==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-MAR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 23-JAN-12 4DFD . COMPND 2 MOLECULE: PUTATIVE HALOACID DEHALOGENASE-LIKE HYDROLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BACTEROIDES THETAIOTAOMICRON; . AUTHOR Y.PATSKOVSKY,R.TORO,R.BHOSLE,B.HILLERICH,R.D.SEIDEL,E.WASHIN . 403 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19760.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 285 70.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 42 10.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 8 2.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 1.0 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 . 21 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 56 13.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 139 34.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 4.0 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 6 0 1 1 0 4 6 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 2 6 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 . 4 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 -2 A F 0 0 62 0, 0.0 6,-0.0 0, 0.0 203,-0.0 0.000 360.0 360.0 360.0 360.0 20.1 40.1 11.8 2 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 3 3 A S 0 0 122 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -30.0 23.5 41.5 12.8 4 4 A K - 0 0 123 2,-0.1 0, 0.0 166,-0.0 0, 0.0 0.268 360.0-109.0-105.4 9.2 23.2 38.2 14.9 5 5 A G + 0 0 46 1,-0.2 2,-0.6 2,-0.0 0, 0.0 0.872 55.2 173.8 64.9 38.1 24.5 36.0 12.0 6 6 A I + 0 0 12 1,-0.2 -1,-0.2 165,-0.0 165,-0.2 -0.668 16.0 160.7 -80.4 122.2 21.0 34.5 11.6 7 7 A K + 0 0 123 163,-2.7 100,-2.3 -2,-0.6 2,-0.3 0.675 60.2 46.1-108.7 -21.8 20.9 32.1 8.6 8 8 A N E -ab 107 171A 9 162,-1.9 164,-2.7 98,-0.2 2,-0.4 -0.937 58.6-157.6-129.2 144.5 17.8 30.1 9.4 9 9 A L E -ab 108 172A 0 98,-2.3 100,-3.1 -2,-0.3 2,-0.5 -0.974 3.6-160.5-119.9 132.6 14.2 30.8 10.6 10 10 A L E -ab 109 173A 0 162,-2.6 164,-2.3 -2,-0.4 2,-0.5 -0.980 18.8-164.0-108.4 123.0 12.0 28.2 12.3 11 11 A I E -ab 110 174A 0 98,-2.6 100,-2.3 -2,-0.5 164,-0.2 -0.929 11.8-137.7-116.5 128.4 8.4 29.4 12.0 12 12 A D - 0 0 11 162,-2.4 100,-0.2 -2,-0.5 163,-0.0 -0.382 8.9-148.3 -72.7 157.4 5.5 28.0 14.1 13 13 A L S >>S+ 0 0 7 98,-0.3 4,-2.5 3,-0.1 5,-2.4 0.908 71.4 71.9 -94.1 -61.0 2.2 27.4 12.3 14 14 A G B 45S-e 18 0B 19 1,-0.2 2,-2.5 3,-0.2 162,-0.4 -0.319 120.6 -13.2 -62.8 131.5 -0.7 28.0 14.8 15 15 A G T 45S+ 0 0 19 3,-2.7 182,-0.2 1,-0.2 -1,-0.2 -0.319 130.6 68.0 76.9 -61.9 -1.2 31.7 15.6 16 16 A V T 45S+ 0 0 1 -2,-2.5 184,-0.2 1,-0.1 -1,-0.2 0.884 127.8 0.1 -58.3 -41.2 2.1 32.8 14.0 17 17 A L T <5S+ 0 0 0 -4,-2.5 2,-0.5 1,-0.3 -3,-0.2 0.743 130.8 47.2-111.6 -54.3 0.8 31.9 10.5 18 18 A I B + 0 0 57 66,-2.3 4,-1.7 -2,-0.3 5,-0.2 -0.725 10.0 175.2-146.4 86.4 -10.9 29.8 16.4 22 22 A R H > S+ 0 0 54 -2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.911 81.5 54.4 -60.2 -41.3 -11.4 27.5 19.4 23 23 A E H > S+ 0 0 152 1,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.926 106.1 50.0 -63.9 -46.9 -15.1 28.6 19.9 24 24 A R H > S+ 0 0 83 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.902 111.0 50.5 -56.5 -43.1 -16.2 27.9 16.4 25 25 A C H X S+ 0 0 0 -4,-1.7 4,-1.9 61,-0.2 -1,-0.2 0.897 111.4 48.4 -62.7 -42.2 -14.6 24.4 16.7 26 26 A I H X S+ 0 0 6 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.950 112.2 48.3 -62.1 -51.0 -16.4 23.8 20.0 27 27 A E H X S+ 0 0 90 -4,-2.9 4,-3.1 1,-0.2 3,-0.3 0.947 111.1 49.5 -56.9 -51.8 -19.8 25.0 18.6 28 28 A N H X S+ 0 0 37 -4,-2.7 4,-1.9 1,-0.3 -1,-0.2 0.838 110.3 52.3 -58.6 -34.9 -19.5 22.8 15.4 29 29 A F H <>S+ 0 0 0 -4,-1.9 5,-2.7 -5,-0.2 -1,-0.3 0.861 109.8 47.6 -69.2 -35.1 -18.6 19.8 17.6 30 30 A K H ><5S+ 0 0 59 -4,-2.1 3,-3.2 -3,-0.3 -2,-0.2 0.974 108.0 57.7 -66.5 -50.0 -21.7 20.4 19.8 31 31 A K H 3<5S+ 0 0 153 -4,-3.1 -2,-0.2 1,-0.3 -1,-0.2 0.885 103.6 49.9 -43.3 -53.8 -23.8 20.8 16.6 32 32 A I T 3<5S- 0 0 28 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.2 0.469 132.9 -94.0 -72.1 2.2 -22.8 17.3 15.4 33 33 A G T < 5S+ 0 0 26 -3,-3.2 2,-1.0 1,-0.1 -3,-0.2 0.687 86.3 129.6 99.5 23.1 -23.8 16.1 18.8 34 34 A F > < + 0 0 0 -5,-2.7 3,-1.4 1,-0.2 -1,-0.1 -0.634 28.9 170.7 -99.5 70.3 -20.6 16.0 20.9 35 35 A Q T 3 S+ 0 0 124 -2,-1.0 3,-0.4 1,-0.3 -1,-0.2 0.813 71.0 48.5 -56.8 -35.9 -22.3 18.0 23.7 36 36 A N T 3> + 0 0 47 1,-0.2 4,-1.5 -3,-0.2 -1,-0.3 -0.119 68.1 131.4 -95.4 36.8 -19.4 17.6 26.2 37 37 A I H <> S+ 0 0 0 -3,-1.4 4,-2.3 1,-0.2 -1,-0.2 0.899 71.6 54.1 -57.8 -36.9 -16.7 18.6 23.8 38 38 A E H 4 S+ 0 0 33 -3,-0.4 -1,-0.2 1,-0.2 -2,-0.1 0.941 100.5 57.3 -67.0 -47.2 -15.3 20.9 26.4 39 39 A E H 4 S+ 0 0 90 1,-0.2 -1,-0.2 3,-0.0 -2,-0.2 0.898 120.2 31.2 -40.8 -47.4 -15.0 18.3 29.1 40 40 A K H < S+ 0 0 90 -4,-1.5 2,-0.4 -3,-0.2 7,-0.3 0.711 114.2 60.1 -93.6 -24.9 -12.8 16.3 26.8 41 41 A F < + 0 0 2 -4,-2.3 2,-0.2 -5,-0.2 5,-0.1 -0.923 41.7 151.8-119.0 128.9 -10.9 18.9 24.6 42 42 A C > - 0 0 29 -2,-0.4 3,-3.5 3,-0.1 -4,-0.0 -0.640 23.1-164.5-152.1 91.6 -8.6 21.7 25.6 43 43 A T T 3 S+ 0 0 43 1,-0.3 3,-0.4 -2,-0.2 -1,-0.0 0.655 91.9 64.7 -51.7 -16.6 -6.0 22.7 23.0 44 44 A H T 3 S+ 0 0 133 1,-0.3 -1,-0.3 -3,-0.0 2,-0.1 0.682 124.4 12.5 -77.2 -24.6 -4.2 24.5 25.9 45 