==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER METAL BINDING PROTEIN 20-JUN-03 1PRW . COMPND 2 MOLECULE: CALMODULIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR J.L.FALLON,F.A.QUIOCHO . 148 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8213.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 97 65.5 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 . 5 3.4 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 . 12 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 70 47.3 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 1 0 0 2 3 1 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 . 1 1 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 . 1 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 66 0, 0.0 3,-1.0 0, 0.0 8,-0.1 0.000 360.0 360.0 360.0 -34.4 59.2 25.4 1.8 2 2 A D T 3 + 0 0 147 1,-0.2 3,-0.0 3,-0.0 68,-0.0 0.471 360.0 47.3 -75.0 -1.7 58.1 28.2 -0.5 3 3 A Q T 3 S+ 0 0 71 2,-0.1 145,-0.6 66,-0.0 2,-0.3 0.382 104.0 72.5-117.2 -0.6 55.7 29.4 2.2 4 4 A L S < S- 0 0 20 -3,-1.0 2,-0.1 143,-0.1 143,-0.1 -0.836 75.2-118.5-121.4 155.8 58.0 29.3 5.2 5 5 A T > - 0 0 55 -2,-0.3 4,-2.4 1,-0.1 5,-0.2 -0.409 37.8-106.8 -80.8 164.4 60.9 31.3 6.6 6 6 A E H > S+ 0 0 168 1,-0.2 4,-2.0 2,-0.2 -1,-0.1 0.822 121.7 53.3 -62.4 -30.1 64.2 29.5 7.0 7 7 A E H > S+ 0 0 92 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.895 108.2 48.4 -72.2 -40.0 63.7 29.6 10.8 8 8 A Q H > S+ 0 0 3 2,-0.2 4,-2.8 1,-0.2 -2,-0.2 0.926 111.7 50.4 -64.8 -43.2 60.3 28.0 10.5 9 9 A I H X S+ 0 0 32 -4,-2.4 4,-1.3 1,-0.2 -1,-0.2 0.915 109.7 51.1 -60.4 -42.3 61.7 25.3 8.2 10 10 A A H X S+ 0 0 24 -4,-2.0 4,-1.1 1,-0.2 3,-0.4 0.929 111.5 47.0 -60.7 -46.7 64.5 24.7 10.8 11 11 A E H >X S+ 0 0 24 -4,-2.4 4,-1.7 1,-0.2 3,-0.5 0.919 110.9 51.4 -61.9 -45.2 62.0 24.3 13.6 12 12 A F H 3X S+ 0 0 8 -4,-2.8 4,-2.5 1,-0.2 -1,-0.2 0.726 97.8 66.3 -67.7 -20.8 59.8 21.9 11.6 13 13 A K H 3X S+ 0 0 126 -4,-1.3 4,-1.0 -3,-0.4 -1,-0.2 0.927 108.3 40.7 -63.3 -42.1 62.8 19.7 10.7 14 14 A E H - 0 0 44 -2,-0.5 4,-2.6 -9,-0.2 5,-0.2 -0.529 33.3-105.8 -97.8 168.5 51.8 7.8 9.0 29 29 A T H > S+ 0 0 21 32,-0.3 4,-2.1 1,-0.2 5,-0.1 0.899 122.3 50.1 -57.9 -41.7 48.2 8.6 9.8 30 30 A K H > S+ 0 0 160 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.911 110.7 47.5 -64.4 -45.2 48.6 6.8 13.2 31 31 A E H > S+ 0 0 10 1,-0.2 4,-2.4 2,-0.2 5,-0.3 0.903 110.6 53.3 -63.0 -41.8 51.8 8.6 14.1 