==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CALCIUM-BINDING 06-SEP-97 1MUX . COMPND 2 MOLECULE: CALMODULIN; . SOURCE 2 ORGANISM_SCIENTIFIC: XENOPUS LAEVIS; . AUTHOR M.OSAWA,M.B.SWINDELLS,J.TANIKAWA,T.TANAKA,T.MASE,T.FURUYA, . 148 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11171.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 90 60.8 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 . 4 2.7 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 . 7 4.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 11 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 66 44.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 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 0 0 0 2 2 1 2 0 0 1 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 . 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 0 0 0 ANTIPARALLEL 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 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 1 A A 0 0 132 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -68.0 -28.8 19.1 -8.8 2 2 A D - 0 0 147 0, 0.0 2,-0.6 0, 0.0 0, 0.0 -0.834 360.0-139.3-110.0 148.2 -25.6 17.0 -8.9 3 3 A Q - 0 0 151 -2,-0.3 2,-0.0 2,-0.0 0, 0.0 -0.890 17.7-140.0-108.3 114.4 -22.4 17.8 -7.0 4 4 A L - 0 0 153 -2,-0.6 2,-0.4 2,-0.0 0, 0.0 -0.365 17.1-148.7 -68.5 149.2 -19.1 17.2 -9.0 5 5 A T >> - 0 0 69 1,-0.1 3,-1.6 -2,-0.0 4,-0.6 -0.927 23.6-122.1-122.1 146.7 -16.2 15.6 -7.0 6 6 A E H 3> S+ 0 0 162 -2,-0.4 4,-2.0 1,-0.3 5,-0.2 0.732 103.7 81.9 -57.2 -17.1 -12.5 16.1 -7.5 7 7 A E H 3> S+ 0 0 138 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.922 85.2 55.8 -56.4 -42.6 -12.4 12.3 -8.0 8 8 A Q H <> S+ 0 0 86 -3,-1.6 4,-1.9 1,-0.2 3,-0.4 0.966 106.0 49.4 -56.2 -52.5 -13.4 12.7 -11.6 9 9 A I H X S+ 0 0 70 -4,-0.6 4,-1.8 1,-0.2 -1,-0.2 0.917 107.8 55.3 -55.3 -40.9 -10.5 15.1 -12.4 10 10 A A H X S+ 0 0 45 -4,-2.0 4,-1.8 1,-0.2 -1,-0.2 0.905 104.2 55.1 -60.3 -37.6 -8.1 12.6 -10.8 11 11 A E H X S+ 0 0 102 -4,-1.9 4,-1.8 -3,-0.4 3,-0.3 0.959 108.8 45.5 -61.2 -49.0 -9.4 9.9 -13.1 12 12 A F H X S+ 0 0 26 -4,-1.9 4,-1.7 1,-0.2 -1,-0.2 0.808 110.6 56.3 -65.8 -25.2 -8.6 12.0 -16.2 13 13 A K H X S+ 0 0 101 -4,-1.8 4,-1.8 -5,-0.3 -1,-0.2 0.844 104.1 52.6 -75.8 -30.7 -5.2 12.7 -14.7 14 14 A E H X S+ 0 0 126 -4,-1.8 4,-1.7 -3,-0.3 -2,-0.2 0.924 111.3 45.6 -71.1 -41.5 -4.4 9.0 -14.3 15 15 A A H X S+ 0 0 25 -4,-1.8 4,-1.6 2,-0.2 -2,-0.2 0.912 109.1 57.1 -68.3 -39.6 -5.2 8.3 -18.0 16 16 A F H >X S+ 0 0 16 -4,-1.7 4,-2.0 1,-0.2 3,-0.8 0.971 109.5 43.2 -56.2 -55.1 -3.2 11.4 -19.1 17 17 A S H 3< S+ 0 0 83 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.882 109.1 59.6 -60.6 -35.1 0.0 10.2 -17.4 18 18 A L H 3< S+ 0 0 92 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.840 108.8 45.4 -63.7 -29.4 -0.6 6.6 -18.7 19 19 A F H << S+ 0 0 43 -4,-1.6 2,-0.7 -3,-0.8 -2,-0.2 0.970 97.3 71.6 -79.4 -57.8 -0.5 8.0 -22.3 20 20 A D < + 0 0 20 -4,-2.0 3,-0.4 1,-0.1 -1,-0.1 -0.414 59.0 174.7 -61.2 106.3 2.6 10.3 -22.1 21 21 A K + 0 0 98 -2,-0.7 -1,-0.1 1,-0.2 -3,-0.1 -0.255 66.3 53.6-109.6 47.6 5.4 7.7 -21.9 22 22 A D S S- 0 0 72 -2,-0.0 -1,-0.2 0, 0.0 -2,-0.1 0.191 108.0-102.8-162.4 22.2 8.4 10.0 -22.1 23 23 A G S S+ 0 0 76 -3,-0.4 -2,-0.1 -6,-0.1 -6,-0.0 0.958 80.0 124.1 47.6 78.3 8.1 12.7 -19.4 24 24 A D - 0 0 94 -4,-0.0 3,-0.1 2,-0.0 -1,-0.1 0.566 63.7-134.5-134.9 -36.8 6.9 15.6 -21.6 25 25 A G S S+ 0 0 42 1,-0.2 2,-0.4 -9,-0.1 -5,-0.1 0.117 81.8 80.8 96.9 -23.4 3.6 16.9 -20.3 26 26 A T S S- 0 0 46 38,-0.1 2,-0.8 39,-0.0 -1,-0.2 -0.916 78.6-128.2-118.0 143.4 2.1 17.0 -23.8 27 27 A I B -A 63 0A 3 36,-1.5 36,-1.8 -2,-0.4 2,-0.1 -0.772 32.1-177.1 -92.0 113.0 0.7 14.0 -25.7 28 28 A T > - 0 0 22 -2,-0.8 4,-1.8 34,-0.2 5,-0.2 -0.342 42.4 -99.4 -97.1-176.5 2.2 13.8 -29.2 29 29 A T H > S+ 0 0 20 32,-0.4 4,-1.4 2,-0.2 -1,-0.1 0.826 121.0 53.3 -74.8 -28.5 1.5 11.3 -32.1 30 30 A K H > S+ 0 0 139 2,-0.2 4,-1.7 3,-0.1 5,-0.2 0.979 111.1 42.9 -70.8 -54.1 4.5 9.2 -31.1 31 31 A E H > S+ 0 0 14 1,-0.2 4,-1.6 2,-0.2 3,-0.5 0.972 115.2 50.0 -56.1 -52.4 3.5 8.7 -27.5 32 32 A L H X S+ 0 0 19 -4,-1.8 4,-1.9 1,-0.2 5,-0.3 0.874 102.9 64.0 -55.0 -33.5 -0.1 8.1 -28.4 33 33 A G H X S+ 0 0 15 -4,-1.4 4,-1.8 1,-0.3 3,-0.5 0.963 105.6 42.0 -56.6 -49.8 1.2 5.6 -30.9 34 34 