==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 15-JUL-01 1JL3 . COMPND 2 MOLECULE: ARSENATE REDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; . AUTHOR X.-D.SU,M.S.BENNETT . 519 7 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25302.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 353 68.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 80 15.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 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 . 35 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 37 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 179 34.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.8 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 2 0 4 0 1 3 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0 4 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 0 7 1 2 2 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 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 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 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 3 A N 0 0 110 0, 0.0 2,-0.3 0, 0.0 29,-0.2 0.000 360.0 360.0 360.0 -48.9 6.8 4.8 8.1 2 4 A K E -a 30 0A 65 27,-2.2 29,-2.6 2,-0.0 2,-0.4 -0.959 360.0-160.6-128.1 146.0 3.1 4.7 9.1 3 5 A I E -a 31 0A 20 -2,-0.3 71,-2.2 27,-0.2 72,-1.3 -0.990 3.2-170.3-129.9 128.9 1.4 3.7 12.4 4 6 A I E -ab 32 75A 0 27,-2.5 29,-2.3 -2,-0.4 2,-0.5 -0.974 6.3-164.0-119.3 132.6 -2.3 2.8 12.9 5 7 A Y E -ab 33 76A 5 70,-2.2 72,-2.6 -2,-0.4 2,-0.4 -0.951 3.2-158.3-122.8 113.1 -3.6 2.4 16.5 6 8 A F E -ab 34 77A 0 27,-2.7 29,-2.1 -2,-0.5 2,-0.4 -0.748 12.9-173.1 -91.1 133.7 -7.0 0.6 17.1 7 9 A L E +ab 35 78A 0 70,-2.7 72,-2.1 -2,-0.4 2,-0.3 -0.987 11.6 157.7-131.3 135.8 -8.8 1.3 20.3 8 10 A C E -a 36 0A 1 27,-1.6 29,-1.3 -2,-0.4 30,-0.2 -0.857 58.2 -88.0-141.7 177.8 -11.9 -0.2 21.8 9 11 A T S S+ 0 0 42 -2,-0.3 29,-1.6 27,-0.2 28,-0.5 0.906 113.2 5.1 -56.1 -41.4 -13.4 -0.6 25.3 10 12 A G S S- 0 0 21 26,-0.2 -2,-0.3 27,-0.2 5,-0.2 -0.631 70.0-123.8-128.7-173.1 -11.4 -3.7 25.8 11 13 A N S S+ 0 0 0 -2,-0.2 30,-0.2 27,-0.2 25,-0.1 -0.409 84.5 86.5-133.4 56.7 -8.7 -5.6 23.9 12 14 A S S S- 0 0 27 30,-0.1 31,-2.1 23,-0.1 34,-0.2 0.701 97.6 -1.2-121.6 -42.8 -10.3 -9.0 23.6 13 15 A C S > S+ 0 