==== 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 3F36 . 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 . 167 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9723.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 127 76.0 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 . 6 3.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 112 67.1 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 2 0 0 1 0 0 0 0 0 0 1 0 0 0 0 0 0 2 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 77 0, 0.0 3,-0.4 0, 0.0 72,-0.0 0.000 360.0 360.0 360.0 138.9 51.7 18.2 21.8 2 3 A Q + 0 0 194 1,-0.2 70,-0.0 3,-0.0 0, 0.0 0.696 360.0 40.9 -60.9 -23.8 51.5 19.7 18.3 3 4 A I S S+ 0 0 89 69,-0.1 -1,-0.2 2,-0.0 2,-0.1 0.625 85.0 118.0-100.0 -14.7 47.8 20.5 19.0 4 5 A R + 0 0 73 -3,-0.4 2,-0.3 68,-0.2 68,-0.1 -0.313 33.1 161.9 -65.2 130.6 48.0 21.7 22.6 5 6 A Q - 0 0 157 66,-0.4 3,-0.1 -2,-0.1 -3,-0.0 -0.936 64.2 -10.1-152.5 121.8 47.0 25.3 23.1 6 7 A N S S+ 0 0 94 -2,-0.3 2,-0.6 1,-0.2 -2,-0.0 0.810 91.4 132.1 63.9 30.9 45.9 27.2 26.2 7 8 A Y - 0 0 12 64,-0.1 -1,-0.2 65,-0.0 114,-0.0 -0.886 46.6-147.7-121.0 104.7 45.8 23.9 28.2 8 9 A S > - 0 0 19 -2,-0.6 4,-2.4 1,-0.1 5,-0.2 -0.201 20.3-125.8 -73.9 155.2 47.6 24.1 31.5 9 10 A T H > S+ 0 0 90 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.846 112.8 58.9 -64.2 -30.1 49.4 21.3 33.2 10 11 A E H > S+ 0 0 97 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.935 108.2 42.8 -65.3 -45.4 47.2 22.0 36.3 11 12 A V H > S+ 0 0 0 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.926 111.4 55.5 -65.3 -44.5 44.0 21.4 34.3 12 13 A E H X S+ 0 0 32 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.927 111.8 43.7 -55.3 -45.6 45.5 18.3 32.6 13 14 A A H X S+ 0 0 36 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.889 112.5 51.3 -67.3 -42.0 46.3 16.7 36.0 14 15 A A H X S+ 0 0 14 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.846 107.7 54.4 -63.4 -34.3 42.9 17.7 37.5 15 16 A V H X S+ 0 0 0 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.922 107.6 49.7 -66.3 -43.4 41.2 16.1 34.5 16 17 A N H X S+ 0 0 18 -4,-2.0 4,-1.8 -5,-0.2 -2,-0.2 0.907 111.2 49.4 -61.2 -38.7 43.0 12.8 35.2 17 18 A R H X S+ 0 0 160 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.915 109.7 51.5 -65.1 -38.8 42.0 13.0 38.8 18 19 A L H X S+ 0 0 7 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.875 105.4 55.5 -68.3 -36.7 38.4 13.6 37.8 19 20 A V H X S+ 0 0 3 -4,-2.3 4,-2.7 2,-0.2 -1,-0.2 0.932 108.2 49.4 -55.7 -46.6 