A T H X S+ 0 0 71 -4,-1.7 4,-1.3 -3,-0.5 -1,-0.3 0.771 109.3 61.9 -69.2 -21.2 2.5 3.4 -28.1 35 35 A V H < S+ 0 0 5 -4,-1.6 4,-0.4 -5,-0.2 -1,-0.2 0.845 110.7 37.5 -73.5 -31.0 -0.7 4.1 -26.2 36 36 A M H X>S+ 0 0 34 -4,-1.9 5,-1.1 -3,-0.5 4,-0.8 0.739 116.8 51.6 -90.9 -24.3 -2.8 2.4 -28.9 37 37 A R H <5S+ 0 0 171 -4,-1.8 -2,-0.2 -5,-0.3 -3,-0.2 0.727 108.7 51.1 -84.4 -20.9 -0.3 -0.3 -29.6 38 38 A S T <5S+ 0 0 74 -4,-1.3 -1,-0.2 -5,-0.2 -2,-0.2 0.705 115.2 42.7 -88.1 -19.3 0.1 -1.3 -25.9 39 39 A L T 45S- 0 0 117 -4,-0.4 -2,-0.1 -5,-0.1 -3,-0.1 0.905 129.9 -61.0 -89.2 -78.4 -3.7 -1.6 -25.4 40 40 A G T <5S+ 0 0 67 -4,-0.8 2,-0.3 0, 0.0 -3,-0.2 -0.091 96.5 90.4-169.7 55.7 -5.3 -3.4 -28.4 41 41 A Q < - 0 0 87 -5,-1.1 -2,-0.1 2,-0.0 0, 0.0 -0.994 42.0-166.1-152.7 158.0 -4.7 -1.5 -31.7 42 42 A N + 0 0 129 -2,-0.3 -5,-0.1 -4,-0.0 -9,-0.0 -0.186 36.0 144.7-143.0 48.6 -2.2 -1.4 -34.6 43 43 A P - 0 0 44 0, 0.0 2,-0.2 0, 0.0 -2,-0.0 0.255 44.5-108.3 -68.8-159.3 -3.0 1.8 -36.6 44 44 A T > - 0 0 85 1,-0.1 4,-1.8 0, 0.0 5,-0.2 -0.794 23.4-101.5-130.9 175.4 -0.3 3.9 -38.2 45 45 A E H > S+ 0 0 89 -2,-0.2 4,-1.8 2,-0.2 5,-0.1 0.864 120.0 48.8 -67.4 -32.7 1.4 7.3 -37.6 46 46 A A H > S+ 0 0 63 2,-0.2 4,-1.6 1,-0.2 3,-0.3 0.995 113.1 41.8 -71.0 -64.8 -0.7 8.9 -40.4 47 47 A E H > S+ 0 0 125 1,-0.2 4,-1.8 2,-0.2 5,-0.2 0.902 113.1 58.1 -50.0 -38.9 -4.2 7.6 -39.4 48 48 A L H X S+ 0 0 6 -4,-1.8 4,-1.3 1,-0.2 3,-0.4 0.965 99.4 55.8 -57.6 -50.3 -3.2 8.5 -35.9 49 49 A Q H >X S+ 0 0 110 -4,-1.8 4,-1.4 -3,-0.3 3,-0.6 0.897 104.8 55.4 -50.2 -38.2 -2.6 12.1 -36.8 50 50 A D H >X S+ 0 0 91 -4,-1.6 4,-0.9 1,-0.3 3,-0.5 0.935 104.0 51.7 -62.6 -42.8 -6.1 12.2 -38.1 51 51 A M H 3< S+ 0 0 67 -4,-1.8 4,-0.4 -3,-0.4 -1,-0.3 0.721 108.8 54.1 -67.1 -15.9 -7.5 11.0 -34.7 52 52 A I H << S+ 0 0 6 -4,-1.3 3,-0.5 -3,-0.6 -1,-0.2 0.760 91.4 71.1 -88.7 -25.7 -5.5 13.9 -33.2 53 53 A N H X< S+ 0 0 103 -4,-1.4 3,-1.1 -3,-0.5 -2,-0.2 0.895 99.1 49.4 -58.4 -36.6 -7.0 16.6 -35.5 54 54 A E T 3< S+ 0 0 144 -4,-0.9 -1,-0.3 1,-0.2 -2,-0.2 0.785 110.3 51.1 -74.2 -23.8 -10.3 16.2 -33.5 55 55 A V T 3 S+ 0 0 22 -3,-0.5 2,-0.4 -4,-0.4 -1,-0.2 