0 9 29,-0.1 4,-2.3 3,-0.1 5,-0.2 0.684 125.6 28.5-117.2 -82.7 -12.6 -9.2 20.5 14 16 A R H > S+ 0 0 25 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.906 123.0 46.8 -54.1 -50.9 -13.2 -6.3 18.1 15 17 A S H > S+ 0 0 2 -5,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.838 113.5 49.6 -64.4 -33.3 -9.8 -4.6 18.6 16 18 A Q H > S+ 0 0 0 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.867 111.8 47.3 -74.0 -36.5 -7.9 -7.9 18.3 17 19 A M H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 5,-0.2 0.871 111.1 52.3 -71.9 -33.9 -9.7 -8.9 15.1 18 20 A A H X S+ 0 0 0 -4,-2.3 4,-2.6 -5,-0.2 -2,-0.2 0.909 109.0 50.0 -66.4 -41.0 -9.1 -5.4 13.7 19 21 A E H X S+ 0 0 19 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.936 112.2 48.2 -61.6 -45.5 -5.4 -5.8 14.5 20 22 A G H X S+ 0 0 2 -4,-2.1 4,-0.9 1,-0.2 -2,-0.2 0.917 114.0 44.7 -62.0 -46.1 -5.4 -9.2 12.7 21 23 A W H X S+ 0 0 24 -4,-2.6 4,-2.6 1,-0.2 3,-0.4 0.892 111.8 53.5 -65.8 -39.6 -7.2 -7.9 9.6 22 24 A A H X S+ 0 0 0 -4,-2.6 4,-2.7 1,-0.2 -1,-0.2 0.883 105.2 52.9 -63.9 -39.8 -5.0 -4.8 9.4 23 25 A K H < S+ 0 0 103 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.763 113.7 45.4 -68.3 -22.6 -1.8 -6.8 9.5 24 26 A Q H < S+ 0 0 107 -4,-0.9 -2,-0.2 -3,-0.4 -1,-0.2 0.901 119.2 38.1 -84.8 -44.4 -3.1 -8.9 6.6 25 27 A Y H < S+ 0 0 89 -4,-2.6 2,-0.4 -5,-0.1 -2,-0.2 0.804 107.8 68.4 -76.8 -33.5 -4.4 -6.0 4.4 26 28 A L S < S- 0 0 16 -4,-2.7 6,-0.1 -5,-0.2 107,-0.0 -0.735 78.7-134.1 -93.2 137.8 -1.7 -3.5 5.1 27 29 A G > - 0 0 45 -2,-0.4 2,-2.4 1,-0.1 3,-2.1 -0.107 43.4 -67.0 -81.1-178.8 1.8 -4.1 3.7 28 30 A D T 3 S+ 0 0 182 1,-0.3 -1,-0.1 3,-0.0 3,-0.1 -0.469 120.9 70.6 -71.0 80.0 5.3 -3.8 5.4 29 31 A E T 3 S+ 0 0 99 -2,-2.4 -27,-2.2 1,-0.3 2,-0.4 0.151 85.4 75.3-162.5 -27.3 5.0 -0.0 5.7 30 32 A W E < -a 2 0A 55 -3,-2.1 2,-0.6 -29,-0.2 -1,-0.3 -0.829 63.8-152.9-103.4 135.8 2.4 0.1 8.4 31 33 A K E -a 3 0A 110 -29,-2.6 -27,-2.5 -2,-0.4 2,-0.5 -0.941 21.3-151.8-104.6 125.2 3.0 -0.7 12.1 32 34 A V E +a 4 0A 14 -2,-0.6 2,-0.3 -29,-0.2 -27,-0.2 -0.877 19.1 171.8-107.9 129.5 -0.3 -2.0 13.6 33 35 A Y E -a 5 0A 33 -29,-2.3 -27,-2.7 -2,-0.5 2,-0.3 -0.917 8.2-173.1-128.5 154.6 -1.3 -1.7 17.3 34 36 A S E +a 6 0A 4 -2,-0.3 2,-0.3 -29,-0.2 29,-0.3 -0.987 13.3 158.5-146.6 