==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=17-APR-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER METAL BINDING PROTEIN 31-JUL-10 3O7S . COMPND 2 MOLECULE: FERRITIN LIGHT CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: EQUUS CABALLUS; . AUTHOR Y.TAKEZAWA,P.BOCKMANN,N.SUGI,Z.WANG,S.ABE,T.MURAKAMI,T.HIKAG . 173 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9670.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 132 76.3 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 . 4 2.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 7 4.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 113 65.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 4.0 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 1 0 0 0 0 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 1 A S 0 0 157 0, 0.0 2,-0.3 0, 0.0 72,-0.0 0.000 360.0 360.0 360.0-123.6 54.4 14.4 21.7 2 2 A S - 0 0 35 3,-0.1 72,-0.0 1,-0.0 71,-0.0 -0.950 360.0-175.0-145.9 142.2 51.5 16.7 20.8 3 3 A Q S S+ 0 0 206 -2,-0.3 -1,-0.0 1,-0.0 70,-0.0 0.324 85.4 49.5-110.2 4.4 51.2 19.0 17.8 4 4 A I + 0 0 103 69,-0.1 69,-0.1 2,-0.0 -1,-0.0 0.564 68.4 125.7-119.8 -16.2 47.9 20.5 18.9 5 5 A R + 0 0 86 68,-0.2 2,-0.3 2,-0.0 68,-0.1 -0.292 29.5 163.4 -61.5 129.5 48.1 21.6 22.6 6 6 A Q - 0 0 156 66,-0.5 3,-0.1 3,-0.0 -1,-0.0 -0.949 63.3 -10.0-151.7 124.7 47.1 25.2 23.1 7 7 A N S S+ 0 0 95 -2,-0.3 2,-0.5 1,-0.2 -2,-0.0 0.847 93.3 129.9 58.1 36.1 46.1 27.1 26.2 8 8 A Y - 0 0 11 64,-0.1 -1,-0.2 65,-0.0 114,-0.0 -0.874 47.3-148.9-126.9 99.5 45.9 23.8 28.2 9 9 A S > - 0 0 21 -2,-0.5 4,-2.5 1,-0.1 5,-0.2 -0.250 22.0-123.8 -73.0 155.1 47.9 23.9 31.4 10 10 A T H > S+ 0 0 91 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.826 114.2 58.1 -59.0 -31.8 49.6 20.9 33.1 11 11 A E H > S+ 0 0 101 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.927 108.2 43.2 -66.7 -45.1 47.4 21.7 36.2 12 12 A V H > S+ 0 0 0 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.914 111.5 55.2 -65.8 -43.9 44.2 21.3 34.2 13 13 A E H X S+ 0 0 29 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.930 111.2 45.1 -54.0 -46.9 45.5 18.2 32.5 14 14 A A H X S+ 0 0 38 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.912 111.6 52.1 -63.3 -44.4 46.2 16.7 36.0 15 15 A A H X S+ 0 0 7 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.877 107.8 52.5 -59.3 -42.1 42.8 17.8 37.3 16 16 A V H X S+ 