32 32 A L H X S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.2 5,-0.2 0.912 110.8 47.1 -59.9 -43.5 50.2 12.0 13.2 33 33 A G H X S+ 0 0 3 -4,-2.1 4,-2.6 -5,-0.2 5,-0.3 0.961 111.7 48.7 -64.0 -51.8 47.2 11.2 15.5 34 34 A T H X S+ 0 0 50 -4,-2.6 4,-1.4 1,-0.2 -2,-0.2 0.927 116.7 41.5 -54.4 -50.6 49.3 10.1 18.4 35 35 A V H X S+ 0 0 4 -4,-2.4 4,-1.2 2,-0.2 -1,-0.2 0.910 113.9 51.2 -68.0 -42.4 51.6 13.2 18.3 36 36 A M H <>S+ 0 0 13 -4,-2.4 5,-2.5 -5,-0.3 3,-0.3 0.894 109.3 50.9 -62.6 -38.8 48.9 15.7 17.6 37 37 A R H ><5S+ 0 0 106 -4,-2.6 3,-1.0 1,-0.2 -1,-0.2 0.854 109.0 52.5 -66.2 -32.0 46.8 14.4 20.5 38 38 A S H 3<5S+ 0 0 55 -4,-1.4 -1,-0.2 -5,-0.3 -2,-0.2 0.738 104.1 58.3 -74.1 -22.3 50.0 14.8 22.6 39 39 A L T 3<5S- 0 0 24 -4,-1.2 -1,-0.3 -3,-0.3 -2,-0.2 -0.015 128.8 -91.2 -98.6 30.9 50.3 18.4 21.4 40 40 A G T < 5S+ 0 0 24 -3,-1.0 -3,-0.2 1,-0.3 2,-0.2 0.504 88.8 124.2 78.1 5.7 46.9 19.5 22.7 41 41 A Q < - 0 0 25 -5,-2.5 -1,-0.3 -6,-0.2 -2,-0.0 -0.501 43.1-164.1 -94.0 166.1 45.0 18.7 19.5 42 42 A N + 0 0 141 -2,-0.2 -5,-0.1 -3,-0.1 2,-0.1 -0.192 21.4 166.0-145.7 49.7 41.9 16.4 19.2 43 43 A P - 0 0 12 0, 0.0 2,-0.1 0, 0.0 -6,-0.1 -0.358 33.1-123.9 -69.1 146.1 41.4 15.6 15.5 44 44 A T > - 0 0 76 1,-0.1 4,-2.0 -2,-0.1 5,-0.2 -0.306 29.9-102.2 -80.3 170.9 39.1 12.7 14.5 45 45 A E H > S+ 0 0 109 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.889 123.7 51.9 -62.9 -39.0 40.3 9.8 12.4 46 46 A A H > S+ 0 0 62 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.880 109.1 50.1 -65.4 -37.4 38.6 11.3 9.3 47 47 A E H > S+ 0 0 98 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.869 110.1 50.2 -69.7 -35.0 40.3 14.6 9.9 48 48 A L H X S+ 0 0 2 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.921 110.9 48.8 -68.1 -43.5 43.7 13.0 10.2 49 49 A Q H X S+ 0 0 66 -4,-2.4 4,-2.8 1,-0.2 -2,-0.2 0.893 112.1 48.9 -63.9 -38.6 43.1 11.0 7.0 50 50 A D H X S+ 0 0 81 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.901 107.8 54.8 -67.5 -40.1 42.1 14.2 5.2 51 51 A M H X S+ 0 0 32 -4,-2.3 4,-0.9 2,-0.2 -2,-0.2 0.931 113.7 42.2 -57.2 -46.0 45.1 16.1 6.6 52 52 A I H >X S+ 0 0 0 -4,-2.1 4,-1.2 1,-0.2 3,-1.1 0.972 114.5 47.8 -65.3 -57.8 47.4 13.4 5.1 53 53 A N H 3< S+ 0 0 85 -4,-2.8 3,-0.4 1,-0.2 -2,-0.2 0.860 105.0 61.4 -53.9 -39.7 45.6 13.0 1.7 54 54 A E H 3< S+ 0 0 122 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.806 119.3 25.1 -59.8 -32.5 45.5 16.7 1.1 55 55 