==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER METAL BINDING PROTEIN 30-OCT-08 3F32 . COMPND 2 MOLECULE: FERRITIN LIGHT CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: EQUUS CABALLUS; . AUTHOR L.S.VEDULA,N.J.ECONOMOU,M.J.ROSSI,R.G.ECKENHOFF,P.J.LOLL . 168 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9514.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 131 78.0 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 . 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 . 3 1.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 7 4.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 115 68.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 3.0 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 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 3 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 . 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 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 2 A S > 0 0 80 0, 0.0 3,-0.7 0, 0.0 72,-0.0 0.000 360.0 360.0 360.0 131.0 51.9 18.1 21.7 2 3 A Q T 3 + 0 0 197 1,-0.2 70,-0.0 3,-0.0 0, 0.0 0.768 360.0 38.7 -58.1 -28.6 51.4 19.7 18.2 3 4 A I T 3 S+ 0 0 90 69,-0.0 -1,-0.2 2,-0.0 2,-0.1 0.623 84.2 119.4 -98.4 -14.6 47.7 20.5 18.9 4 5 A R < + 0 0 74 -3,-0.7 2,-0.3 68,-0.2 68,-0.1 -0.328 33.4 161.8 -63.2 128.3 48.0 21.6 22.6 5 6 A Q - 0 0 156 66,-0.4 3,-0.1 -2,-0.1 -3,-0.0 -0.937 63.6 -11.0-152.4 123.7 46.9 25.2 23.0 6 7 A N S S+ 0 0 96 -2,-0.3 2,-0.6 1,-0.2 -2,-0.0 0.800 91.8 131.6 59.8 32.1 45.8 27.1 26.2 7 8 A Y - 0 0 10 64,-0.1 -1,-0.2 65,-0.0 114,-0.0 -0.904 47.1-148.6-122.3 102.2 45.7 23.8 28.1 8 9 A S > - 0 0 19 -2,-0.6 4,-2.3 1,-0.1 5,-0.1 -0.242 20.6-124.3 -75.3 155.2 47.5 24.1 31.4 9 10 A T H > S+ 0 0 91 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.842 112.7 59.4 -62.4 -30.5 49.4 21.2 33.1 10 11 A E H > S+ 0 0 96 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.918 108.0 42.2 -66.5 -42.8 47.2 21.9 36.2 11 12 A V H > S+ 0 0 0 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.922 111.6 55.9 -69.2 -43.8 43.9 21.3 34.3 12 13 A E H X S+ 0 0 31 -4,-2.3 4,-1.8 1,-0.2 -2,-0.2 0.916 111.4 43.7 -52.6 -48.2 45.4 18.3 32.5 13 14 A A H X S+ 0 0 35 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.893 113.2 51.1 -65.6 -41.4 46.3 16.7 35.9 14 15 A A H X S+ 0 0 14 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.844 106.5 54.4 -66.2 -34.6 42.9 17.6 37.4 15 16 A V H X S+ 0 0 0 -4,-2.7 4,-2.3 2,-0.2 -1,-0.2 0.919 108.0 50.3 -66.8 -41.5 41.1 16.1 34.4 16 17 A N H X S+ 0 0 19 -4,-1.8 4,-1.8 -5,-0.2 -2,-0.2 0.901 110.7 49.3 -61.0 -38.1 43.0 12.8 35.1 17 18 A R H X S+ 0 0 158 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.914 109.7 51.4 -65.9 -39.7 42.0 13.0 38.8 18 19 A L H X S+ 0 0 5 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.870 105.4 55.6 -68.3 -37.0 38.3 13.6 37.8 19 20 A V H X S+ 0 0 3 