0.119 99.8 77.6 -98.8 23.5 -8.4 16.5 -30.2 56 56 A D < + 0 0 25 -3,-1.1 7,-0.1 7,-0.1 -1,-0.1 -0.929 44.4 171.7-135.4 112.9 -6.6 19.7 -31.3 57 57 A A S S+ 0 0 97 -2,-0.4 -1,-0.1 1,-0.1 -4,-0.1 -0.067 79.8 46.0-108.9 34.4 -8.3 23.2 -31.3 58 58 A D S S- 0 0 84 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.509 102.9-111.6-141.5 -34.1 -5.2 25.3 -32.1 59 59 A G S S+ 0 0 69 3,-0.2 -6,-0.0 -6,-0.1 -2,-0.0 0.885 75.5 121.0 95.4 52.8 -3.3 23.6 -34.9 60 60 A N S S- 0 0 69 2,-0.3 3,-0.1 0, 0.0 -4,-0.0 0.513 75.3-119.1-122.3 -12.3 -0.1 22.5 -33.2 61 61 A G S S+ 0 0 40 1,-0.3 -32,-0.4 -9,-0.1 2,-0.3 0.807 85.2 71.3 78.4 27.6 -0.2 18.7 -33.9 62 62 A T S S- 0 0 32 -34,-0.1 2,-0.3 -10,-0.1 -2,-0.3 -0.989 73.4-119.4-163.0 167.2 -0.4 17.8 -30.1 63 63 A I B -A 27 0A 8 -36,-1.8 -36,-1.5 -2,-0.3 2,-0.1 -0.875 21.9-160.8-117.4 150.6 -2.7 17.9 -27.1 64 64 A D > - 0 0 56 -2,-0.3 4,-1.1 -38,-0.2 5,-0.1 -0.335 37.1 -91.2-112.6-163.0 -2.2 19.7 -23.8 65 65 A F H > S+ 0 0 96 2,-0.2 4,-2.0 1,-0.2 5,-0.3 0.893 120.9 50.7 -81.6 -40.7 -3.6 19.4 -20.3 66 66 A P H > S+ 0 0 80 0, 0.0 4,-1.2 0, 0.0 -1,-0.2 0.752 113.0 48.0 -70.8 -21.4 -6.6 21.8 -20.7 67 67 A E H > S+ 0 0 39 2,-0.2 4,-1.1 3,-0.1 5,-0.2 0.855 111.0 49.1 -86.1 -35.2 -7.6 20.1 -23.9 68 68 A F H X S+ 0 0 8 -4,-1.1 4,-1.6 2,-0.2 5,-0.2 0.896 118.5 39.1 -70.8 -38.5 -7.5 16.6 -22.4 69 69 A L H X S+ 0 0 40 -4,-2.0 4,-1.5 2,-0.2 -2,-0.2 0.877 114.8 51.7 -80.6 -37.1 -9.5 17.5 -19.3 70 70 A T H < S+ 0 0 78 -4,-1.2 -1,-0.2 -5,-0.3 4,-0.2 0.758 114.2 46.0 -71.4 -20.3 -12.0 19.8 -21.1 71 71 A M H X S+ 0 0 78 -4,-1.1 4,-0.6 2,-0.1 3,-0.3 0.878 121.3 33.1 -88.8 -42.3 -12.7 17.0 -23.7 72 72 A M H < S+ 0 0 34 -4,-1.6 -2,-0.2 -5,-0.2 -3,-0.1 0.598 109.4 67.0 -90.5 -9.7 -13.1 14.0 -21.3 73 73 A A T < S+ 0 0 53 -4,-1.5 -1,-0.2 -5,-0.2 -3,-0.1 0.620 98.1 56.0 -85.1 -9.9 -14.7 16.1 -18.4 74 74 A R T 4 S- 0 0 194 -3,-0.3 -2,-0.1 -4,-0.2 -3,-0.1 0.921 128.6 -34.4 -84.1 -81.6 -17.8 16.8 -20.5 75 75 A K < + 0 0 161 -4,-0.6 2,-1.0 1,-0.1 -3,-0.1 0.707 62.7 153.2-107.4 -87.1 -19.4 13.5 -21.6 76 76 A M S S+ 0 0 118 -5,-0.1 2,-0.3 2,-0.0 -1,-0.1 -0.108 79.3 3.4 80.1 -40.5 -17.0 10.6 -22.5 77 77 A K S S- 0 0 156 -2,-1.0 2,-0.4 -5,-0.1 0, 0.0 -0.894 73.3-112.4-157.1-173.5 -19.7 8.0 -21.6 78 78 A D + 0 0 108 -2,-0.3 2,-0.3 2,-0.0 61,-0.1 -0.917 30.8 162.2-138.9 114.3 -23.4 7.7 -20.6 79 79 A T - 0 0 94 -2,-0.4 -2,-0.0 59,-0.1 -1,-0.0 -0.668 23.0-157.9-130.9 80.2 -24.6 6.4 -17.2 80 80 A D - 0 0 86 -2,-0.3 2,-0.4 1,-0.1 62,-0.1 -0.250 6.5-163.4 -56.2 141.5 -28.2 7.4 -16.5 81 81 A S + 0 0 84 61,-0.0 2,-0.3 5,-0.0 -1,-0.1 -0.862 18.3 159.8-133.6 102.3 -29.0 7.4 -12.8 82 82 A E > - 0 0 97 -2,-0.4 4,-1.3 1,-0.1 5,-0.2 -0.825 52.3-112.7-119.4 160.5 -32.7 7.4 -11.7 83 83 A E H > S+ 0 0 108 -2,-0.3 4,-0.7 2,-0.2 5,-0.1 0.663 115.6 52.5 -65.6 -11.1 -34.5 6.4 -8.5 84 84 A E H > S+ 0 0 133 2,-0.2 4,-1.8 3,-0.1 3,-0.2 0.935 113.8 33.8 -88.9 -65.2 -36.0 3.5 -10.4 85 85 A I H > S+ 0 0 6 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.661 113.2 68.5 -66.2 -10.2 -33.1 1.7 -12.1 86 86 A R H X S+ 0 0 141 -4,-1.3 4,-1.4 2,-0.2 -1,-0.2 0.975 104.6 35.8 -73.5 -54.7 -31.0 2.6 -9.0 87 87 A E H X S+ 0 0 111 -4,-0.7 4,-1.5 -3,-0.2 5,-0.2 0.887 114.4 60.6 -66.3 -35.5 -32.8 0.3 -6.5 88 88 A A H >X S+ 0 0 16 -4,-1.8 4,-1.7 1,-0.2 3,-0.8 0.970 107.3 42.2 -57.3 -54.2 -33.2 -2.3 -9.2 89 89 A F H 3X S+ 0 0 25 -4,-1.7 4,-1.3 1,-0.2 -1,-0.2 0.831 110.1 60.0 -64.3 -27.4 -29.5 -2.7 -9.8 90 90 A R H 3< S+ 0 0 193 -4,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.804 111.0 39.7 -71.3 -25.8 -29.0 -2.6 -6.0 91 91 A V H << S+ 0 0 73 -4,-1.5 -2,-0.2 -3,-0.8 -1,-0.2 0.703 117.3 47.9 -95.1 -21.3 -31.2 -5.7 -5.5 92 92 A F H < S+ 0 0 35 -4,-1.7 2,-0.7 -5,-0.2 9,-0.3 0.615 105.1 63.9 -93.6 -11.9 -29.9 -7.6 -8.6 93 93 A D < + 0 0 43 -4,-1.3 -1,-0.2 -5,-0.2 7,-0.1 -0.790 51.2 137.1-114.2 92.1 -26.2 -7.1 -7.7 94 94 A K + 0 0 130 -2,-0.7 -1,-0.1 -3,-0.1 -2,-0.0 0.499 68.3 57.7-110.5 -6.5 -25.4 -8.8 -4.4 95 95 A D S S- 0 0 86 -3,-0.2 -2,-0.1 4,-0.2 -1,-0.0 0.867 103.0-119.2 -91.9 -39.8 -22.0 -10.3 -5.4 96 96 A G S S+ 0 0 56 3,-0.1 -3,-0.0 0, 0.0 -1,-0.0 -0.032 84.9 108.1 128.5 -35.4 -20.2 -7.1 -6.4 97 97 A N S S- 0 0 68 1,-0.1 3,-0.1 2,-0.1 -4,-0.0 0.787 83.1-128.6 -47.9 -22.8 -19.3 -7.7 -10.1 98 98 A G S S+ 0 0 19 1,-0.3 2,-0.3 -9,-0.1 40,-0.2 0.924 70.3 105.9 75.6 42.8 -22.0 -5.0 -10.8 99 99 A Y - 0 0 105 -7,-0.1 2,-0.6 38,-0.1 -1,-0.3 -0.996 68.7-122.6-152.5 146.3 -23.9 -7.2 -13.4 100 100 A I B -B 136 0B 5 36,-1.5 36,-1.4 -2,-0.3 2,-0.3 -0.797 30.4-170.2 -94.4 121.3 -27.1 -9.1 -13.5 101 101 A S > - 0 0 37 -2,-0.6 4,-2.2 -9,-0.3 5,-0.3 -0.807 35.6-115.4-109.0 151.4 -26.7 -12.9 -14.3 102 102 A A H > S+ 0 0 39 -2,-0.3 4,-1.5 32,-0.3 -1,-0.1 0.882 116.6 55.7 -51.2 -36.3 -29.4 -15.4 -15.1 103 103 A A H >> S+ 0 0 64 2,-0.2 4,-1.7 1,-0.2 3,-0.8 0.991 106.1 46.7 -62.2 -59.9 -28.4 -17.2 -11.9 104 104 A E H >> S+ 0 0 20 1,-0.3 4,-1.5 2,-0.2 3,-0.5 0.942 108.3 57.1 -48.4 -51.2 -28.8 -14.3 -9.5 105 105 A L H 3X S+ 0 0 13 -4,-2.2 4,-2.1 1,-0.3 3,-0.4 0.898 103.9 54.5 -49.2 -40.6 -32.2 -13.4 -11.0 106 106 A R H S+ 0 0 31 -4,-2.1 5,-1.8 -5,-0.2 4,-1.0 0.862 111.0 49.6 -69.5 -32.3 -37.5 -14.2 -7.7 110 110 A T H <5S+ 0 0 60 -4,-1.1 -1,-0.2 -5,-0.2 -2,-0.2 0.825 110.6 50.5 -76.4 -28.7 -37.6 -17.0 -5.1 111 111 A N H <5S+ 0 0 133 -4,-0.6 -2,-0.2 1,-0.2 -1,-0.2 0.931 102.8 57.9 -75.0 -44.2 -36.7 -14.6 -2.2 112 112 A L H <5S- 0 0 126 -4,-2.0 -1,-0.2 1,-0.1 -2,-0.2 0.884 125.8 -97.9 -54.3 -36.3 -39.3 -11.9 -3.1 113 113 A G T <5S+ 0 0 51 -4,-1.0 -3,-0.2 -5,-0.2 -2,-0.1 0.627 86.2 108.4 122.9 31.4 -42.0 -14.6 -2.7 114 114 A E < - 0 0 128 -5,-1.8 2,-0.1 2,-0.0 -1,-0.1 -0.290 60.3-127.2-116.2-156.2 -42.7 -15.8 -6.2 115 115 A K + 0 0 178 -2,-0.1 2,-0.5 2,-0.0 -5,-0.1 -0.489 31.3 163.3-161.0 84.0 -42.0 -19.0 -8.2 116 116 A L - 0 0 42 -10,-0.2 -6,-0.1 -2,-0.1 2,-0.1 -0.893 30.3-134.0-108.7 131.8 -40.2 -18.8 -11.6 117 117 A T >> - 0 0 76 -2,-0.5 4,-1.7 1,-0.1 3,-1.1 -0.383 32.6-101.4 -77.9 160.0 -38.6 -21.9 -13.2 118 118 A D H 3> S+ 0 0 88 1,-0.3 4,-2.2 2,-0.2 5,-0.3 0.853 123.0 62.5 -50.0 -33.1 -35.1 -21.7 -14.7 119 119 A E H 3> S+ 0 0 139 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.924 103.8 46.5 -61.3 -42.5 -36.8 -21.5 -18.1 120 120 A E H <> S+ 0 0 91 -3,-1.1 4,-1.8 2,-0.2 -2,-0.2 0.938 113.7 47.4 -67.7 -45.2 -38.6 -18.2 -17.2 121 121 A V H X S+ 0 0 4 -4,-1.7 4,-2.1 2,-0.2 