0 0 0 -4,-2.8 4,-2.5 2,-0.2 -1,-0.2 0.923 108.2 50.6 -63.0 -43.2 41.1 16.1 34.3 17 17 A N H X S+ 0 0 20 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.907 110.5 49.9 -61.8 -39.1 42.9 12.8 35.0 18 18 A R H X S+ 0 0 146 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.923 109.4 51.1 -63.1 -42.8 41.8 13.1 38.7 19 19 A L H X S+ 0 0 4 -4,-2.5 4,-2.7 1,-0.2 5,-0.2 0.896 106.9 54.3 -62.8 -40.5 38.2 13.7 37.6 20 20 A V H X S+ 0 0 3 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.943 109.5 47.6 -55.0 -48.4 38.4 10.6 35.3 21 21 A N H X S+ 0 0 39 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.929 111.6 50.6 -62.3 -41.1 39.5 8.5 38.3 22 22 A L H X S+ 0 0 72 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.886 111.5 47.2 -63.2 -42.6 36.6 10.0 40.4 23 23 A Y H X S+ 0 0 0 -4,-2.7 4,-2.4 2,-0.2 -1,-0.2 0.892 113.3 48.2 -67.3 -40.5 34.0 9.2 37.8 24 24 A L H X S+ 0 0 41 -4,-2.5 4,-2.4 -5,-0.2 -2,-0.2 0.884 111.3 50.4 -67.2 -37.3 35.3 5.7 37.3 25 25 A R H X S+ 0 0 84 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.901 110.4 50.2 -64.7 -40.5 35.3 5.1 41.1 26 26 A A H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.923 109.4 51.5 -62.2 -43.2 31.7 6.4 41.2 27 27 A S H X S+ 0 0 19 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.931 110.2 49.0 -57.8 -45.1 30.8 3.9 38.4 28 28 A Y H X S+ 0 0 103 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.891 109.1 52.5 -63.8 -40.3 32.4 1.1 40.4 29 29 A T H X S+ 0 0 12 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.917 109.7 49.1 -61.6 -42.3 30.5 2.1 43.5 30 30 A Y H X S+ 0 0 0 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.841 106.7 55.6 -69.7 -32.4 27.2 2.0 41.6 31 31 A L H X S+ 0 0 69 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.919 110.0 46.6 -59.0 -45.2 28.1 -1.4 40.2 32 32 A S H X S+ 0 0 34 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.915 112.6 49.7 -63.9 -45.2 28.5 -2.7 43.8 33 33 A L H X S+ 0 0 0 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.935 110.0 52.0 -57.7 -45.9 25.2 -1.0 44.8 34 34 A G H X S+ 0 0 0 -4,-2.7 4,-0.6 1,-0.2 -2,-0.2 0.936 111.9 43.6 -59.8 -49.1 23.4 -2.5 41.8 35 35 A F H < S+ 0 0 99 -4,-2.3 4,-0.3 1,-0.2 3,-0.3 0.781 107.1 60.8 -72.4 -23.6 24.5 -6.1 42.5 36 36 A Y H >< S+ 0 0 31 -4,-1.8 3,-1.6 1,-0.2 7,-0.3 0.931 104.8 48.5 -63.7 -45.8 23.8 -5.7 46.2 37 37 A F H 3< S+ 0 0 0 -4,-1.9 7,-2.5 1,-0.3 11,-0.3 0.600 