A V H << S+ 0 0 10 -3,-1.1 2,-2.3 -4,-0.9 -1,-0.2 0.352 88.9 108.6-114.3 4.0 49.3 17.1 1.2 56 56 A D >< + 0 0 17 -4,-1.2 3,-1.6 -3,-0.4 5,-0.2 -0.513 44.0 172.2 -81.3 74.3 50.2 13.6 0.1 57 57 A A T 3 S+ 0 0 99 -2,-2.3 -1,-0.2 1,-0.3 6,-0.1 0.721 72.7 44.5 -58.6 -30.1 51.4 14.8 -3.3 58 58 A D T 3 S- 0 0 91 4,-0.2 -1,-0.3 -3,-0.2 -2,-0.1 0.326 103.5-130.2 -99.0 8.9 52.9 11.5 -4.5 59 59 A G < + 0 0 58 -3,-1.6 -2,-0.1 -6,-0.1 -3,-0.1 0.787 64.7 133.5 49.6 38.2 49.9 9.5 -3.2 60 60 A N S S- 0 0 87 2,-0.3 -1,-0.1 0, 0.0 3,-0.1 0.362 74.5-113.7 -97.0 6.2 52.0 6.9 -1.3 61 61 A G S S+ 0 0 34 1,-0.2 -32,-0.3 -5,-0.2 2,-0.3 0.322 87.2 78.0 83.8 -10.0 49.8 7.2 1.8 62 62 A T S S- 0 0 30 -34,-0.1 2,-0.5 -10,-0.1 -2,-0.3 -0.804 75.1-117.4-127.0 170.6 52.5 8.7 4.0 63 63 A I B -A 27 0A 1 -36,-2.2 -36,-2.3 -2,-0.3 2,-0.1 -0.934 22.9-168.7-115.2 122.7 54.0 12.1 4.6 64 64 A D > - 0 0 50 -2,-0.5 4,-2.0 -38,-0.2 5,-0.2 -0.297 45.4 -84.5 -93.5-174.0 57.7 12.9 4.0 65 65 A F H > S+ 0 0 56 -40,-0.3 4,-2.3 2,-0.2 5,-0.2 0.937 126.3 48.3 -60.2 -51.0 59.5 16.1 5.0 66 66 A P H > S+ 0 0 80 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.912 114.8 46.6 -56.8 -42.0 58.6 18.3 2.0 67 67 A E H > S+ 0 0 12 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.835 109.0 56.6 -67.7 -32.0 54.9 17.2 2.3 68 68 A F H X S+ 0 0 1 -4,-2.0 4,-2.6 2,-0.2 -1,-0.2 0.900 103.0 53.6 -65.7 -41.6 55.1 17.9 6.1 69 69 A L H X S+ 0 0 6 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.907 108.1 50.7 -60.5 -38.7 56.2 21.5 5.4 70 70 A T H X S+ 0 0 42 -4,-1.4 4,-2.4 1,-0.2 -1,-0.2 0.898 109.6 50.9 -64.8 -40.3 53.1 21.9 3.2 71 71 A M H X S+ 0 0 9 -4,-1.9 4,-2.2 1,-0.2 -2,-0.2 0.905 111.3 47.3 -64.0 -42.4 50.9 20.5 6.0 72 72 A M H X S+ 0 0 28 -4,-2.6 4,-1.8 2,-0.2 -2,-0.2 0.898 110.7 51.7 -66.4 -40.7 52.4 22.9 8.5 73 73 A A H < S+ 0 0 4 -4,-2.4 4,-0.3 1,-0.2 -2,-0.2 0.942 113.8 43.4 -61.4 -47.1 52.0 25.9 6.2 74 74 A R H >< S+ 0 0 125 -4,-2.4 3,-1.6 1,-0.2 -1,-0.2 0.862 107.9 59.9 -66.8 -36.2 48.3 25.0 5.6 75 75 A K H >< S+ 0 0 40 -4,-2.2 3,-2.1 1,-0.3 -1,-0.2 0.895 96.0 61.7 -58.2 -40.9 47.8 24.4 9.3 76 76 A M T 3< S+ 0 0 16 -4,-1.8 71,-0.3 1,-0.3 -1,-0.3 0.673 105.9 48.5 -60.5 -16.1 48.8 27.9 10.1 77 77 A K T < S+ 0 0 138 -3,-1.6 -1,-0.3 -4,-0.3 -2,-0.2 0.349 79.6 131.5-106.4 4.3 45.8 29.0 8.0 78 78 A D X - 0 0 55 -3,-2.1 3,-1.8 -4,-0.2 4,-0.3 -0.212 68.5-120.2 -54.4 149.3 43.2 26.7 9.6 79 79 A T T 3 S+ 0 0 134 