3,-0.4 0.983 112.5 47.5 -61.7 -56.2 -35.4 -16.5 -15.8 122 122 A D H X S+ 0 0 97 -4,-2.2 4,-1.5 1,-0.3 -1,-0.2 0.930 112.7 50.0 -52.1 -46.2 -33.1 -17.5 -18.7 123 123 A E H X S+ 0 0 119 -4,-1.8 4,-1.8 -5,-0.3 -1,-0.3 0.871 109.4 53.9 -63.0 -33.1 -35.8 -16.3 -21.2 124 124 A M H >X S+ 0 0 62 -4,-1.8 4,-1.7 -3,-0.4 3,-0.8 0.997 107.1 46.4 -65.2 -62.5 -36.1 -13.0 -19.3 125 125 A I H 3X S+ 0 0 19 -4,-2.1 4,-1.4 1,-0.3 8,-0.2 0.837 111.4 57.1 -49.8 -30.4 -32.4 -12.0 -19.3 126 126 A R H 3< S+ 0 0 196 -4,-1.5 -1,-0.3 -5,-0.3 -2,-0.2 0.917 103.1 50.9 -70.2 -41.1 -32.5 -12.9 -23.0 127 127 A E H << S+ 0 0 142 -4,-1.8 -1,-0.2 -3,-0.8 -2,-0.2 0.832 117.8 40.0 -66.7 -28.7 -35.3 -10.5 -23.8 128 128 A A H < S+ 0 0 13 -4,-1.7 2,-1.9 -5,-0.1 3,-0.3 0.665 93.3 90.5 -93.6 -17.0 -33.3 -7.7 -22.1 129 129 A D < + 0 0 15 -4,-1.4 -1,-0.1 -5,-0.3 7,-0.1 -0.518 41.0 142.4 -81.2 82.6 -29.9 -8.7 -23.4 130 130 A I S S+ 0 0 110 -2,-1.9 -1,-0.2 1,-0.1 -2,-0.1 0.804 85.3 10.2 -89.5 -32.5 -29.8 -6.6 -26.6 131 131 A D S S+ 0 0 79 -3,-0.3 -2,-0.1 4,-0.1 5,-0.1 0.512 133.1 46.8-121.8 -13.1 -26.1 -5.7 -26.4 132 132 A G - 0 0 28 -4,-0.2 4,-0.2 5,-0.1 -3,-0.1 0.894 68.7-179.8 -95.2 -63.5 -24.8 -8.0 -23.6 133 133 A D S S+ 0 0 103 2,-0.3 -7,-0.1 -8,-0.2 3,-0.1 0.872 77.6 30.0 60.0 100.5 -26.2 -11.4 -24.3 134 134 A G S S+ 0 0 71 -9,-0.1 2,-0.3 -5,-0.0 -32,-0.3 0.104 131.1 31.5 105.1 -21.0 -24.9 -13.7 -21.5 135 135 A Q - 0 0 62 -10,-0.1 2,-0.3 -34,-0.1 -2,-0.3 -0.987 69.6-141.9-162.1 153.2 -24.9 -10.8 -19.0 136 136 A V B -B 100 0B 1 -36,-1.4 -36,-1.5 -2,-0.3 2,-0.2 -0.897 16.1-174.5-122.1 152.7 -26.8 -7.5 -18.3 137 137 A N > - 0 0 37 -2,-0.3 4,-1.8 -38,-0.2 5,-0.2 -0.613 44.5 -77.9-130.0-168.8 -25.5 -4.1 -17.2 138 138 A Y H > S+ 0 0 50 -40,-0.2 4,-1.9 -2,-0.2 3,-0.3 0.992 123.8 48.6 -59.6 -64.3 -26.9 -0.7 -16.1 139 139 A E H >> S+ 0 0 93 1,-0.2 4,-1.9 2,-0.2 3,-0.6 0.923 109.5 53.8 -43.3 -55.5 -27.7 0.7 -19.6 140 140 A E H 3> S+ 0 0 1 1,-0.3 4,-1.8 2,-0.2 3,-0.5 0.933 108.1 49.3 -48.4 -51.4 -29.5 -2.5 -20.6 141 141 A F H 3X S+ 0 0 14 -4,-1.8 4,-1.3 -3,-0.3 5,-0.3 0.860 111.2 51.0 -59.6 -33.0 -31.8 -2.4 -17.6 142 142 A V H