105.1 61.6 -72.5 -8.3 20.1 -5.0 45.4 38 38 A D T 3< S+ 0 0 102 -4,-0.6 -1,-0.3 -3,-0.3 -2,-0.2 0.485 77.7 117.3 -89.2 -8.7 20.2 -8.1 43.2 39 39 A R S X> S- 0 0 78 -3,-1.6 4,-2.2 -4,-0.3 3,-2.0 -0.291 75.6-124.0 -58.7 143.6 21.0 -10.4 46.2 40 40 A D T 34 S+ 0 0 155 1,-0.3 -1,-0.1 2,-0.2 -3,-0.0 0.812 113.4 51.3 -61.3 -27.6 18.4 -13.0 46.8 41 41 A D T 34 S+ 0 0 102 1,-0.0 -1,-0.3 0, 0.0 -2,-0.1 0.191 121.1 32.7 -91.0 12.5 18.1 -11.7 50.4 42 42 A V T <4 S+ 0 0 30 -3,-2.0 -2,-0.2 -5,-0.1 -5,-0.1 0.523 78.1 169.7-127.5 -65.6 17.6 -8.1 49.2 43 43 A A < + 0 0 65 -4,-2.2 2,-0.4 -7,-0.3 -5,-0.2 0.913 13.4 146.9 58.0 60.4 15.8 -8.5 45.9 44 44 A L >> - 0 0 17 -7,-2.5 4,-2.6 1,-0.1 3,-0.7 -0.783 21.1-177.4-126.7 88.6 14.7 -5.0 44.9 45 45 A E H 3> S+ 0 0 124 -2,-0.4 4,-2.8 1,-0.3 5,-0.2 0.857 79.6 53.8 -59.5 -43.2 14.8 -5.0 41.1 46 46 A G H 3> S+ 0 0 1 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.840 112.7 46.0 -57.8 -37.4 13.9 -1.3 40.6 47 47 A V H <> S+ 0 0 0 -3,-0.7 4,-2.2 2,-0.2 5,-0.2 0.911 110.6 51.6 -73.9 -47.1 16.7 -0.3 43.0 48 48 A C H X S+ 0 0 15 -4,-2.6 4,-2.4 -11,-0.3 -2,-0.2 0.940 113.2 46.9 -51.9 -46.3 19.2 -2.6 41.3 49 49 A H H X S+ 0 0 74 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.891 106.4 56.2 -67.4 -39.6 18.3 -1.1 38.0 50 50 A F H X S+ 0 0 10 -4,-1.8 4,-1.7 1,-0.2 -1,-0.2 0.930 113.7 41.6 -56.9 -48.4 18.5 2.5 39.2 51 51 A F H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.859 111.3 53.3 -73.0 -35.8 22.1 2.0 40.3 52 52 A R H X S+ 0 0 85 -4,-2.4 4,-1.9 -5,-0.2 -1,-0.2 0.906 108.1 53.1 -64.3 -39.0 23.2 -0.1 37.3 53 53 A E H X S+ 0 0 60 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.923 109.8 48.1 -55.4 -47.5 21.9 2.8 35.1 54 54 A L H X S+ 0 0 4 -4,-1.7 4,-2.8 2,-0.2 5,-0.3 0.862 105.1 58.7 -65.5 -35.0 24.0 5.2 37.2 55 55 A A H X S+ 0 0 5 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.939 109.8 44.2 -58.7 -43.8 27.1 2.9 36.8 56 56 A E H X S+ 0 0 84 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.929 111.8 52.7 -68.3 -42.6 26.8 3.3 33.0 57 57 A E H X S+ 0 0 67 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.909 110.9 47.0 -58.3 -45.7 26.2 7.1 33.2 58 58 A K H X S+ 0 0 0 -4,-2.8 4,-2.3 2,-0.2 -1,-0.2 0.902 111.3 50.8 -65.0 -40.8 29.3 7.6 35.4 59 59 A R H X S+ 0 0 78 -4,-2.0 4,-2.5 -5,-0.3 -2,-0.2 0.923 109.2 52.2 -60.6 -43.1 31.4 5.4 33.0 60 60 A E H X S+ 0 0 81 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.890 