38.5 10.6 35.5 20 21 A N H < S+ 0 0 54 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.924 110.2 50.4 -60.7 -43.2 39.6 8.5 38.5 21 22 A L H < S+ 0 0 64 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.887 111.7 47.7 -62.0 -40.9 36.7 9.9 40.6 22 23 A Y H < 0 0 5 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.896 360.0 360.0 -69.5 -40.2 34.1 9.1 37.9 23 24 A L < 0 0 47 -4,-2.7 4,-2.4 2,-0.2 -2,-0.2 0.896 360.0 360.0 -65.7 360.0 35.5 5.6 37.5 24 ! 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 25 26 A A > 0 0 11 0, 0.0 4,-2.5 0, 0.0 -2,-0.2 0.000 360.0 360.0 360.0 -41.6 31.8 6.3 41.3 26 27 A S H > + 0 0 17 -4,-2.3 4,-2.1 1,-0.2 -3,-0.1 0.931 360.0 49.2 -58.6 -42.0 30.9 3.8 38.5 27 28 A Y H > S+ 0 0 104 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.880 109.3 51.5 -64.2 -43.0 32.5 1.0 40.6 28 29 A T H > S+ 0 0 26 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.916 110.6 48.5 -60.2 -44.3 30.5 2.1 43.7 29 30 A Y H X S+ 0 0 0 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.848 107.3 56.0 -66.9 -33.1 27.3 2.0 41.7 30 31 A L H X S+ 0 0 69 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.925 110.1 45.5 -60.2 -44.8 28.2 -1.4 40.3 31 32 A S H X S+ 0 0 33 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.929 112.7 50.0 -66.1 -43.5 28.5 -2.7 43.9 32 33 A L H X S+ 0 0 0 -4,-2.6 4,-1.8 2,-0.2 -2,-0.2 0.930 110.2 52.2 -58.7 -45.0 25.3 -1.0 44.9 33 34 A G H X S+ 0 0 0 -4,-2.7 4,-0.8 1,-0.2 -2,-0.2 0.946 111.8 43.8 -59.7 -49.8 23.5 -2.5 41.9 34 35 A F H < S+ 0 0 93 -4,-2.3 3,-0.3 1,-0.2 4,-0.3 0.812 106.8 60.1 -72.3 -25.4 24.6 -6.1 42.6 35 36 A Y H >< S+ 0 0 30 -4,-2.1 3,-1.5 1,-0.2 7,-0.3 0.925 105.4 49.3 -62.9 -42.4 23.9 -5.8 46.4 36 37 A F H 3< S+ 0 0 0 -4,-1.8 7,-2.4 1,-0.3 11,-0.3 0.653 104.4 60.5 -74.7 -10.3 20.2 -5.0 45.5 37 38 A D T 3< S+ 0 0 100 -4,-0.8 -1,-0.3 -3,-0.3 -2,-0.2 0.472 78.7 117.6 -89.2 -7.4 20.2 -8.1 43.2 38 39 A R S X> S- 0 0 83 -3,-1.5 4,-2.4 -4,-0.3 3,-2.0 -0.334 75.5-124.4 -58.8 140.7 21.1 -10.4 46.2 39 40 A D T 34 S+ 0 0 155 1,-0.3 -1,-0.1 2,-0.2 -3,-0.0 0.785 112.7 52.1 -61.6 -23.7 18.3 -13.0 46.9 40 41 A D T 34 S+ 0 0 99 1,-0.0 -1,-0.3 0, 0.0 -2,-0.1 0.219 120.3 32.5 -95.9 12.4 18.1 -11.7 50.5 41 42 A V T <4 S+ 0 0 32 -3,-2.0 -2,-0.2 -5,-0.1 -5,-0.1 0.502 79.3 171.4-125.5 -62.2 17.7 -8.0 49.4 42 43 A A < + 0 0 65 -4,-2.4 2,-0.5 -7,-0.3 -5,-0.2 0.901 16.1 144.7 58.1 55.6 15.8 -8.5 46.1 43 44 A L >> - 0 0 17 -7,-2.4 4,-2.4 1,-0.1 3,-0.6 -0.796 21.5-179.3-122.8 89.3 14.8 -5.0 45.1 44 45 A E H 