 31.6 66 91 A L T 3 S+ 0 0 23 -2,-0.4 29,-2.5 1,-0.3 30,-0.3 0.832 103.4 50.7 -57.4 -29.7 39.3 10.0 34.1 67 92 A G T 3 S+ 0 0 43 27,-0.2 -1,-0.3 26,-0.2 2,-0.2 0.472 80.4 119.9 -89.2 -2.4 38.6 13.0 31.8 68 93 A R < - 0 0 104 -3,-2.0 26,-2.2 25,-0.1 2,-0.5 -0.466 61.7-132.7 -64.3 133.7 38.3 11.0 28.6 69 94 A R E -F 93 0C 107 24,-0.3 2,-0.5 -2,-0.2 24,-0.3 -0.761 14.0-155.0 -94.6 128.5 34.9 11.4 27.0 70 95 A I E -F 92 0C 22 22,-3.2 22,-1.9 -2,-0.5 2,-0.6 -0.897 3.2-155.4-104.3 126.0 33.0 8.3 25.8 71 96 A H + 0 0 139 -2,-0.5 2,-0.2 20,-0.2 17,-0.1 -0.897 22.8 169.9-101.7 121.9 30.5 8.7 23.1 72 97 A Y - 0 0 22 -2,-0.6 2,-0.2 16,-0.3 19,-0.1 -0.703 17.1-139.0-123.7 177.2 27.8 6.0 23.1 73 98 A S >> - 0 0 61 -2,-0.2 3,-1.5 1,-0.0 4,-0.5 -0.772 36.6 -86.1-132.4 179.2 24.5 5.4 21.3 74 99 A Q G >4 S+ 0 0 29 1,-0.3 3,-1.4 -2,-0.2 -1,-0.0 0.838 119.2 65.9 -52.4 -35.4 21.0 4.2 21.7 75 100 A N G 34 S+ 0 0 72 1,-0.3 -1,-0.3 339,-0.0 337,-0.0 0.834 99.0 53.8 -60.9 -30.2 22.1 0.6 21.0 76 101 A D G <4 S+ 0 0 50 -3,-1.5 -1,-0.3 2,-0.0 2,-0.2 0.657 82.8 107.2 -79.1 -18.3 24.2 0.7 24.3 77 102 A L << + 0 0 0 -3,-1.4 2,-0.2 -4,-0.5 3,-0.1 -0.459 45.1 172.8 -70.5 131.1 21.3 1.7 26.5 78 103 A V - 0 0 0 -2,-0.2 30,-0.3 1,-0.1 29,-0.2 -0.762 42.5 -56.9-127.8 173.0 20.0 -1.1 28.8 79 104 A E S S+ 0 0 15 -2,-0.2 28,-0.2 1,-0.2 -1,-0.1 -0.193 116.4 22.1 -50.9 134.6 17.5 -1.4 31.7 80 105 A Y S S+ 0 0 7 1,-0.1 27,-3.0 26,-0.1 28,-0.2 0.990 75.3 137.9 67.5 65.6 18.2 1.0 34.7 81 106 A S > + 0 0 0 25,-0.2 4,-1.9 26,-0.2 5,-0.3 -0.478 8.6 154.8-136.4 62.2 20.3 3.8 33.1 82 107 A P H > S+ 0 0 1 0, 0.0 4,-0.9 0, 0.0 -1,-0.1 0.876 78.1 37.8 -61.5 -38.3 19.1 7.1 34.6 83 108 A V H > S+ 0 0 2 2,-0.2 4,-1.5 1,-0.1 3,-0.2 0.950 116.8 47.2 -81.7 -47.6 22.4 9.0 34.1 84 109 A T H 4 S+ 0 0 0 1,-0.2 7,-0.2 2,-0.2 -1,-0.1 0.838 108.9 55.8 -62.2 -35.4 23.6 7.6 30.7 85 110 A E H >< S+ 0 0 15 -4,-1.9 3,-1.0 1,-0.2 -1,-0.2 0.906 107.8 49.5 -62.1 -42.9 20.1 8.0 29.1 86 111 A K H 3< S+ 0 0 42 -4,-0.9 3,-0.3 -5,-0.3 -1,-0.2 0.806 115.6 42.5 -67.5 -31.2 20.2 11.8 30.0 87 112 A H T 3X S+ 0 0 22 -4,-1.5 4,-2.5 1,-0.2 -1,-0.2 0.179 77.7 117.2-101.6 17.4 23.7 12.3 28.6 88 113 A L T <4 S+ 0 0 35 -3,-1.0 -16,-0.3 1,-0.2 -1,-0.2 0.848 76.4 45.9 -54.0 -39.3 23.1 10.3 25.5 89 114 A T T 4 S+ 0 0 