107.4 52.7 -60.9 -37.1 30.1 7.5 30.1 61 61 A G H X S+ 0 0 0 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.923 108.6 49.4 -63.1 -47.5 31.2 10.7 31.9 62 62 A A H X S+ 0 0 0 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.923 110.5 51.1 -56.9 -44.4 34.7 9.3 32.4 63 63 A E H X S+ 0 0 92 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.882 108.4 50.7 -63.0 -41.0 34.9 8.4 28.7 64 64 A R H X S+ 0 0 85 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.906 110.6 50.4 -62.3 -43.2 33.8 11.9 27.7 65 65 A L H X S+ 0 0 2 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.903 110.2 49.3 -59.9 -41.9 36.5 13.4 29.9 66 66 A L H X S+ 0 0 31 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.917 110.1 50.9 -66.7 -39.4 39.1 11.1 28.4 67 67 A K H X S+ 0 0 139 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.924 111.3 48.5 -60.4 -44.2 38.0 12.1 24.9 68 68 A M H X S+ 0 0 0 -4,-2.4 4,-2.1 2,-0.2 6,-0.2 0.901 106.4 57.1 -63.6 -43.7 38.3 15.8 25.9 69 69 A Q H X>S+ 0 0 0 -4,-2.5 5,-2.3 1,-0.2 4,-0.8 0.939 111.7 42.1 -51.0 -52.1 41.8 15.2 27.3 70 70 A N H ><5S+ 0 0 93 -4,-2.2 3,-0.7 1,-0.2 -1,-0.2 0.880 109.1 57.9 -66.7 -37.6 42.9 13.9 24.0 71 71 A Q H 3<5S+ 0 0 107 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.856 110.0 45.5 -59.0 -33.4 41.1 16.6 22.0 72 72 A R H 3<5S- 0 0 27 -4,-2.1 -66,-0.5 -3,-0.2 -1,-0.2 0.590 119.8-108.7 -87.5 -10.0 43.1 19.2 24.0 73 73 A G T <<5S+ 0 0 2 -4,-0.8 -3,-0.2 -3,-0.7 -68,-0.2 0.572 74.0 135.9 91.9 10.9 46.5 17.4 23.6 74 74 A G < - 0 0 0 -5,-2.3 2,-0.5 -6,-0.2 -1,-0.3 -0.283 53.8-117.3 -80.6 171.3 46.7 16.2 27.2 75 75 A R - 0 0 109 -3,-0.1 2,-0.1 -2,-0.1 -58,-0.1 -0.963 18.2-127.4-123.5 121.8 47.7 12.7 28.2 76 76 A A - 0 0 34 -2,-0.5 2,-0.4 -10,-0.1 -62,-0.1 -0.407 25.7-175.0 -64.0 134.6 45.4 10.3 30.0 77 77 A L - 0 0 115 -2,-0.1 2,-0.3 -63,-0.1 -2,-0.0 -0.971 10.1-153.1-135.0 119.6 47.0 8.8 33.1 78 78 A F - 0 0 128 -2,-0.4 2,-0.3 -58,-0.1 -60,-0.1 -0.664 9.0-169.1 -95.6 146.2 45.1 6.1 35.0 79 79 A Q - 0 0 135 -2,-0.3 -2,-0.0 -62,-0.2 0, 0.0 -0.798 40.8 -70.8-121.0 169.5 45.4 5.3 38.6 80 80 A D - 0 0 125 -2,-0.3 2,-0.8 1,-0.1 -1,-0.1 -0.222 44.2-126.0 -54.1 147.6 44.0 2.4 40.6 81 81 A L - 0 0 68 -57,-0.1 -1,-0.1 -3,-0.1 2,-0.1 -0.898 26.5-134.2 -97.1 111.6 40.3 2.4 41.1 82 82 A Q - 0 0 112 -2,-0.8 3,-0.1 1,-0.1 -54,-0.1 -0.390 25.3-106.5 -63.8 136.8 39.7 2.1 44.9 83 83 