1,-0.3 3,-0.3 2,-0.1 -1,-0.1 0.845 117.5 39.7 -61.7 -32.1 40.0 28.6 10.5 80 80 A D T 3> S+ 0 0 91 1,-0.2 4,-2.4 2,-0.1 -1,-0.3 0.030 79.6 122.4-104.7 26.0 40.7 27.5 14.1 81 81 A S H <> + 0 0 27 -3,-1.8 4,-3.0 1,-0.2 5,-0.3 0.884 69.2 56.6 -55.9 -42.8 44.4 28.1 14.0 82 82 A E H > S+ 0 0 135 -3,-0.3 4,-2.1 -4,-0.3 -1,-0.2 0.937 111.5 43.4 -55.4 -48.6 44.5 30.5 16.9 83 83 A E H > S+ 0 0 93 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.929 113.5 50.7 -63.0 -46.8 42.8 28.0 19.2 84 84 A E H X S+ 0 0 36 -4,-2.4 4,-1.7 1,-0.2 -2,-0.2 0.897 111.2 48.7 -59.3 -42.2 45.0 25.1 18.0 85 85 A I H X S+ 0 0 22 -4,-3.0 4,-2.5 2,-0.2 -1,-0.2 0.883 110.2 51.8 -66.6 -37.7 48.1 27.1 18.6 86 86 A R H X S+ 0 0 111 -4,-2.1 4,-2.3 -5,-0.3 -2,-0.2 0.922 109.1 50.1 -63.9 -44.3 46.9 28.1 22.1 87 87 A E H X S+ 0 0 70 -4,-2.5 4,-1.3 1,-0.2 -1,-0.2 0.855 110.8 49.8 -63.5 -34.6 46.3 24.5 23.0 88 88 A A H X S+ 0 0 15 -4,-1.7 4,-1.4 2,-0.2 3,-0.4 0.941 108.7 51.5 -69.4 -46.8 49.8 23.5 21.7 89 89 A F H X S+ 0 0 17 -4,-2.5 4,-2.8 1,-0.2 3,-0.4 0.915 104.5 59.1 -54.9 -43.0 51.4 26.3 23.8 90 90 A R H < S+ 0 0 186 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.888 100.3 55.6 -53.6 -43.0 49.5 25.0 26.8 91 91 A V H < S+ 0 0 21 -4,-1.3 -1,-0.2 -3,-0.4 -2,-0.2 0.898 113.7 40.2 -59.3 -41.0 51.2 21.6 26.5 92 92 A F H < S+ 0 0 27 -4,-1.4 2,-2.4 -3,-0.4 9,-0.2 0.909 102.0 69.5 -75.7 -43.4 54.6 23.2 26.6 93 93 A D >< + 0 0 16 -4,-2.8 3,-1.5 1,-0.2 -1,-0.2 -0.421 62.3 167.6 -78.6 70.9 54.0 25.8 29.3 94 94 A K T 3 S+ 0 0 100 -2,-2.4 -1,-0.2 1,-0.3 6,-0.1 0.823 73.7 42.5 -52.8 -42.9 53.7 23.2 32.1 95 95 A D T 3 S- 0 0 106 4,-0.2 -1,-0.3 -3,-0.2 -2,-0.1 0.386 103.1-130.3 -90.6 5.5 53.9 25.7 35.0 96 96 A G < + 0 0 58 -3,-1.5 -2,-0.1 -6,-0.2 4,-0.1 0.720 65.3 131.6 55.8 29.5 51.6 28.2 33.3 97 97 A N S S- 0 0 78 2,-0.3 -1,-0.1 1,-0.0 3,-0.1 0.451 81.0-105.0 -90.5 2.4 53.8 31.3 33.8 98 98 A G S S+ 0 0 28 1,-0.2 40,-1.0 -5,-0.1 2,-0.4 0.489 91.6 90.7 91.6 2.8 53.5 32.3 30.1 99 99 A Y E -B 137 0B 89 38,-0.2 2,-0.7 39,-0.1 -2,-0.3 -0.991 67.5-137.4-133.8 140.9 57.0 31.1 29.1 100 100 A I E -B 136 0B 8 36,-2.3 36,-2.1 -2,-0.4 2,-0.1 -0.874 29.5-160.3 -97.6 116.9 58.3 27.9 27.7 101 101 A S > - 0 0 26 -2,-0.7 4,-2.5 -9,-0.2 5,-0.2 -0.449 32.6-107.4 -90.6 167.2 61.6 27.1 29.4 102 102 A A H > S+ 0 0 26 32,-0.3 4,-2.7 1,-0.2 5,-0.2 0.880 122.9 54.8 -61.2 -36.6 64.4 24.8 28.3 103 103 A A H > S+ 0 0 52 