104 -3,-0.3 -1,-0.2 -4,-0.2 -2,-0.1 0.914 123.4 30.9 -72.5 -42.4 23.7 13.2 23.1 90 115 A D T 4 S- 0 0 66 1,-0.2 -2,-0.2 -19,-0.0 -1,-0.2 0.606 101.2-139.0 -93.0 -13.0 26.8 14.7 24.7 91 116 A G < - 0 0 0 -4,-2.5 2,-0.3 -7,-0.2 -1,-0.2 -0.342 16.6-100.4 81.1-171.5 28.4 11.5 26.1 92 117 A M E -F 70 0C 2 -22,-1.9 -22,-3.2 -4,-0.1 2,-0.1 -0.992 22.0-115.2-150.8 147.4 30.1 11.1 29.4 93 118 A T E > -F 69 0C 16 -2,-0.3 4,-2.2 -24,-0.3 3,-0.3 -0.407 36.3-106.8 -80.3 161.3 33.7 11.1 30.8 94 119 A V H > S+ 0 0 0 -26,-2.2 4,-2.0 -29,-0.5 5,-0.2 0.884 123.2 53.6 -53.9 -39.3 35.2 8.0 32.4 95 120 A R H > S+ 0 0 106 -29,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.888 108.2 48.5 -63.5 -41.4 34.9 9.7 35.7 96 121 A E H > S+ 0 0 71 -30,-0.3 4,-2.4 -3,-0.3 -1,-0.2 0.843 108.1 56.4 -70.1 -31.2 31.2 10.5 35.2 97 122 A L H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.915 109.3 44.4 -67.5 -42.9 30.6 6.8 34.2 98 123 A a H X S+ 0 0 0 -4,-2.0 4,-2.8 2,-0.2 5,-0.4 0.895 111.7 53.3 -67.8 -38.9 32.0 5.5 37.5 99 124 A S H X>S+ 0 0 34 -4,-2.0 4,-2.3 1,-0.2 5,-0.6 0.941 114.5 41.7 -61.9 -45.1 30.1 8.1 39.4 100 125 A A H X5S+ 0 0 0 -4,-2.4 6,-2.4 3,-0.2 4,-1.2 0.889 115.1 50.8 -65.7 -43.0 26.9 7.0 37.7 101 126 A A H <5S+ 0 0 0 -4,-2.6 4,-0.3 4,-0.3 -2,-0.2 0.915 122.2 30.7 -62.7 -43.1 27.7 3.3 38.0 102 127 A I H <5S+ 0 0 0 -4,-2.8 108,-0.2 -5,-0.2 -2,-0.2 0.955 127.3 35.1 -84.6 -51.7 28.5 3.4 41.7 103 128 A T H <5S+ 0 0 7 -4,-2.3 87,-2.0 -5,-0.4 88,-0.5 0.813 136.4 22.3 -75.6 -29.8 26.3 6.2 43.1 104 129 A M S < - 0 0 0 -6,-2.4 4,-1.3 1,-0.1 -25,-0.2 -0.406 14.1-158.8 -60.0 120.2 23.6 2.9 36.2 107 132 A N H > S+ 0 0 4 -27,-3.0 4,-2.3 -2,-0.2 34,-0.3 0.873 87.4 50.7 -74.9 -41.5 23.8 -0.2 34.1 108 133 A T H > S+ 0 0 0 -30,-0.3 4,-2.9 -28,-0.2 5,-0.2 0.893 107.6 55.8 -63.7 -37.9 24.8 1.3 30.7 109 134 A A H > S+ 0 0 0 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.933 108.4 48.2 -60.2 -43.5 27.6 3.1 32.5 110 135 A A H X S+ 0 0 0 -4,-1.3 4,-2.4 2,-0.2 -2,-0.2 0.929 111.7 48.5 -63.5 -44.8 28.9 -0.2 33.8 111 136 A N H X S+ 0 0 14 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.921 112.2 49.8 -61.5 -39.9 28.7 -1.8 30.4 112 137 A L H X S+ 0 0 17 -4,-2.9 4,-1.8 1,-0.2 -2,-0.2 0.949 112.0 47.8 -62.4 -47.3 30.5 1.2 28.9 113 138 A L H X S+ 0 0 0 -4,-2.8 4,-0.8 1,-0.2 -1,-0.2 0.833 108.6 54.4 -62.3 -36.6 33.2 0.9 31.5 114 139 A L H >X>S+ 0 0 0 -4,-2.4 5,-3.4 1,-0.2 4,-0.9 0.889 105.8 53.2 -62.8 -40.2 33.6 -2.8 31.0 115 140 A T H ><5S+ 0 0 87 -4,-1.9 3,-0.8 1,-0.2 -2,-0.2 0.911 102.6 58.2 -63.1 -40.5 34.1 -2.2 27.3 116 141 A T H 3<5S+ 0 0 26 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.742 113.2 39.7 -60.7 -24.4 37.0 0.3 28.2 117 142 A I H <<5S- 0 0 18 -4,-0.8 -1,-0.2 -3,-0.6 -2,-0.2 0.512 126.5 -91.3-103.7 -6.3 38.8 -2.5 30.0 118 143 A G T <<5 - 0 0 51 -4,-0.9 3,-0.3 -3,-0.8 -3,-0.2 0.522 69.1 -79.6 109.7 5.0 38.2 -5.4 27.7 119 144 A G S >> S+ 0 0 7 0, 0.0 4,-2.1 0, 0.0 17,-0.5 0.804 130.5 59.5 -49.3 -38.0 34.0 -9.2 32.0 121 146 A K H 3> S+ 0 0 171 -3,-0.3 4,-2.6 1,-0.2 -2,-0.1 0.866 104.7 49.6 -61.5 -35.5 37.0 -11.5 31.4 122 147 A E H <> S+ 0 0 100 -3,-1.1 4,-2.5 2,-0.2 -1,-0.2 0.837 108.6 51.3 -76.4 -29.5 39.5 -8.6 31.9 123 148 A L H X S+ 0 0 1 -4,-1.3 4,-2.3 2,-0.2 -1,-0.2 0.909 112.7 48.0 -68.6 -40.4 37.9 -7.6 35.2 124 149 A T H X S+ 0 0 38 -4,-2.1 4,-3.4 13,-0.3 -2,-0.2 0.930 111.2 49.0 -64.1 -44.9 38.2 -11.2 36.3 125 150 A A H X S+ 0 0 34 -4,-2.6 4,-2.7 1,-0.2 -2,-0.2 0.919 110.5 52.1 -61.4 -43.5 41.8 -11.3 35.1 126 151 A F H X S+ 0 0 38 -4,-2.5 4,-0.9 2,-0.2 -1,-0.2 0.920 113.3 43.9 -55.1 -47.9 42.4 -8.1 37.0 127 152 A L H ><>S+ 0 0 0 -4,-2.3 5,-1.9 2,-0.2 3,-1.1 0.956 111.9 52.2 -64.1 -49.2 40.9 -9.6 40.2 128 153 A H H ><5S+ 0 0 96 -4,-3.4 3,-1.8 1,-0.3 -2,-0.2 0.930 107.2 55.1 -53.6 -44.9 42.8 -12.9 39.7 129 154 A N H 3<5S+ 0 0 132 -4,-2.7 -1,-0.3 1,-0.3 -2,-0.2 0.714 103.2 54.2 -62.6 -26.7 46.0 -10.9 39.4 130 155 A M T <<5S- 0 0 28 -3,-1.1 -1,-0.3 -4,-0.9 -2,-0.2 0.137 129.9 -89.8 -95.4 19.7 45.5 -9.1 42.8 131 156 A G T < 5S+ 0 0 44 -3,-1.8 2,-0.8 1,-0.2 -3,-0.2 0.335 91.0 122.2 96.7 -7.9 45.1 -12.4 44.7 132 157 A D < + 0 0 7 -5,-1.9 -1,-0.2 -6,-0.2 -2,-0.2 -0.808 23.1 163.8 -90.8 107.9 41.3 -13.0 44.3 133 158 A H + 0 0 125 -2,-0.8 -1,-0.1 -3,-0.1 -5,-0.1 0.179 68.3 57.7-109.0 16.9 40.7 -16.3 42.6 134 159 A V S S+ 0 0 34 23,-0.1 21,-0.2 -7,-0.1 2,-0.1 0.807 81.4 83.2-109.4 -51.3 37.1 -16.6 43.6 135 160 A T + 0 0 3 22,-0.1 2,-0.4 19,-0.1 21,-0.2 -0.319 56.1 175.9 -63.9 132.5 35.3 -13.6 42.2 136 161 A R - 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