A K - 0 0 140 1,-0.1 -1,-0.1 -2,-0.1 -54,-0.1 -0.250 50.6 -82.0 -59.9 151.5 37.1 -0.4 45.9 84 84 A P - 0 0 15 0, 0.0 -1,-0.1 0, 0.0 -58,-0.0 -0.159 39.0-110.5 -58.4 158.6 33.8 1.1 47.0 85 85 A S S S+ 0 0 87 -3,-0.1 2,-0.3 2,-0.1 -2,-0.1 0.646 97.2 34.9 -67.4 -18.7 33.5 2.3 50.6 86 86 A Q - 0 0 107 1,-0.1 3,-0.1 -57,-0.0 -54,-0.0 -0.956 52.9-158.4-135.3 151.7 31.0 -0.6 51.7 87 87 A D S S+ 0 0 127 -2,-0.3 2,-0.4 1,-0.3 -1,-0.1 0.680 94.1 34.7 -95.3 -29.8 30.5 -4.2 50.8 88 88 A E - 0 0 117 1,-0.0 -1,-0.3 -52,-0.0 -55,-0.1 -0.978 69.0-160.0-125.3 141.4 26.9 -4.2 52.0 89 89 A W - 0 0 12 -2,-0.4 2,-0.2 1,-0.3 9,-0.1 0.319 22.1-145.9-113.1 8.5 24.7 -1.1 51.5 90 90 A G - 0 0 31 4,-0.1 -1,-0.3 5,-0.1 2,-0.1 -0.417 55.2 -2.9 71.6-136.3 21.9 -1.5 54.0 91 91 A T S > S- 0 0 56 -2,-0.2 4,-2.7 1,-0.1 5,-0.2 -0.364 73.4-102.8 -87.3 169.5 18.4 -0.2 53.1 92 92 A T H > S+ 0 0 4 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.900 127.0 54.1 -55.4 -39.6 17.2 1.6 50.0 93 93 A L H > S+ 0 0 30 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.946 108.7 46.6 -59.7 -49.4 17.3 4.7 52.3 94 94 A D H > S+ 0 0 78 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.908 114.8 48.4 -55.9 -45.4 21.0 4.1 53.3 95 95 A A H X S+ 0 0 0 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.910 110.5 48.9 -65.7 -44.0 21.9 3.5 49.6 96 96 A M H X S+ 0 0 0 -4,-2.7 4,-2.1 2,-0.2 -1,-0.2 0.880 110.9 51.4 -66.6 -36.1 20.2 6.6 48.3 97 97 A K H X S+ 0 0 97 -4,-2.3 4,-2.2 -5,-0.2 -2,-0.2 0.930 110.7 48.7 -62.8 -45.0 21.9 8.7 51.1 98 98 A A H X S+ 0 0 35 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.887 110.3 51.8 -62.8 -37.0 25.3 7.2 50.0 99 99 A A H X S+ 0 0 0 -4,-2.3 4,-2.8 2,-0.2 -1,-0.2 0.901 108.9 49.5 -65.7 -42.0 24.5 8.0 46.4 100 100 A I H X S+ 0 0 16 -4,-2.1 4,-2.7 2,-0.2 5,-0.2 0.911 111.2 49.8 -63.9 -43.7 23.6 11.7 47.2 101 101 A V H X S+ 0 0 101 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.932 112.1 49.1 -58.7 -47.4 26.9 12.0 49.1 102 102 A L H X S+ 0 0 28 -4,-2.5 4,-1.8 2,-0.2 -2,-0.2 0.937 112.6 45.9 -58.5 -49.5 28.8 10.5 46.2 103 103 A E H X S+ 0 0 0 -4,-2.8 4,-2.9 1,-0.2 -2,-0.2 0.891 109.8 54.1 -64.1 -39.7 27.2 12.8 43.6 104 104 A K H X S+ 0 0 123 -4,-2.7 4,-2.7 1,-0.2 -1,-0.2 0.912 107.4 52.6 -59.8 -39.7 27.7 15.9 45.8 105 105 A S H X S+ 0 0 62 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.881 110.1 46.8 -64.2 -38.8 31.4 14.9 45.9 106 