45 A Q S < S- 0 0 108 -3,-3.5 -1,-0.3 2,-0.0 -2,-0.1 -0.607 88.4-156.4-152.9 85.4 -3.6 21.1 27.5 46 46 A L - 0 0 41 -3,-0.4 2,-0.3 -2,-0.1 -5,-0.1 -0.372 13.5-173.8 -71.4 144.0 -4.4 18.3 25.1 47 47 A D > - 0 0 117 -7,-0.3 3,-1.5 -2,-0.1 4,-0.4 -0.906 39.3 -14.1-136.5 159.7 -5.3 14.8 26.4 48 48 A G T 3> S+ 0 0 33 -2,-0.3 4,-2.1 1,-0.3 5,-0.1 -0.223 126.6 3.9 59.5-124.5 -6.0 11.3 25.2 49 49 A I H 3> S+ 0 0 29 2,-0.2 4,-2.9 1,-0.2 -1,-0.3 0.830 131.2 59.4 -63.8 -33.8 -6.6 10.8 21.6 50 50 A F H <> S+ 0 0 7 -3,-1.5 4,-1.4 2,-0.2 -2,-0.2 0.933 110.0 40.3 -63.0 -45.7 -5.8 14.4 21.0 51 51 A L H > S+ 0 0 67 -4,-0.4 4,-1.2 1,-0.2 -1,-0.2 0.887 115.2 55.0 -66.7 -39.1 -2.3 14.2 22.4 52 52 A Q H ><>S+ 0 0 79 -4,-2.1 5,-2.8 1,-0.2 6,-0.6 0.919 107.8 46.2 -63.6 -44.8 -1.9 10.8 20.7 53 53 A Q H ><5S+ 0 0 9 -4,-2.9 3,-0.9 1,-0.2 63,-0.3 0.843 105.7 62.3 -68.1 -28.3 -2.8 12.1 17.2 54 54 A E H 3<5S+ 0 0 33 -4,-1.4 60,-0.4 1,-0.3 -1,-0.2 0.805 110.9 37.6 -68.5 -29.8 -0.5 15.1 17.8 55 55 A K T <<5S- 0 0 26 -4,-1.2 -1,-0.3 -3,-0.6 -2,-0.2 0.313 115.6-113.8-103.1 6.5 2.5 12.8 18.1 56 56 A G T < 5S+ 0 0 15 -3,-0.9 -3,-0.2 -4,-0.3 -2,-0.1 0.803 75.3 134.5 69.9 29.7 1.3 10.4 15.4 57 57 A L S - 0 0 70 -2,-0.3 4,-2.3 1,-0.1 5,-0.1 -0.397 32.4-107.5 -81.9 164.1 -3.9 7.2 12.7 60 60 A P H > S+ 0 0 32 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.884 121.7 57.7 -56.1 -38.6 -6.6 9.6 11.6 61 61 A A H > S+ 0 0 50 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.944 108.1 45.1 -58.1 -48.0 -9.0 6.6 11.3 62 62 A E H > S+ 0 0 95 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.881 109.0 56.6 -62.8 -39.4 -8.4 5.8 15.0 63 63 A F H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.933 109.1 47.2 -55.6 -44.7 -8.8 9.4 15.9 64 64 A R H X S+ 0 0 36 -4,-2.5 4,-3.0 2,-0.2 -2,-0.2 0.903 111.5 48.1 -68.1 -41.3 -12.2 9.4 14.3 65 65 A D H X S+ 0 0 89 -4,-2.3 4,-3.9 2,-0.2 5,-0.2 0.949 111.2 53.0 -60.2 -45.8 -13.4 6.1 16.0 66 66 A G H X S+ 0 0 8 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.905 111.4 45.4 -53.7 -47.2 -12.1 7.6 19.3 67 67 A I H X S+ 0 0 0 -4,-2.2 4,-1.5 2,-0.2 -1,-0.2 0.909 113.0 50.0 -63.0 -43.7 -14.3 10.6 18.6 68 68 A R H >X>S+ 0 0 34 -4,-3.0 4,-1.4 1,-0.2 5,-0.9 0.959 110.8 50.5 -60.8 -48.9 -17.2 8.4 17.6 69 69 A E H 3<5S+ 0 0 156 -4,-3.9 3,-0.3 1,-0.2 -2,-0.2 0.891 109.8 48.9 -52.8 -47.6 -16.8 6.4 20.8 70 70 A M H 3<5S+ 0 0 50 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.759 114.0 47.0 -66.7 -25.9 -16.7 9.5 23.0 71 71 A M H <<5S- 0 0 22 -4,-1.5 -1,-0.2 -3,-0.5 -2,-0.2 0.676 98.9-139.3 -84.2 -21.9 -19.9 10.8 21.3 72 72 A G T <5S+ 0 0 66 -4,-1.4 2,-0.2 -3,-0.3 -3,-0.2 0.994 70.1 89.4 53.4 65.4 -21.7 7.5 21.5 73 73 A K S - 0 0 47 -2,-0.4 4,-2.3 1,-0.1 3,-0.3 -0.020 24.5-114.2 -55.6 151.1 -19.2 10.3 9.3 77 77 A D H > S+ 0 0 70 1,-0.2 4,-3.2 2,-0.2 5,-0.2 0.940 117.6 48.5 -45.7 -54.1 -15.5 10.8 8.8 78 78 A K H > S+ 0 0 177 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.800 108.5 53.2 -67.6 -26.4 -16.0 13.9 6.8 79 79 A Q H > S+ 0 0 95 -3,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.898 112.1 46.1 -69.2 -40.4 -18.4 15.4 9.4 80 80 A I H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 5,-0.2 0.968 113.5 48.6 -64.0 -50.5 -15.8 14.8 12.1 81 81 A D H X S+ 0 0 29 -4,-3.2 4,-3.0 1,-0.2 -2,-0.2 0.862 109.0 54.4 -57.5 -38.2 -13.1 16.3 9.9 82 82 A A H X S+ 0 0 62 -4,-2.1 4,-1.1 -5,-0.2 -1,-0.2 0.920 110.9 43.5 -64.3 -44.0 -15.2 19.3 9.1 83 83 A A H >< S+ 0 0 4 -4,-1.9 3,-0.5 2,-0.2 4,-0.3 0.942 116.8 47.5 -65.9 -46.3 -15.8 20.1 12.8 84 84 A W H >< S+ 0 0 6 -4,-2.5 3,-1.3 1,-0.2 -2,-0.2 0.919 112.2 49.7 -60.3 -45.1 -12.1 19.5 13.7 85 85 A N H >< S+ 0 0 21 -4,-3.0 3,-1.8 1,-0.2 -1,-0.2 0.674 90.8 77.8 -69.7 -19.2 -10.9 21.6 10.8 86 86 A S T << S+ 0 0 14 -4,-1.1 -1,-0.2 -3,-0.5 -61,-0.2 0.645 78.6 74.8 -68.0 -11.4 -13.2 24.5 11.7 87 87 A F T < S+ 0 0 21 -3,-1.3 -66,-2.3 -4,-0.3 2,-0.3 0.823 87.7 73.6 -59.7 -29.8 -10.6 25.3 14.4 88 88 A L B < +F 20 0C 8 -3,-1.8 -68,-0.2 -68,-0.2 -69,-0.0 -0.713 58.1 171.5 -94.5 138.1 -8.4 26.6 11.5 89 89 A V - 0 0 45 -70,-2.7 2,-0.3 -2,-0.3 -1,-0.2 0.799 44.7 -45.7-109.7 -77.8 -9.3 29.9 9.9 90 90 A D - 0 0 66 -71,-0.5 -71,-2.9 -73,-0.0 -1,-0.2 -0.991 27.4-132.1-158.8 150.1 -7.0 31.5 7.4 91 91 A I - 0 0 9 -2,-0.3 -73,-0.2 -73,-0.2 5,-0.1 -0.965 42.3-124.2 -99.3 115.2 -3.4 32.4 6.7 92 92 A P >> - 0 0 17 0, 0.0 3,-2.3 0, 0.0 4,-1.1 -0.367 15.8-124.8 -60.6 138.0 -3.5 36.0 5.6 93 93 A T H 3> S+ 0 0 78 1,-0.3 4,-2.6 2,-0.2 5,-0.2 0.758 107.4 66.9 -62.7 -22.7 -1.9 36.4 2.2 94 94 A Y H 3> S+ 0 0 100 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.774 99.2 53.8 -68.2 -21.1 0.5 39.1 3.5 95 95 A K H <> S+ 0 0 2 -3,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.860 107.8 48.9 -75.2 -36.0 2.1 36.3 5.7 96 96 A L H X S+ 0 0 3 -4,-1.1 4,-2.7 2,-0.2 -2,-0.2 0.950 110.7 50.3 -67.4 -46.5 2.5 34.1 2.6 97 97 A D H X S+ 0 0 66 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.909 110.8 51.3 -50.3 -47.5 4.1 37.1 0.7 98 98 A L H X S+ 0 0 24 -4,-1.7 4,-2.8 2,-0.2 -2,-0.2 0.923 108.3 49.1 -59.8 -47.5 6.4 37.5 3.7 99 99 A L H X S+ 0 0 0 -4,-2.5 4,-1.0 1,-0.2 -1,-0.2 0.953 112.3 50.3 -59.8 -43.1 7.5 33.9 3.8 100 100 A L H < S+ 0 0 21 -4,-2.7 3,-0.3 1,-0.2 4,-0.3 0.873 112.0 47.1 -62.3 -36.3 8.2 34.2 0.0 101 101 A K H >< S+ 0 0 125 -4,-2.3 3,-1.8 1,-0.2 4,-0.3 0.884 104.3 60.8 -69.1 -40.7 10.2 37.4 0.6 102 102 A L H >X S+ 0 0 8 -4,-2.8 4,-2.3 1,-0.3 3,-1.4 0.744 87.9 74.7 -63.3 -23.2 12.2 35.8 3.5 103 103 A R T 3< S+ 0 0 118 -4,-1.0 -1,-0.3 -3,-0.3 -2,-0.2 0.743 84.9 65.9 -57.5 -28.5 13.5 33.1 1.1 104 104 A E T <4 S+ 0 0 137 -3,-1.8 -1,-0.3 -4,-0.3 -2,-0.2 0.764 119.4 17.8 -66.0 -26.4 15.9 35.8 -0.4 105 105 A K T <4 S+ 0 0 128 -3,-1.4 2,-0.3 -4,-0.3 -2,-0.2 0.593 124.0 36.5-124.1 -15.9 17.8 36.1 2.8 106 106 A Y S < S- 0 0 26 -4,-2.3 2,-0.5 -98,-0.0 -98,-0.2 -0.944 70.3-117.7-137.1 156.3 17.1 33.0 5.0 107 107 A V E -a 8 0A 57 -100,-2.3 -98,-2.3 -2,-0.3 2,-0.5 -0.854 43.0-150.9 -86.4 132.5 16.5 29.3 4.8 108 108 A V E +a 9 0A 5 -2,-0.5 31,-3.1 -100,-0.2 32,-0.5 -0.923 18.8 178.2-120.9 125.5 13.0 29.0 6.2 109 109 A Y E -ac 10 140A 14 -100,-3.1 -98,-2.6 -2,-0.5 2,-0.4 -0.876 22.2-134.2-119.2 157.7 11.6 25.9 8.0 110 110 A L E -ac 11 141A 0 30,-1.8 32,-3.1 -2,-0.3 2,-0.4 -0.915 16.6-174.3-106.1 133.6 8.2 25.2 9.7 111 111 A L E + c 0 142A 0 -100,-2.3 2,-0.4 -2,-0.4 -98,-0.3 -0.937 21.7 162.0-124.6 115.9 8.1 23.6 13.1 112 112 A S E - 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0 0 27 -5,-1.1 2,-0.3 -95,-0.2 -1,-0.3 -0.955 61.5-150.4-146.8 162.7 7.6 14.3 19.3 150 150 A A > - 0 0 4 -2,-0.3 3,-2.4 -3,-0.1 6,-0.2 -0.990 28.6 -70.2-140.6 148.0 6.0 17.6 20.2 151 151 A K T 3 S+ 0 0 9 -2,-0.3 29,-0.1 1,-0.3 28,-0.0 -0.496 109.7 36.5 -59.0 142.6 7.0 21.1 21.4 152 152 A P T 3 S+ 0 0 28 0, 0.0 -1,-0.3 0, 0.0 5,-0.0 -0.843 86.1 112.7-101.1 33.7 8.1 22.0 24.0 153 153 A E X> - 0 0 15 -3,-2.4 3,-1.9 1,-0.2 4,-0.9 -0.415 65.5-136.6 -58.8 124.3 10.2 18.7 24.3 154 154 A P H >> S+ 0 0 10 0, 0.0 4,-1.8 0, 0.0 3,-0.7 0.898 100.9 66.3 -48.1 -42.8 13.9 19.6 24.1 155 155 A E H 3> S+ 0 0 95 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.743 93.4 59.2 -54.3 -27.8 14.4 16.6 21.9 156 156 A I H <> S+ 0 0 0 -3,-1.9 4,-1.9 -6,-0.2 -1,-0.2 0.916 105.1 46.9 -72.1 -40.0 12.3 18.1 19.1 157 157 A F H S+ 0 0 10 -4,-1.9 5,-2.2 2,-0.2 4,-1.3 0.910 119.3 47.8 -65.8 -40.0 18.7 21.3 13.9 162 162 A E H <5S+ 0 0 146 -4,-2.2 3,-0.4 -5,-0.2 -2,-0.2 0.960 115.0 43.6 -59.2 -57.6 20.3 17.8 13.6 163 163 A D H <5S+ 0 0 101 -4,-3.0 -2,-0.2 -5,-0.3 -1,-0.2 0.903 118.2 45.3 -56.6 -41.7 18.1 16.7 10.7 164 164 A A H <5S- 0 0 24 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.677 104.5-127.7 -78.5 -20.5 18.4 20.1 8.9 165 165 A G T <5 + 0 0 70 -4,-1.3 2,-0.3 -3,-0.4 -3,-0.2 0.884 61.4 138.6 73.1 38.8 22.2 20.3 9.4 166 166 A I < - 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