145.3 -4.5 -2.4 19.2 35 37 A A E -a 7 0A 1 -29,-2.1 -27,-1.6 -2,-0.3 2,-0.3 -0.968 23.6-136.8-157.7 169.3 -5.4 -1.7 22.8 36 38 A G E -ac 8 64A 0 27,-2.3 29,-1.8 -2,-0.3 -26,-0.2 -0.864 30.8-116.1-131.4 165.5 -8.3 -1.2 25.1 37 39 A I S S+ 0 0 45 -29,-1.3 2,-0.3 -28,-0.5 -27,-0.2 0.845 115.7 17.1 -65.6 -31.8 -9.3 1.1 27.9 38 40 A E S S- 0 0 106 -29,-1.6 2,-0.4 -30,-0.2 -27,-0.2 -0.917 78.8-149.2-132.8 156.7 -9.1 -2.1 29.9 39 41 A A + 0 0 28 -2,-0.3 25,-0.1 -29,-0.2 3,-0.1 -0.930 25.0 161.1-135.9 111.3 -7.4 -5.4 28.8 40 42 A H - 0 0 149 -2,-0.4 -1,-0.1 1,-0.3 -28,-0.1 0.161 57.8 -90.3-115.1 18.1 -8.7 -8.7 30.0 41 43 A G - 0 0 26 -30,-0.2 -1,-0.3 2,-0.1 -30,-0.1 -0.074 58.1 -42.2 97.9 162.7 -7.1 -11.1 27.5 42 44 A L - 0 0 53 18,-0.2 -29,-0.1 16,-0.1 -30,-0.1 -0.350 53.9-125.9 -64.7 139.3 -7.8 -12.6 24.1 43 45 A N >> - 0 0 29 -31,-2.1 4,-2.0 1,-0.1 3,-0.5 -0.780 12.2-143.3 -88.1 124.3 -11.4 -13.9 23.6 44 46 A P H 3> S+ 0 0 81 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.854 99.7 54.7 -55.0 -38.2 -11.2 -17.5 22.5 45 47 A N H 3> S+ 0 0 62 1,-0.2 4,-2.5 2,-0.2 5,-0.1 0.865 107.2 50.6 -65.0 -36.4 -14.2 -17.1 20.1 46 48 A A H <> S+ 0 0 0 -3,-0.5 4,-2.2 2,-0.2 5,-0.2 0.911 109.8 50.2 -67.6 -41.3 -12.4 -14.2 18.4 47 49 A V H X S+ 0 0 32 -4,-2.0 4,-2.1 2,-0.2 10,-0.3 0.927 113.5 45.4 -61.6 -44.7 -9.3 -16.3 17.9 48 50 A K H X S+ 0 0 103 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.918 110.4 54.5 -64.4 -44.5 -11.3 -19.2 16.4 49 51 A A H X S+ 0 0 0 -4,-2.5 4,-0.5 1,-0.2 -1,-0.2 0.891 111.9 43.1 -57.9 -42.9 -13.2 -16.8 14.2 50 52 A M H ><>S+ 0 0 0 -4,-2.2 5,-2.3 1,-0.2 3,-1.2 0.882 109.3 57.4 -72.0 -37.0 -10.1 -15.4 12.7 51 53 A K H ><5S+ 0 0 136 -4,-2.1 3,-2.0 1,-0.3 -2,-0.2 0.883 98.1 63.2 -58.8 -37.3 -8.4 -18.8 12.4 52 54 A E H 3<5S+ 0 0 107 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.770 106.0 43.8 -59.7 -27.9 -11.4 -19.8 10.3 53 55 A V T <<5S- 0 0 48 -3,-1.2 -1,-0.3 -4,-0.5 -2,-0.2 0.158 127.6 -95.5-104.5 17.9 -10.4 -17.2 7.7 54 56 A G T < 5S+ 0 0 66 -3,-2.0 2,-0.5 1,-0.2 -3,-0.2 0.734 85.6 122.7 79.6 24.1 -6.7 -18.0 7.8 55 57 A I < - 0 0 16 -5,-2.3 2,-0.7 -8,-0.1 -1,-0.2 -0.974 47.6-152.5-123.2 124.3 -5.5 -15.4 10.2 56 58 A D + 0 0 99 -2,-0.5 3,-0.2 1,-0.1 -8,-0.1 -0.829 28.1 157.0 -99.1 109.7 -3.7 -16.4 13.5 57 59 A I > + 0 0 1 -2,-0.7 3,-1.4 -10,-0.3 -1,-0.1 0.217 44.2 107.0-111.4 12.6 -4.1 -13.8 16.2 58 60 A S T 3 S+ 0 0 57 1,-0.3 -1,-0.1 -11,-0.1 -16,-0.1 0.738 79.1 51.6 -63.7 -24.0 -3.4 -16.3 19.1 59 61 A N T 3 S+ 0 0 135 -3,-0.2 -1,-0.3 2,-0.1 2,-0.2 0.476 84.3 110.5 -92.1 -3.6 0.0 -14.6 19.7 60 62 A Q < - 0 0 15 -3,-1.4 2,-0.2 1,-0.1 -18,-0.2 -0.492 65.1-131.3 -72.9 139.5 -1.4 -11.1 19.9 61 63 A T - 0 0 88 -2,-0.2 2,-0.8 -20,-0.1 -27,-0.1 -0.547 11.2-120.4 -91.7 158.2 -1.2 -9.6 23.4 62 64 A S - 0 0 32 -2,-0.2 2,-0.3 -23,-0.1 -23,-0.1 -0.881 43.5-176.5 -98.4 109.8 -4.1 -7.9 25.3 63 65 A D - 0 0 66 -2,-0.8 -27,-2.3 -29,-0.3 2,-0.2 -0.826 25.8-131.2-116.7 150.2 -2.8 -4.3 26.0 64 66 A I B -c 36 0A 105 -2,-0.3 -27,-0.2 -29,-0.2 -26,-0.1 -0.629 52.9 -76.5 -90.0 152.7 -4.0 -1.2 27.8 65 67 A I - 0 0 43 -29,-1.8 2,-0.5 -2,-0.2 -1,-0.1 -0.189 45.7-161.9 -51.7 134.3 -3.9 2.1 26.0 66 68 A D >> - 0 0 42 1,-0.1 4,-2.6 -3,-0.1 3,-1.1 -0.957 10.6-161.8-124.9 108.8 -0.3 3.6 25.9 67 69 A S H 3> S+ 0 0 59 -2,-0.5 4,-2.4 1,-0.3 5,-0.2 0.752 88.3 67.4 -62.2 -25.3 -0.1 7.3 25.1 68 70 A D H 34 S+ 0 0 20 2,-0.2 -1,-0.3 1,-0.2 4,-0.1 0.868 113.4 31.3 -63.2 -34.2 3.6 7.0 24.2 69 71 A I H X4 S+ 0 0 9 -3,-1.1 3,-1.5 2,-0.1 4,-0.4 0.909 118.5 53.2 -87.0 -49.8 2.5 5.0 21.2 70 72 A L H >< S+ 0 0 0 -4,-2.6 3,-1.6 1,-0.3 -3,-0.2 0.881 104.4 55.5 -53.4 -45.8 -0.9 6.6 20.5 71 73 A N T 3< S+ 0 0 31 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.1 0.657 108.7 49.4 -65.7 -14.8 0.5 10.1 20.4 72 74 A N T < S+ 0 0 53 -3,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.390 89.0 112.3-103.6 2.0 3.0 9.0 17.7 73 75 A A < - 0 0 0 -3,-1.6 -69,-0.2 -4,-0.4 3,-0.2 -0.360 67.4-138.0 -77.0 153.8 0.3 7.3 15.5 74 76 A D S S- 0 0 67 -71,-2.2 21,-2.3 1,-0.3 2,-0.3 0.834 90.4 -4.2 -76.4 -32.7 -0.7 8.6 12.1 75 77 A L E -bd 4 95A 4 -72,-1.3 -70,-2.2 19,-0.2 2,-0.4 -0.987 58.9-145.2-159.6 149.4 -4.3 7.8 13.1 76 78 A V E -bd 5 96A 0 19,-2.9 21,-2.8 -2,-0.3 2,-0.5 -0.949 16.4-158.9-114.6 135.3 -6.2 6.2 15.9 77 79 A V E -bd 6 97A 0 -72,-2.6 -70,-2.7 -2,-0.4 2,-0.3 -0.967 3.3-156.1-118.8 114.6 -9.3 4.2 15.0 78 80 A T E -bd 7 98A 1 19,-2.3 21,-2.9 -2,-0.5 -70,-0.2 -0.695 4.2-153.8 -87.3 143.6 -11.9 3.7 17.8 79 81 A L + 0 0 0 -72,-2.1 22,-1.9 -2,-0.3 2,-0.3 0.343 69.4 16.0-103.5 6.2 -14.2 0.7 17.2 80 82 A C S > S- 0 0 15 -73,-0.3 4,-1.9 20,-0.3 3,-0.2 -0.966 81.9 -99.1-166.8 163.1 -17.3 1.7 19.1 81 83 A G H > S+ 0 0 52 -2,-0.3 4,-2.0 1,-0.2 5,-0.1 0.831 119.4 54.8 -58.1 -36.9 -19.0 4.8 20.5 82 84 A D H > S+ 0 0 57 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.905 108.4 49.0 -65.3 -40.7 -17.8 4.0 24.1 83 85 A A H > S+ 0 0 0 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.878 108.2 54.2 -65.6 -37.6 -14.2 3.9 22.9 84 86 A A H < S+ 0 0 25 -4,-1.9 3,-0.3 1,-0.2 -1,-0.2 0.906 109.3 48.7 -62.8 -40.8 -14.7 7.2 21.0 85 87 A D H < S+ 0 0 138 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.887 117.6 40.3 -64.4 -41.1 -15.9 8.8 24.3 86 88 A K H < S+ 0 0 107 -4,-2.0 -1,-0.2 -5,-0.1 -2,-0.2 0.488 81.7 118.2 -90.4 -4.2 -13.0 7.4 26.3 87 89 A C < - 0 0 9 -4,-1.2 3,-0.1 -3,-0.3 -9,-0.0 -0.486 66.9-123.5 -65.9 120.7 -10.2 8.0 23.7 88 90 A P - 0 0 52 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 -0.097 35.2 -74.4 -64.4 164.0 -7.7 10.4 25.4 89 91 A M - 0 0 163 1,-0.0 -18,-0.1 3,-0.0 0, 0.0 -0.294 54.5-164.3 -55.1 135.7 -6.6 13.7 24.0 90 92 A T - 0 0 18 -3,-0.1 -19,-0.1 4,-0.1 6,-0.1 -0.886 29.4 -86.3-125.0 157.7 -4.1 13.2 21.1 91 93 A P > - 0 0 6 0, 0.0 3,-2.2 0, 0.0 -1,-0.1 -0.282 45.3-109.2 -59.4 148.1 -1.7 15.6 19.4 92 94 A P T 3 S+ 0 0 137 0, 0.0 -2,-0.0 0, 0.0 -3,-0.0 0.737 115.8 63.8 -52.4 -23.1 -3.3 17.6 16.6 93 95 A H T 3 S+ 0 0 113 -22,-0.1 2,-0.5 2,-0.1 -21,-0.0 0.653 82.6 90.0 -77.7 -15.2 -1.3 15.6 14.0 94 96 A V S < S- 0 0 6 -3,-2.2 2,-0.3 -23,-0.1 -19,-0.2 -0.719 77.7-133.7 -85.3 123.5 -3.0 12.3 14.9 95 97 A K E -d 75 0A 138 -21,-2.3 -19,-2.9 -2,-0.5 2,-0.7 -0.612 13.2-149.3 -77.6 134.0 -6.1 11.6 12.9 96 98 A R E +d 76 0A 94 -2,-0.3 2,-0.4 -21,-0.2 -19,-0.2 -0.902 21.0 177.0-108.0 106.6 -9.1 10.5 15.0 97 99 A E E -d 77 0A 30 -21,-2.8 -19,-2.3 -2,-0.7 2,-0.5 -0.868 14.4-152.6-110.6 145.0 -11.3 8.1 13.0 98 100 A H E +d 78 0A 108 -2,-0.4 2,-0.2 -21,-0.2 -19,-0.2 -0.944 18.0 168.4-125.8 116.1 -14.4 6.4 14.4 99 101 A W - 0 0 20 -21,-2.9 2,-0.4 -2,-0.5 -15,-0.1 -0.606 21.8-139.8-109.4 175.1 -15.8 3.1 13.2 100 102 A G + 0 0 56 -2,-0.2 2,-0.3 -20,-0.1 -20,-0.3 -0.950 23.0 165.5-147.8 127.6 -18.5 1.1 15.0 101 103 