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.924 109.4 45.8 -62.5 -44.6 63.2 22.4 31.1 104 104 A E H > S+ 0 0 14 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.876 112.0 50.9 -67.3 -38.2 59.7 22.4 29.8 105 105 A L H X S+ 0 0 13 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.934 110.3 49.9 -65.3 -43.1 60.8 21.9 26.2 106 106 A R H X S+ 0 0 92 -4,-2.7 4,-2.6 1,-0.2 5,-0.2 0.878 108.1 55.2 -61.5 -35.6 62.9 18.9 27.3 107 107 A H H X S+ 0 0 95 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.919 108.7 45.4 -65.9 -42.5 59.9 17.5 29.2 108 108 A V H X S+ 0 0 4 -4,-2.0 4,-1.7 2,-0.2 6,-0.2 0.944 114.5 49.2 -65.6 -45.5 57.7 17.5 26.1 109 109 A M H <>S+ 0 0 1 -4,-2.4 5,-2.6 1,-0.2 -2,-0.2 0.910 112.6 46.4 -59.1 -45.4 60.5 16.0 24.0 110 110 A T H ><5S+ 0 0 85 -4,-2.6 3,-1.5 1,-0.2 -1,-0.2 0.854 109.5 54.2 -68.7 -34.2 61.2 13.3 26.5 111 111 A N H 3<5S+ 0 0 100 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.841 107.0 53.1 -67.0 -30.5 57.5 12.5 26.9 112 112 A L T 3<5S- 0 0 37 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.220 120.4-111.5 -88.3 15.0 57.4 12.1 23.1 113 113 A G T < 5 + 0 0 64 -3,-1.5 2,-0.6 1,-0.2 -3,-0.2 0.592 69.6 146.7 67.3 11.1 60.2 9.6 23.2 114 114 A E < - 0 0 35 -5,-2.6 -1,-0.2 -6,-0.2 -2,-0.1 -0.703 44.8-138.5 -85.2 116.4 62.5 12.1 21.5 115 115 A X - 0 0 255 -2,-0.6 2,-0.3 -3,-0.1 -1,-0.0 -0.441 31.2-169.2 -68.8 148.5 66.1 11.8 22.6 116 116 A L - 0 0 54 -2,-0.1 2,-0.3 4,-0.0 3,-0.1 -0.876 24.1-153.0-139.5 169.9 67.6 15.3 23.0 117 117 A T > - 0 0 71 -2,-0.3 4,-2.0 1,-0.1 5,-0.2 -0.960 31.9-119.2-138.1 152.2 70.8 17.3 23.6 118 118 A D H > S+ 0 0 90 -2,-0.3 4,-3.1 1,-0.2 5,-0.2 0.912 115.4 56.4 -59.7 -42.6 71.2 20.7 25.3 119 119 A E H > S+ 0 0 134 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.896 107.9 48.9 -55.1 -40.9 72.6 22.1 22.0 120 120 A E H > S+ 0 0 40 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.905 111.8 47.3 -65.8 -43.8 69.5 21.0 20.2 121 121 A V H X S+ 0 0 1 -4,-2.0 4,-2.2 1,-0.2 5,-0.2 0.926 110.8 52.8 -64.6 -43.7 67.2 22.5 22.9 122 122 A D H X S+ 0 0 71 -4,-3.1 4,-2.6 1,-0.2 -1,-0.2 0.886 109.7 48.6 -58.5 -41.5 69.1 25.8 22.8 123 123 A E H X S+ 0 0 74 -4,-1.9 4,-2.3 -5,-0.2 -1,-0.2 0.884 108.4 53.1 -68.1 -39.8 68.8 26.0 19.0 124 124 A M H X S+ 0 0 25 -4,-2.1 4,-0.6 1,-0.2 -2,-0.2 0.934 115.4 40.5 -61.5 -45.2 65.1 25.4 19.0 125 125 A I H >X S+ 0 0 10 -4,-2.2 4,-1.9 1,-0.2 3,-1.1 0.915 111.9 57.2 -67.9 -42.9 64.5 28.2 21.6 126 126 A R H 3< S+ 0 0 147 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.881 100.4 57.9 -55.4 -42.6 67.1 30.4 19.8 127 127 A E H 3< S+ 0 0 34 -4,-2.3 -1,-0.3 1,-0.2 -2,-0.2 0.746 120.1 27.8 -63.8 -23.4 65.2 30.3 16.5 128 128 A A H << S+ 0 0 9 -3,-1.1 2,-1.9 -4,-0.6 -1,-0.2 0.513 91.0 107.3-114.1 -8.4 62.0 31.6 18.1 129 129 A D < + 0 0 28 -4,-1.9 3,-0.4 1,-0.2 5,-0.1 -0.460 34.3 162.8 -78.1 77.8 63.5 33.7 20.9 130 130 A I S S+ 0 0 124 -2,-1.9 -1,-0.2 1,-0.2 6,-0.1 0.904 76.5 41.9 -62.7 -46.3 62.9 37.3 19.7 131 131 A D S S- 0 0 86 4,-0.2 -1,-0.2 1,-0.0 -2,-0.1 0.567 103.8-132.2 -81.4 -5.2 63.4 39.1 23.0 132 132 A G + 0 0 54 -3,-0.4 -2,-0.1 3,-0.1 4,-0.1 0.714 61.9 135.8 65.6 25.9 66.3 36.9 23.8 133 133 A D S S- 0 0 72 2,-0.3 -1,-0.1 1,-0.0 3,-0.1 0.357 77.7-107.7 -85.6 7.7 65.3 36.0 27.4 134 134 A G S S+ 0 0 40 1,-0.3 2,-0.3 -5,-0.1 -32,-0.3 0.522 92.8 79.8 81.3 3.8 66.2 32.3 26.8 135 135 A Q S S- 0 0 52 -34,-0.1 2,-0.6 -10,-0.1 -2,-0.3 -0.890 77.9-118.2-136.1 167.9 62.6 31.2 26.8 136 136 A V E -B 100 0B 13 -36,-2.1 -36,-2.3 -2,-0.3 -7,-0.1 -0.923 30.1-164.0-112.5 110.7 59.7 31.2 24.3 137 137 A N E > -B 99 0B 11 -2,-0.6 4,-2.3 -38,-0.2 -38,-0.2 -0.299 37.4 -95.1 -86.4 176.0 56.7 33.3 25.3 138 138 A Y H > S+ 0 0 70 -40,-1.0 4,-2.8 1,-0.2 5,-0.2 0.924 123.5 51.1 -55.1 -49.0 53.2 33.1 23.8 139 139 A E H > S+ 0 0 126 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.898 112.5 46.2 -56.8 -43.7 53.8 35.9 21.4 140 140 A E H > S+ 0 0 9 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.850 111.7 52.2 -68.0 -35.5 57.0 34.4 20.1 141 141 A F H X S+ 0 0 31 -4,-2.3 4,-1.3 2,-0.2 -2,-0.2 0.921 110.7 47.7 -66.6 -43.5 55.3 31.0 19.8 142 142 A V H < S+ 0 0 42 -4,-2.8 3,-0.2 1,-0.2 -2,-0.2 0.906 108.7 54.3 -64.4 -41.9 52.5 32.5 17.8 143 143 A Q H >< S+ 0 0 80 -4,-2.2 3,-1.6 1,-0.2 -1,-0.2 0.902 105.9 52.1 -59.5 -42.5 54.9 34.3 15.5 144 144 A M H 3< S+ 0 0 22 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.838 112.5 46.7 -63.3 -31.3 56.7 31.1 14.7 145 145 A M T 3< S+ 0 0 35 -4,-1.3 2,-0.5 -3,-0.2 -1,-0.3 0.072 92.0 105.7 -99.1 24.3 53.3 29.6 13.8 146 146 A T S < S- 0 0 40 -3,-1.6 2,-0.3 -5,-0.1 -69,-0.1 -0.907 72.6-123.4-109.1 129.7 52.2 32.5 11.7 147 147 A A 0 0 34 -2,-0.5 -143,-0.1 -71,-0.3 -2,-0.1 -0.525 360.0 360.0 -70.4 126.4 52.2 32.3 7.9 148 148 A K 0 0 172 -145,-0.6 -1,-0.1 -2,-0.3 -2,-0.0 -0.482 360.0 360.0-107.0 360.0 54.4 35.1 6.4