106 A L H X S+ 0 0 2 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.933 112.2 51.0 -65.9 -46.1 31.6 14.7 42.0 107 107 A N H X S+ 0 0 31 -4,-2.9 4,-2.3 1,-0.2 -2,-0.2 0.919 109.3 50.1 -56.8 -46.0 29.8 18.0 41.7 108 108 A Q H X S+ 0 0 103 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.898 109.3 51.9 -61.0 -40.0 32.3 19.6 44.2 109 109 A A H X S+ 0 0 18 -4,-2.0 4,-1.8 2,-0.2 -1,-0.2 0.875 109.4 49.9 -64.5 -35.7 35.2 18.2 42.1 110 110 A L H X S+ 0 0 1 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.893 110.4 49.9 -67.0 -40.3 33.7 19.7 39.0 111 111 A L H X S+ 0 0 75 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.849 109.3 51.9 -66.1 -36.4 33.3 23.1 40.7 112 112 A D H X S+ 0 0 95 -4,-2.2 4,-0.8 2,-0.2 -1,-0.2 0.869 111.1 47.4 -66.0 -38.1 36.9 22.8 41.8 113 113 A L H X S+ 0 0 7 -4,-1.8 4,-2.8 2,-0.2 -2,-0.2 0.834 109.7 52.2 -72.1 -37.1 38.0 22.2 38.2 114 114 A H H X S+ 0 0 64 -4,-2.2 4,-2.3 1,-0.2 5,-0.2 0.896 109.1 50.8 -63.1 -41.5 35.9 25.0 36.8 115 115 A A H X S+ 0 0 63 -4,-1.9 4,-0.9 2,-0.2 -1,-0.2 0.713 111.7 49.2 -68.7 -24.0 37.6 27.3 39.4 116 116 A L H X S+ 0 0 54 -4,-0.8 4,-1.0 2,-0.2 -2,-0.2 0.936 110.8 47.8 -75.1 -53.1 41.0 26.0 38.2 117 117 A G H <>S+ 0 0 0 -4,-2.8 5,-2.7 1,-0.2 4,-0.3 0.838 111.8 49.9 -58.4 -39.6 40.2 26.5 34.5 118 118 A S H ><5S+ 0 0 67 -4,-2.3 3,-0.9 3,-0.2 -1,-0.2 0.894 111.3 49.0 -65.1 -41.4 39.0 30.1 35.1 119 119 A A H 3<5S+ 0 0 87 -4,-0.9 -2,-0.2 1,-0.2 -1,-0.2 0.649 114.7 46.9 -69.0 -16.5 42.2 30.7 37.1 120 120 A Q T 3<5S- 0 0 63 -4,-1.0 -1,-0.2 2,-0.1 -2,-0.2 0.426 114.4-120.3 -99.5 -2.7 44.0 29.2 34.1 121 121 A A T < 5 + 0 0 66 -3,-0.9 -3,-0.2 -4,-0.3 -2,-0.1 0.949 59.4 152.0 56.7 55.4 42.0 31.3 31.5 122 122 A D >< + 0 0 4 -5,-2.7 4,-1.4 1,-0.1 -1,-0.2 -0.829 18.0 171.9-118.7 87.6 40.6 28.2 29.8 123 123 A P H > S+ 0 0 87 0, 0.0 4,-1.8 0, 0.0 5,-0.2 0.823 76.0 57.9 -65.6 -34.0 37.2 29.0 28.2 124 124 A H H > S+ 0 0 78 2,-0.2 4,-0.8 1,-0.2 3,-0.2 0.930 107.1 45.6 -65.1 -48.4 36.9 25.7 26.4 125 125 A L H >> S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 3,-0.6 0.900 111.3 56.5 -57.5 -40.4 37.2 23.5 29.5 126 126 A C H 3< S+ 0 0 32 -4,-1.4 -2,-0.2 1,-0.3 -1,-0.2 0.835 111.6 40.0 -62.0 -38.1 34.7 25.9 31.1 127 127 A D H 3< S+ 0 0 97 -4,-1.8 4,-0.4 -3,-0.2 -1,-0.3 0.436 111.2 60.9 -90.8 -1.8 32.1 25.3 28.4 128 128 A F H S+ 0 0 2 -4,-2.2 5,-3.2 2,-0.2 4,-0.3 0.478 111.4 64.9 -80.0 -0.4 