3> S+ 0 0 150 -2,-0.5 4,-2.8 1,-0.3 5,-0.2 0.858 78.2 55.1 -64.2 -37.9 15.0 -5.1 41.3 45 46 A G H 3> S+ 0 0 13 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.848 110.6 47.1 -62.7 -36.6 14.0 -1.5 40.8 46 47 A V H <> S+ 0 0 0 -3,-0.6 4,-2.2 2,-0.2 5,-0.2 0.904 110.2 51.9 -72.5 -43.5 16.8 -0.3 43.1 47 48 A C H X S+ 0 0 12 -4,-2.4 4,-2.6 -11,-0.3 -2,-0.2 0.943 111.7 47.3 -54.3 -46.9 19.3 -2.6 41.4 48 49 A H H X S+ 0 0 132 -4,-2.8 4,-2.3 1,-0.2 5,-0.2 0.903 108.0 56.0 -64.2 -40.4 18.3 -1.1 38.0 49 50 A F H X S+ 0 0 26 -4,-1.9 4,-1.5 1,-0.2 -1,-0.2 0.938 113.4 39.9 -58.0 -47.8 18.5 2.4 39.3 50 51 A F H X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.846 111.4 55.8 -77.9 -32.3 22.1 2.0 40.4 51 52 A R H X S+ 0 0 128 -4,-2.6 4,-1.9 -5,-0.2 -1,-0.2 0.904 107.5 50.5 -62.7 -38.8 23.2 -0.1 37.4 52 53 A E H X S+ 0 0 70 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.881 109.8 51.2 -65.5 -36.6 22.1 2.8 35.1 53 54 A L H X S+ 0 0 12 -4,-1.5 4,-2.6 2,-0.2 5,-0.2 0.886 105.1 55.4 -69.0 -33.4 24.1 5.2 37.3 54 55 A A H X S+ 0 0 8 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.940 109.5 48.0 -62.5 -42.1 27.2 3.0 36.9 55 56 A E H X S+ 0 0 75 -4,-1.9 4,-2.4 1,-0.2 -2,-0.2 0.931 110.7 51.0 -60.1 -48.6 26.8 3.3 33.2 56 57 A E H X S+ 0 0 78 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.880 110.9 47.8 -57.4 -44.6 26.3 7.1 33.4 57 58 A K H X S+ 0 0 9 -4,-2.6 4,-2.2 2,-0.2 -1,-0.2 0.896 110.7 50.7 -69.4 -37.5 29.5 7.6 35.5 58 59 A R H X S+ 0 0 97 -4,-2.2 4,-2.3 -5,-0.2 -2,-0.2 0.934 110.1 50.6 -62.0 -42.7 31.6 5.4 33.2 59 60 A E H X S+ 0 0 67 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.898 107.6 54.3 -61.1 -38.1 30.3 7.4 30.2 60 61 A G H X S+ 0 0 8 -4,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.911 108.3 48.8 -59.7 -48.7 31.3 10.6 32.0 61 62 A A H X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.898 110.3 50.8 -58.7 -43.2 34.8 9.3 32.5 62 63 A E H X S+ 0 0 102 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.869 108.3 52.0 -64.7 -37.6 35.1 8.3 28.8 63 64 A R H X S+ 0 0 115 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.892 109.8 49.9 -64.1 -41.5 33.9 11.8 27.8 64 65 A L H X S+ 0 0 0 -4,-2.1 4,-2.7 2,-0.2 -2,-0.2 0.901 110.9 49.2 -60.7 -40.1 36.6 13.4 30.0 65 66 A L H X S+ 0 0 31 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.895 109.7 51.3 -71.2 -37.6 39.3 11.1 28.5 66 67 A K H X S+ 0 0 138 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.927 112.0 47.7 -60.0 -42.8 38.1 12.0 25.0 67 68 A M