A F - 0 0 19 -22,-1.9 -87,-0.1 -2,-0.4 -20,-0.1 -0.994 37.7-109.6-137.4 142.0 -19.0 -2.6 15.5 102 104 A D - 0 0 104 -2,-0.3 3,-0.1 1,-0.1 5,-0.0 -0.357 36.3-108.9 -68.0 150.7 -21.3 -4.5 17.9 103 105 A D > - 0 0 46 1,-0.2 3,-1.5 -90,-0.0 4,-0.5 -0.709 25.7-164.1 -82.7 106.0 -19.7 -6.3 20.8 104 106 A P G > S+ 0 0 3 0, 0.0 3,-0.5 0, 0.0 -1,-0.2 0.752 86.0 64.2 -63.6 -20.5 -20.0 -10.1 20.0 105 107 A A G 3 S+ 0 0 56 1,-0.2 -2,-0.0 12,-0.1 9,-0.0 0.686 101.8 48.2 -76.1 -18.7 -19.3 -10.9 23.6 106 108 A R G < S+ 0 0 176 -3,-1.5 -1,-0.2 2,-0.1 -3,-0.0 0.482 82.0 124.5 -99.8 -3.1 -22.4 -9.2 24.9 107 109 A A < - 0 0 13 -3,-0.5 2,-0.4 -4,-0.5 7,-0.1 -0.289 49.2-150.3 -59.4 136.7 -24.7 -10.8 22.3 108 110 A Q + 0 0 174 5,-0.0 2,-0.3 6,-0.0 -2,-0.1 -0.917 46.3 72.4-111.3 136.7 -27.7 -12.7 23.9 109 111 A G S S- 0 0 41 -2,-0.4 5,-0.0 4,-0.0 -2,-0.0 -0.974 81.4 -23.1 156.3-169.5 -29.2 -15.7 22.2 110 112 A T > - 0 0 58 -2,-0.3 4,-2.3 1,-0.1 5,-0.2 -0.281 64.4-110.0 -65.6 159.1 -28.9 -19.3 21.3 111 113 A E H > S+ 0 0 134 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.843 119.7 52.2 -62.6 -31.8 -25.3 -20.6 21.2 112 114 A E H > 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50.1 -61.5 -43.3 37.8 27.1 22.3 294 21 C E H X S+ 0 0 0 -4,-1.9 4,-2.2 1,-0.2 -1,-0.2 0.920 109.7 51.0 -60.7 -43.8 40.7 27.7 19.9 295 22 C G H X S+ 0 0 2 -4,-1.9 4,-1.2 1,-0.2 -2,-0.2 0.928 113.1 44.0 -60.2 -47.2 43.1 25.8 22.1 296 23 C W H X S+ 0 0 12 -4,-2.5 4,-1.8 1,-0.2 3,-0.4 0.920 111.6 54.4 -63.8 -44.2 40.8 22.8 22.3 297 24 C A H X S+ 0 0 0 -4,-2.8 4,-2.8 1,-0.2 -1,-0.2 0.884 105.0 52.7 -59.4 -40.9 40.0 22.8 18.6 298 25 C K H < S+ 0 0 95 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.848 110.0 50.1 -64.0 -32.6 43.6 22.7 17.6 299 26 C Q H < S+ 0 0 121 -4,-1.2 -1,-0.2 -3,-0.4 -2,-0.2 0.835 123.2 27.1 -75.8 -34.2 44.1 19.7 19.8 300 27 C Y H < 0 0 116 -4,-1.8 -2,-0.2 -3,-0.0 -3,-0.2 0.683 360.0 360.0-104.3 -21.4 41.2 17.7 18.5 301 28 C L < 0 0 54 -4,-2.8 -3,-0.2 -5,-0.3 -2,-0.1 0.865 360.0 360.0 -97.4 360.0 40.6 18.9 14.9 302 ! 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 0.0 303 31 C E 0 0 178 0, 0.0 2,-0.4 0, 0.0 -2,-0.0 0.000 360.0 360.0 360.0 -42.2 42.4 19.6 7.8 304 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