32.0 20.9 31.9 130 130 A E T 4>S+ 0 0 39 3,-0.2 5,-1.2 -5,-0.2 -2,-0.1 0.972 109.0 34.0 -75.9 -70.2 29.0 23.2 31.5 131 131 A S T >>S+ 0 0 53 -4,-0.4 4,-0.6 3,-0.2 5,-0.6 0.960 127.2 25.0 77.9-154.9 27.4 21.4 29.3 132 132 A H T <5S+ 0 0 42 -4,-0.8 -3,-0.1 -5,-0.2 -2,-0.1 0.358 131.3 25.5 -68.4 9.5 27.8 17.6 29.7 133 133 A F T >5S+ 0 0 0 -4,-0.3 4,-2.4 -5,-0.1 -3,-0.2 0.661 111.4 46.9-134.4 -59.5 28.6 17.7 33.5 134 134 A L H >< S+ 0 0 98 -4,-2.8 3,-0.9 1,-0.2 -2,-0.2 0.890 107.9 53.1 -62.4 -41.5 11.6 8.8 54.1 153 153 A R H 3< S+ 0 0 171 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.824 108.2 53.0 -61.7 -31.6 7.9 9.5 54.0 154 154 A L H 3< S+ 0 0 60 -4,-1.4 2,-1.1 -3,-0.4 8,-0.3 0.580 81.9 98.8 -84.0 -12.7 7.4 5.7 53.5 155 155 A V << + 0 0 69 -3,-0.9 4,-0.2 -4,-0.7 -1,-0.0 -0.672 62.6 136.7 -78.1 101.8 9.4 4.6 56.5 156 156 A G S S- 0 0 44 -2,-1.1 -1,-0.1 2,-0.0 -2,-0.0 0.568 80.5 -49.7 -74.4-133.6 6.7 4.0 59.1 157 157 A S S S+ 0 0 123 -3,-0.1 2,-0.3 0, 0.0 -2,-0.1 -0.266 138.0 45.6 84.4 -79.8 5.5 2.4 61.2 158 158 A Q > + 0 0 106 -4,-0.3 4,-2.1 1,-0.1 5,-0.2 -0.729 56.7 172.3-141.6 84.2 6.2 -0.2 58.5 159 159 A A H > S+ 0 0 59 -2,-0.3 4,-2.3 1,-0.2 5,-0.2 0.863 80.4 53.0 -62.0 -41.8 9.7 0.0 56.9 160 160 A G H > S+ 0 0 54 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.941 110.2 47.1 -60.1 -50.0 9.4 -3.2 54.9 161 161 A L H > S+ 0 0 87 1,-0.2 4,-2.7 2,-0.2 -2,-0.2 0.922 113.1 49.1 -55.3 -49.2 6.1 -2.2 53.3 162 162 A G H X S+ 0 0 4 -4,-2.1 4,-2.4 -8,-0.3 5,-0.2 0.891 109.8 51.7 -61.1 -39.8 7.4 1.2 52.4 163 163 A E H X S+ 0 0 56 -4,-2.3 4,-1.8 2,-0.2 -1,-0.2 0.927 112.0 46.4 -65.7 -43.5 10.6 -0.2 50.9 164 164 A Y H X S+ 0 0 132 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.946 112.3 50.4 -60.0 -49.6 8.6 -2.6 48.7 165 165 A L H X S+ 0 0 58 -4,-2.7 4,-2.8 1,-0.2 5,-0.4 0.890 108.8 50.7 -62.0 -40.7 6.1 0.2 47.6 166 166 A F H X>S+ 0 0 4 -4,-2.4 4,-2.2 1,-0.2 5,-1.9 0.928 112.1 47.5 -61.7 -43.0 8.8 2.6 46.6 167 167 A E H <>S+ 0 0 4 -4,-1.8 5,-2.5 -5,-0.2 -2,-0.2 0.906 118.3 41.1 -64.6 -40.8 10.6 0.0 44.5 168 168 A R H <5S+ 0 0 96 -4,-2.3 -2,-0.2 3,-0.2 -1,-0.2 0.891 125.8 30.5 -71.8 -42.2 7.3 -1.0 42.8 169 169 A L H <5S+ 0 0 139 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.2 0.629 131.7 23.9-104.4 -17.8 5.7 2.3 42.3 170 170 A T T <5S+ 0 0 69 -4,-2.2 -3,-0.2 -5,-0.4 -4,-0.1 0.763 128.3 27.5-109.1 -50.3 8.6 4.8 41.8 171 171 A L T