H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 6,-0.2 0.918 106.0 57.3 -67.8 -42.1 38.4 15.7 25.9 68 69 A Q H X>S+ 0 0 0 -4,-2.7 5,-2.5 1,-0.2 4,-0.5 0.942 111.7 43.0 -52.7 -48.0 41.9 15.2 27.4 69 70 A N H ><5S+ 0 0 93 -4,-2.0 3,-0.8 1,-0.2 -1,-0.2 0.868 108.9 57.3 -66.6 -37.6 43.0 13.8 24.0 70 71 A Q H 3<5S+ 0 0 109 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.862 110.9 45.1 -61.4 -33.9 41.2 16.6 22.1 71 72 A R H 3<5S- 0 0 26 -4,-2.1 -66,-0.4 -3,-0.2 -1,-0.3 0.504 119.1-109.5 -88.3 -7.5 43.2 19.1 24.1 72 73 A G T <<5S+ 0 0 2 -3,-0.8 -3,-0.2 -4,-0.5 -68,-0.2 0.635 72.7 136.0 87.0 11.2 46.5 17.4 23.7 73 74 A G < - 0 0 0 -5,-2.5 2,-0.5 -6,-0.2 -1,-0.2 -0.307 54.5-115.2 -80.8 172.3 46.8 16.3 27.3 74 75 A R - 0 0 131 -2,-0.1 2,-0.2 -3,-0.1 -58,-0.1 -0.958 19.0-129.5-121.3 121.3 47.9 12.8 28.3 75 76 A A - 0 0 34 -2,-0.5 2,-0.4 -10,-0.1 -62,-0.1 -0.460 26.2-176.2 -64.8 133.8 45.6 10.4 30.1 76 77 A L - 0 0 113 -2,-0.2 2,-0.3 -63,-0.1 -2,-0.0 -0.992 10.0-153.0-134.2 125.8 47.2 8.8 33.2 77 78 A F - 0 0 124 -2,-0.4 2,-0.3 -58,-0.1 -60,-0.1 -0.745 8.6-168.1-103.5 146.7 45.3 6.2 35.1 78 79 A Q - 0 0 137 -2,-0.3 -2,-0.0 -62,-0.2 0, 0.0 -0.766 40.2 -71.0-119.5 169.5 45.5 5.3 38.8 79 80 A D - 0 0 129 -2,-0.3 2,-0.7 1,-0.1 -1,-0.1 -0.257 45.2-126.8 -53.6 147.7 44.3 2.4 40.8 80 81 A L - 0 0 70 -57,-0.1 2,-0.1 -3,-0.1 -1,-0.1 -0.901 23.6-134.1 -98.2 113.3 40.5 2.4 41.4 81 82 A Q - 0 0 151 -2,-0.7 3,-0.1 1,-0.1 -54,-0.1 -0.414 25.6-108.3 -64.8 135.6 39.8 2.1 45.1 82 83 A K - 0 0 145 1,-0.1 -1,-0.1 -2,-0.1 -54,-0.1 -0.265 49.3 -80.9 -56.1 153.1 37.2 -0.4 46.0 83 84 A P - 0 0 16 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 -0.159 39.5-112.8 -58.8 158.0 33.8 1.0 47.2 84 85 A S S S+ 0 0 99 -3,-0.1 2,-0.3 2,-0.0 -2,-0.1 0.620 95.9 38.3 -73.3 -18.9 33.6 2.2 50.7 85 86 A Q - 0 0 105 1,-0.1 3,-0.1 -57,-0.0 -54,-0.0 -0.953 53.3-159.6-130.7 152.8 31.1 -0.6 51.8 86 87 A D S S+ 0 0 125 -2,-0.3 2,-0.4 1,-0.3 -1,-0.1 0.693 92.9 33.0 -95.9 -28.4 30.6 -4.3 51.0 87 88 A E - 0 0 117 1,-0.0 -1,-0.3 -52,-0.0 -55,-0.1 -0.983 69.2-158.9-129.2 141.6 26.9 -4.3 52.0 88 89 A W - 0 0 12 -2,-0.4 2,-0.2 1,-0.3 9,-0.2 0.347 22.0-146.5-114.4 5.7 24.7 -1.2 51.6 89 90 A G - 0 0 29 4,-0.1 -1,-0.3 5,-0.1 2,-0.1 -0.411 54.7 -3.4 74.8-138.7 21.8 -1.6 54.0 90 91 A T S > S- 0 0 56 -2,-0.2 4,-2.5 1,-0.1 5,-0.2 -0.345 73.7-102.4 -87.7 173.0 18.4 -0.4 53.2 91 92 A T H > S+ 0 0 3 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.908 126.0 53.6 -57.4 -40.8 17.3 1.6 50.1 92 93 A L H > S+ 0 0 34 