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.926 108.3 48.7 -54.1 -46.7 38.4 10.5 35.5 20 21 A N H X S+ 0 0 38 -4,-1.8 4,-2.6 1,-0.2 -2,-0.2 0.932 110.4 50.9 -61.1 -43.8 39.5 8.4 38.4 21 22 A L H X S+ 0 0 58 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.877 111.4 47.8 -61.8 -41.3 36.7 9.9 40.6 22 23 A Y H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.889 112.6 47.8 -68.2 -39.9 34.1 9.1 37.9 23 24 A L H X S+ 0 0 41 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.884 111.6 51.1 -66.7 -40.1 35.4 5.5 37.4 24 25 A R H X S+ 0 0 56 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.899 110.1 49.7 -59.4 -44.0 35.4 5.1 41.2 25 26 A A H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.922 109.4 51.4 -61.5 -45.3 31.8 6.3 41.2 26 27 A S H X S+ 0 0 16 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.921 110.9 48.7 -55.0 -44.9 30.9 3.8 38.4 27 28 A Y H X S+ 0 0 105 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.898 109.0 52.6 -63.3 -43.4 32.5 1.0 40.5 28 29 A T H X S+ 0 0 9 -4,-2.4 4,-2.7 1,-0.2 -1,-0.2 0.920 111.1 47.0 -58.7 -44.1 30.5 2.1 43.6 29 30 A Y H X S+ 0 0 0 -4,-2.5 4,-2.9 2,-0.2 -1,-0.2 0.822 107.7 56.0 -70.8 -31.3 27.2 2.0 41.6 30 31 A L H X S+ 0 0 70 -4,-2.0 4,-2.5 -5,-0.2 -1,-0.2 0.938 110.6 45.9 -59.9 -47.3 28.2 -1.4 40.2 31 32 A S H X S+ 0 0 33 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.940 113.0 49.5 -60.1 -49.8 28.5 -2.6 43.8 32 33 A L H X S+ 0 0 0 -4,-2.7 4,-1.8 1,-0.2 -2,-0.2 0.939 110.5 51.3 -53.9 -49.6 25.2 -0.9 44.8 33 34 A G H X S+ 0 0 0 -4,-2.9 4,-0.9 1,-0.2 -2,-0.2 0.939 111.7 44.4 -57.2 -49.6 23.4 -2.5 41.9 34 35 A F H < S+ 0 0 97 -4,-2.5 4,-0.4 1,-0.2 -1,-0.2 0.811 106.9 60.6 -72.2 -23.5 24.5 -6.1 42.5 35 36 A Y H >< S+ 0 0 29 -4,-2.0 3,-1.5 1,-0.2 7,-0.3 0.933 104.9 48.1 -64.3 -42.2 23.8 -5.7 46.2 36 37 A F H 3< S+ 0 0 0 -4,-1.8 7,-2.4 1,-0.3 11,-0.3 0.677 104.9 61.7 -74.3 -12.7 20.1 -5.0 45.5 37 38 A D T 3< S+ 0 0 101 -4,-0.9 -1,-0.3 -3,-0.2 -2,-0.2 0.492 78.2 116.5 -83.9 -8.3 20.2 -8.1 43.1 38 39 A R S X> S- 0 0 82 -3,-1.5 4,-2.5 -4,-0.4 3,-1.8 -0.346 75.5-126.0 -60.1 143.3 21.0 -10.4 46.1 39 40 A D T 34 S+ 0 0 153 1,-0.3 -1,-0.1 2,-0.2 -3,-0.0 0.770 112.1 53.1 -65.0 -23.2 18.3 -12.9 46.8 40 41 A D T 34 S+ 0 0 101 1,-0.0 -1,-0.3 0, 0.0 -2,-0.1 0.284 120.9 31.4 -93.9 11.1 18.1 -11.7 50.4 41 42 A V T <4 S+ 0 0 31 -3,-1.8 -2,-0.2 -5,-0.1 -5,-0.1 0.555 79.7 171.6-125.8 -63.9 17.7 -8.1 49.3 42 43 A A < + 0 0 66 -4,-2.5 2,-0.5 -7,-0.3 -5,-0.2 0.906 16.6 143.8 60.6 55.0 15.7 -8.5 46.0 43 44 A L >> - 0 0 17 -7,-2.4 4,-2.3 1,-0.1 3,-0.8 -0.781 21.9-179.1-124.3 87.8 14.7 -5.0 45.0 44 45 A E H 3> S+ 0 0 147 -2,-0.5 4,-2.8 1,-0.3 5,-0.2 0.851 78.1 54.8 -62.0 -39.0 15.0 -5.1 41.2 45 46 A G H 3> S+ 0 0 13 2,-0.2 4,-1.9 1,-0.2 -1,-0.3 0.843 110.5 47.1 -61.9 -34.7 14.0 -1.5 40.6 46 47 A V H <> S+ 0 0 0 -3,-0.8 4,-2.2 2,-0.2 5,-0.3 0.904 110.6 52.2 -73.9 -42.7 16.8 -0.3 43.0 47 48 A C