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.946 108.5 47.7 -59.3 -48.5 17.3 4.7 52.4 93 94 A D H > S+ 0 0 82 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.900 113.8 48.3 -56.6 -46.0 20.9 4.0 53.4 94 95 A A H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.919 110.6 49.1 -63.9 -43.6 21.9 3.4 49.8 95 96 A M H X S+ 0 0 1 -4,-2.7 4,-2.3 2,-0.2 -1,-0.2 0.872 110.4 52.4 -67.5 -36.4 20.2 6.6 48.5 96 97 A K H X S+ 0 0 83 -4,-2.4 4,-2.2 -5,-0.2 -1,-0.2 0.929 110.9 47.1 -61.2 -45.4 21.9 8.6 51.3 97 98 A A H X S+ 0 0 35 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.877 110.6 53.2 -65.5 -37.2 25.3 7.2 50.2 98 99 A A H X S+ 0 0 0 -4,-2.5 4,-2.8 2,-0.2 -1,-0.2 0.906 108.3 48.2 -64.3 -42.8 24.5 8.0 46.6 99 100 A I H X S+ 0 0 31 -4,-2.3 4,-2.6 2,-0.2 5,-0.2 0.914 110.7 52.1 -65.9 -38.9 23.7 11.6 47.3 100 101 A V H X S+ 0 0 103 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.936 111.8 47.8 -57.7 -46.8 27.0 11.9 49.3 101 102 A L H X S+ 0 0 29 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.941 112.5 46.8 -60.2 -47.9 28.8 10.5 46.3 102 103 A E H X S+ 0 0 0 -4,-2.8 4,-2.8 1,-0.2 -1,-0.2 0.882 108.9 54.3 -66.0 -37.4 27.2 12.8 43.8 103 104 A K H X S+ 0 0 128 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.869 108.9 50.6 -62.7 -37.0 27.8 15.9 45.9 104 105 A S H X S+ 0 0 53 -4,-1.9 4,-2.2 -5,-0.2 -2,-0.2 0.901 111.1 47.0 -66.7 -40.3 31.5 14.9 46.0 105 106 A L H X S+ 0 0 0 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.931 112.2 51.2 -64.4 -42.4 31.6 14.6 42.2 106 107 A N H X S+ 0 0 29 -4,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.909 108.6 51.1 -62.6 -42.4 29.8 17.9 41.9 107 108 A Q H X S+ 0 0 97 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.908 109.0 51.2 -62.2 -41.0 32.3 19.6 44.2 108 109 A A H X S+ 0 0 26 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.878 110.2 49.4 -62.2 -37.9 35.1 18.2 42.1 109 110 A L H X S+ 0 0 0 -4,-2.1 4,-2.7 2,-0.2 -2,-0.2 0.914 111.9 48.1 -65.2 -43.1 33.5 19.6 38.9 110 111 A L H X S+ 0 0 74 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.882 111.2 50.8 -65.2 -39.8 33.0 23.0 40.5 111 112 A D H X S+ 0 0 95 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.909 111.7 47.3 -62.7 -43.8 36.7 22.9 41.7 112 113 A L H X S+ 0 0 6 -4,-2.1 4,-2.7 2,-0.2 -2,-0.2 0.903 110.5 52.3 -66.8 -37.5 37.9 22.1 38.2 113 114 A H H X S+ 0 0 42 -4,-2.7 4,-2.5 1,-0.2 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1,-0.2 -2,-0.2 0.914 112.1 48.1 -57.5 -43.2 13.2 13.7 45.7 146 147 A H H X S+ 0 0 21 -4,-2.5 4,-3.0 2,-0.2 -2,-0.2 0.931 109.6 52.0 -65.3 -46.2 13.7 9.9 46.1 147 148 A L H X S+ 0 0 23 -4,-2.8 4,-2.6 1,-0.2 -1,-0.2 0.908 108.7 51.1 -56.3 -44.5 15.1 10.3 49.6 148 149 A T H X S+ 0 0 70 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.920 112.7 45.6 -60.5 -43.8 12.1 12.4 50.6 149 150 A N H X S+ 0 0 55 -4,-2.0 4,-1.3 2,-0.2 -2,-0.2 0.903 112.3 50.4 -67.0 -40.1 9.7 9.7 49.3 150 151 A I H X S+ 0 0 15 -4,-3.0 4,-0.5 1,-0.2 3,-0.4 0.948 111.3 49.8 -61.3 -45.0 11.6 6.9 51.0 151 152 A Q H >< S+ 0 0 91 -4,-2.6 3,-1.0 1,-0.2 -2,-0.2 0.885 107.7 52.2 -63.2 -39.8 11.6 8.8 54.3 152 153 A R H 3< S+ 0 0 174 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.819 106.7 57.2 -68.9 -22.4 7.9 9.4 54.2 153 154 A L H 3< 0 0 57 -4,-1.3 7,-0.3 -3,-0.4 -1,-0.2 0.545 360.0 360.0 -84.1 -9.2 7.3 5.7 53.6 154 155 A V << 0 0 100 -3,-1.0 3,-0.2 -4,-0.5 4,-0.0 -0.560 360.0 360.0 -72.3 360.0 9.1 4.4 56.8 155 ! 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 0.0 156 158 A Q > 0 0 179 0, 0.0 4,-2.1 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 74.4 6.0 -0.2 58.6 157 159 A A H > + 0 0 58 -3,-0.2 4,-2.2 2,-0.2 5,-0.2 0.848 360.0 51.6 -64.6 -41.3 9.5 0.1 57.0 158 160 A G H > S+ 0 0 54 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.938 111.3 47.8 -60.7 -48.5 9.4 -3.2 54.9 159 161 A L H > S+ 0 0 105 1,-0.2 4,-2.7 2,-0.2 -2,-0.2 0.904 112.5 50.4 -55.1 -46.2 6.1 -2.3 53.3 160 162 A G H X S+ 0 0 5 -4,-2.1 4,-2.2 -7,-0.3 -2,-0.2 0.896 109.4 50.4 -65.1 -37.6 7.4 1.2 52.6 161 163 A E H X S+ 0 0 52 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.919 111.9 47.5 -68.2 -43.7 10.6 -0.1 51.0 162 164 A Y H X S+ 0 0 131 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.939 111.7 49.8 -58.7 -48.4 8.6 -2.5 48.8 163 165 A L H X S+ 0 0 58 -4,-2.7 4,-2.8 1,-0.2 5,-0.4 0.882 108.9 52.0 -63.9 -37.2 6.1 0.1 47.7 164 166 A F H X>S+ 0 0 3 -4,-2.2 4,-2.1 1,-0.2 5,-1.6 0.923 111.7 46.3 -64.1 -43.2 8.9 2.6 46.7 165 167 A E H <5S+ 0 0 8 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.917 118.9 41.7 -65.7 -38.8 10.6 0.1 44.6 166 168 A R H <5S+ 0 0 124 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.890 125.8 29.7 -73.4 -39.4 7.4 -1.0 42.9 167 169 A L H <5S+ 0 0 140 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.2 0.660 129.8 28.4-105.7 -20.2 5.7 2.4 42.4 168 170 A T T <5 0 0 70 -4,-2.1 -3,-0.2 -5,-0.4 -4,-0.1 0.798 360.0 360.0-104.8 -46.7 8.6 4.9 41.9 169 171 A L < 0 0 59 -5,-1.6 -124,-0.1 -4,-0.0 -123,-0.1 -0.303 360.0 360.0 -90.3 360.0 11.5 2.9 40.4