H X S+ 0 0 16 -4,-2.3 4,-2.5 -11,-0.3 -2,-0.2 0.948 111.8 46.6 -54.9 -47.2 19.3 -2.6 41.3 48 49 A H H X S+ 0 0 133 -4,-2.8 4,-2.3 1,-0.2 -1,-0.2 0.885 108.0 56.3 -65.7 -39.3 18.3 -1.1 37.9 49 50 A F H X S+ 0 0 25 -4,-1.9 4,-1.6 1,-0.2 -1,-0.2 0.925 113.9 39.6 -57.3 -48.0 18.5 2.5 39.2 50 51 A F H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.856 111.8 55.0 -77.4 -31.9 22.1 2.0 40.3 51 52 A R H X S+ 0 0 121 -4,-2.5 4,-1.7 -5,-0.3 -1,-0.2 0.907 108.0 51.0 -66.6 -37.4 23.2 -0.1 37.4 52 53 A E H X S+ 0 0 68 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.911 109.6 50.2 -60.7 -43.4 22.1 2.7 35.1 53 54 A L H X S+ 0 0 4 -4,-1.6 4,-2.5 1,-0.2 5,-0.2 0.871 105.0 57.3 -65.8 -35.1 24.1 5.2 37.2 54 55 A A H X S+ 0 0 7 -4,-2.3 4,-1.9 -25,-0.2 -1,-0.2 0.926 109.1 46.3 -58.2 -43.6 27.2 2.9 36.9 55 56 A E H X S+ 0 0 85 -4,-1.7 4,-2.7 1,-0.2 -2,-0.2 0.926 110.8 52.5 -65.8 -45.1 26.9 3.2 33.1 56 57 A E H X S+ 0 0 50 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.894 110.5 47.1 -56.2 -44.3 26.4 7.0 33.3 57 58 A K H X S+ 0 0 0 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.875 111.2 50.8 -70.6 -38.1 29.5 7.5 35.4 58 59 A R H X S+ 0 0 98 -4,-1.9 4,-2.3 -5,-0.2 -2,-0.2 0.935 110.3 50.5 -61.1 -43.8 31.6 5.3 33.1 59 60 A E H X S+ 0 0 71 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.878 107.8 53.3 -61.9 -37.0 30.3 7.3 30.2 60 61 A G H X S+ 0 0 4 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.924 107.8 50.8 -64.5 -44.8 31.3 10.6 31.9 61 62 A A H X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.899 110.2 49.4 -56.2 -45.8 34.8 9.2 32.5 62 63 A E H X S+ 0 0 102 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.857 108.0 53.2 -63.1 -36.7 35.1 8.3 28.8 63 64 A R H X S+ 0 0 118 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.907 110.1 48.8 -63.5 -41.9 33.9 11.8 27.8 64 65 A L H X S+ 0 0 0 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.890 111.1 49.7 -61.5 -41.3 36.6 13.3 30.0 65 66 A L H X S+ 0 0 32 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.900 109.4 50.9 -69.1 -38.1 39.2 11.0 28.4 66 67 A K H X S+ 0 0 138 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.936 112.1 48.3 -62.1 -42.8 38.1 12.0 24.9 67 68 A M H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 6,-0.2 0.910 105.6 57.2 -63.8 -45.8 38.4 15.7 25.9 68 69 A Q H X>S+ 0 0 0 -4,-2.6 5,-2.4 1,-0.2 4,-0.6 0.945 112.2 42.3 -48.7 -53.9 41.8 15.1 27.4 69 70 A N H ><5S+ 0 0 92 -4,-2.1 3,-0.9 1,-0.2 -1,-0.2 0.868 108.9 57.6 -64.1 -38.9 43.0 13.8 24.0 70 71 A Q H 3<5S+ 0 0 108 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.876 111.0 45.0 -59.5 -35.0 41.1 16.5 22.0 71 72 A R H 3<5S- 0 0 27 -4,-2.3 -66,-0.4 -3,-0.2 -1,-0.3 0.518 119.1-109.7 -85.4 -8.5 43.1 19.1 24.0 72 73 A G T <<5S+ 0 0 1 -3,-0.9 -3,-0.2 -4,-0.6 -68,-0.2 0.640 72.9 136.1 87.8 11.4 46.5 17.3 23.6 73 74 A G < - 0 0 0 -5,-2.4 2,-0.5 -6,-0.2 -1,-0.2 -0.292 55.0-114.9 -82.1 173.2 46.7 16.3 27.2 74 75 A R - 0 0 132 -2,-0.1 2,-0.2 -3,-0.1 -58,-0.1 -0.962 18.9-129.9-123.0 119.1 47.8 12.8 28.2 75 76 A A - 0 0 33 -2,-0.5 2,-0.4 -10,-0.1 -62,-0.1 -0.419 25.6-174.6 -62.0 130.3 45.5 10.4 30.0 76 77 A L - 0 0 114 -2,-0.2 2,-0.3 -63,-0.1 -2,-0.0 -0.991 9.5-152.6-130.9 126.4 47.1 8.8 33.1 77 78 A F - 0 0 129 -2,-0.4 2,-0.3 -58,-0.1 -60,-0.1 -0.742 9.5-169.3-102.0 144.6 45.2 6.1 35.0 78 79 A Q - 0 0 136 -2,-0.3 -2,-0.0 -62,-0.2 0, 0.0 -0.800 40.6 -70.8-120.2 169.2 45.6 5.3 38.6 79 80 A D - 0 0 125 -2,-0.3 2,-0.7 1,-0.1 -1,-0.1 -0.218 46.0-128.2 -54.2 148.3 44.3 2.4 40.7 80 81 A L - 0 0 72 -57,-0.1 -1,-0.1 -3,-0.1 2,-0.1 -0.914 23.1-134.8-102.6 111.8 40.6 2.4 41.3 81 82 A Q - 0 0 112 -2,-0.7 3,-0.1 1,-0.1 -54,-0.1 -0.386 24.5-107.0 -65.2 141.9 39.8 2.1 45.0 82 83 A K - 0 0 145 1,-0.1 -1,-0.1 -2,-0.1 -54,-0.1 -0.241 49.2 -81.6 -63.5 156.0 37.1 -0.4 45.9 83 84 A P - 0 0 14 0, 0.0 -1,-0.1 0, 0.0 -58,-0.0 -0.183 39.4-111.8 -59.9 159.0 33.8 1.1 47.1 84 85 A S S S+ 0 0 93 -3,-0.1 2,-0.3 2,-0.0 -2,-0.1 0.653 96.5 37.8 -70.4 -17.9 33.5 2.2 50.7 85 86 A Q - 0 0 82 1,-0.1 3,-0.1 -57,-0.0 -54,-0.0 -0.952 53.4-158.8-135.1 151.2 31.1 -0.5 51.7 86 87 A D S S+ 0 0 128 -2,-0.3 2,-0.4 1,-0.3 -1,-0.1 0.696 92.6 32.2 -94.4 -29.1 30.5 -4.2 50.9 87 88 A E - 0 0 117 1,-0.1 -1,-0.3 -52,-0.0 -55,-0.1 -0.982 67.7-158.1-130.0 143.4 26.8 -4.2 51.9 88 89 A W - 0 0 4 -2,-0.4 9,-0.1 1,-0.3 2,-0.1 0.321 21.8-148.3-114.1 8.2 24.6 -1.2 51.5 89 90 A G - 0 0 29 4,-0.1 -1,-0.3 5,-0.1 2,-0.1 -0.350 56.4 -0.2 67.5-134.3 21.8 -1.7 54.0 90 91 A T S > S- 0 0 56 -2,-0.1 4,-2.6 1,-0.1 5,-0.2 -0.315 73.6-105.0 -88.0 170.0 18.4 -0.3 53.1 91 92 A T H > S+ 0 0 2 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.893 125.4 54.7 -58.4 -39.6 17.2 1.6 50.0 92 93 A L H > S+ 0 0 32 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.940 108.5 45.9 -56.7 -50.5 17.3 4.6 52.3 93 94 A D H > S+ 0 0 81 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.912 114.4 49.5 -59.2 -42.9 20.9 4.0 53.3 94 95 A A H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.915 110.1 48.6 -65.7 -43.8 21.8 3.4 49.7 95 96 A M H X S+ 0 0 1 -4,-2.8 4,-2.2 2,-0.2 -1,-0.2 0.883 110.7 51.9 -67.2 -34.9 20.2 6.6 48.4 96 97 A K H X S+ 0 0 89 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.926 110.6 48.2 -63.7 -42.6 21.9 8.7 51.1 97 98 A A H X S+ 0 0 26 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.887 110.2 52.6 -65.4 -38.6 25.2 7.2 50.1 98 99 A A H X S+ 0 0 0 -4,-2.4 4,-2.8 2,-0.2 5,-0.2 0.908 108.6 49.0 -63.3 -41.2 24.5 8.0 46.4 99 100 A I H X S+ 0 0 33 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.913 110.6 51.5 -67.5 -38.0 23.7 11.6 47.2 100 101 A V H X S+ 0 0 102 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.942 112.1 47.1 -55.8 -49.4 26.9 11.9 49.2 101 102 A L H X S+ 0 0 21 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.928 112.4 48.2 -60.2 -46.9 28.8 10.5 46.2 102 103 A E H X S+ 0 0 0 -4,-2.8 4,-2.9 1,-0.2 -1,-0.2 0.891 109.5 52.9 -64.2 -38.5 27.1 12.8 43.6 103 104 A K H X S+ 0 0 132 -4,-2.4 4,-2.5 -5,-0.2 -1,-0.2 0.879 108.6 50.9 -63.3 -38.0 27.7 15.9 45.8 104 105 A S H X S+ 0 0 52 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.897 112.1 46.4 -66.0 -40.4 31.4 14.9 46.0 105 106 A L H X S+ 0 0 0 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.905 112.3 50.9 -65.3 -44.4 31.6 14.5 42.2 106 107 A N H X S+ 0 0 28 -4,-2.9 4,-2.5 2,-0.2 -2,-0.2 0.918 108.9 51.0 -60.1 -43.1 29.7 17.9 41.7 107 108 A Q H X S+ 0 0 100 -4,-2.5 4,-2.7 1,-0.2 -1,-0.2 0.904 109.3 50.9 -62.1 -39.7 32.2 19.6 44.1 108 109 A A H X S+ 0 0 25 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.893 110.0 50.0 -63.1 -38.7 35.1 18.2 42.0 109 110 A L H X S+ 0 0 0 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.906 111.6 48.5 -64.5 -41.4 33.4 19.5 38.8 110 111 A L H X S+ 0 0 73 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.897 110.3 51.1 -67.5 -40.1 33.0 22.9 40.4 111 112 A D H X S+ 0 0 96 -4,-2.7 4,-2.3 2,-0.2 -1,-0.2 0.913 111.8 47.3 -60.5 -44.3 36.7 22.9 41.6 112 113 A L H X S+ 0 0 7 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.886 110.3 52.6 -64.3 -39.9 37.8 22.0 38.0 113 114 A H H X 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0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 156 158 A Q > 0 0 184 0, 0.0 4,-2.0 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 78.6 6.1 -0.1 58.5 157 159 A A H > + 0 0 57 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.840 360.0 54.3 -69.6 -38.3 9.5 0.1 56.8 158 160 A G H > S+ 0 0 56 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.935 110.3 46.0 -60.1 -48.4 9.4 -3.1 54.9 159 161 A L H > S+ 0 0 90 1,-0.2 4,-2.7 2,-0.2 -2,-0.2 0.918 112.7 53.0 -58.7 -43.9 6.1 -2.3 53.2 160 162 A G H X S+ 0 0 2 -4,-2.0 4,-2.3 -7,-0.2 -2,-0.2 0.913 108.5 48.0 -58.6 -47.4 7.5 1.2 52.4 161 163 A E H X S+ 0 0 47 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.898 112.9 48.9 -62.8 -42.6 10.6 -0.1 50.8 162 164 A Y H X S+ 0 0 132 -4,-2.1 4,-2.4 -5,-0.2 -2,-0.2 0.945 111.9 48.1 -60.6 -50.2 8.6 -2.5 48.6 163 165 A L H X S+ 0 0 59 -4,-2.7 4,-3.0 2,-0.2 5,-0.4 0.880 110.3 51.4 -62.0 -38.8 6.1 0.1 47.5 164 166 A F H X>S+ 0 0 3 -4,-2.3 4,-2.4 1,-0.2 5,-1.7 0.946 112.1 46.6 -63.3 -45.3 8.8 2.6 46.6 165 167 A E H <5S+ 0 0 5 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.893 118.9 41.5 -63.5 -39.0 10.6 0.1 44.5 166 168 A R H <5S+ 0 0 122 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.891 125.7 30.1 -74.9 -38.9 7.4 -1.0 42.8 167 169 A L H <5S+ 0 0 142 -4,-3.0 -3,-0.2 -5,-0.2 -2,-0.2 0.645 129.7 27.7-106.6 -17.9 5.8 2.4 42.2 168 170 A T T <5 0 0 69 -4,-2.4 -3,-0.2 -5,-0.4 -4,-0.1 0.788 360.0 360.0-106.4 -45.9 8.6 4.9 41.8 169 171 A L < 0 0 57 -5,-1.7 -1,-0.1 -4,-0.0 -124,-0.1 -0.632 360.0 360.0 -87.6 360.0 11.5 2.9 40.4