==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER METAL BINDING PROTEIN 18-JAN-08 2ZG8 . COMPND 2 MOLECULE: FERRITIN LIGHT CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: EQUUS CABALLUS; . AUTHOR S.ABE,J.NIEMEYER,M.ABE,T.UENO,T.HIKAGE,G.ERKER,Y.WATANABE . 173 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9781.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 134 77.5 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 . 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 . 2 1.2 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 . 118 68.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 3.5 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 0 0 0 1 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 X S 0 0 153 0, 0.0 2,-0.3 0, 0.0 72,-0.0 0.000 360.0 360.0 360.0 169.8 -54.2 -22.0 -14.4 2 2 X S - 0 0 50 1,-0.1 71,-0.0 3,-0.1 72,-0.0 -0.994 360.0-173.6-144.7 148.4 -51.4 -20.7 -16.7 3 3 X Q S S+ 0 0 191 -2,-0.3 -1,-0.1 1,-0.0 70,-0.0 0.272 87.7 53.2-116.6 6.9 -51.2 -17.8 -19.1 4 4 X I + 0 0 95 69,-0.1 69,-0.1 2,-0.0 2,-0.0 0.561 68.1 124.7-117.7 -15.5 -47.7 -18.8 -20.5 5 5 X R + 0 0 86 68,-0.2 2,-0.3 2,-0.0 68,-0.1 -0.288 29.2 162.5 -63.5 130.0 -47.9 -22.4 -21.6 6 6 X Q - 0 0 157 66,-0.5 3,-0.1 3,-0.0 -1,-0.0 -0.937 64.0 -9.8-152.4 122.5 -46.9 -22.9 -25.2 7 7 X N S S+ 0 0 93 -2,-0.3 2,-0.6 1,-0.2 -2,-0.0 0.798 91.9 131.9 61.2 30.8 -45.8 -26.0 -27.1 8 8 X Y - 0 0 11 64,-0.1 -1,-0.2 117,-0.0 114,-0.0 -0.890 46.4-148.7-120.2 101.4 -45.7 -28.0 -23.8 9 9 X S > - 0 0 19 -2,-0.6 4,-2.4 1,-0.1 5,-0.1 -0.223 20.6-125.7 -73.3 155.9 -47.6 -31.3 -24.0 10 10 X T H > S+ 0 0 91 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.858 112.8 58.6 -63.7 -33.4 -49.4 -33.0 -21.1 11 11 X E H > S+ 0 0 98 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.911 108.6 43.0 -60.6 -45.2 -47.2 -36.1 -21.8 12 12 X V H > S+ 0 0 0 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.927 111.6 55.0 -68.1 -43.5 -44.0 -34.1 -21.3 13 13 X E H X S+ 0 0 31 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.921 111.5 44.1 -53.8 -48.4 -45.5 -32.4 -18.2 14 14 X A H X S+ 0 0 37 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.887 112.4 52.0 -65.0 -40.3 -46.3 -35.8 -16.7 15 15 X A H X S+ 0 0 13 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.860 107.4 52.8 -65.6 -37.3 -42.9 -37.3 -17.6 16 16 X V H X S+ 0 0 0 -4,-2.8 4,-2.4 2,-0.2 -1,-0.2 0.933 108.2 50.6 -64.0 -44.4 -41.1 -34.3 -16.0 17 17 X N H X S+ 0 0 18 -4,-1.9 4,-1.8 -5,-0.2 -2,-0.2 0.915 111.3 48.4 -58.1 -41.9 -43.0 -35.0 -12.8 18 18 X R H X S+ 0 0 153 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.912 109.5 52.8 -65.5 -39.9 -42.0 -38.6 -12.9 19 19 X L H X S+ 0 0 5 -4,-2.5 4,-2.7 1,-0.2 -2,-0.2 0.890 105.0 54.7 -62.1 -40.3 -38.4 -37.6 -13.5 20 20 X V H X S+ 0 0 3 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.932 108.2 49.9 -57.2 -44.1 -38.5 -35.4 -10.4 21 21 X N H X S+ 0 0 26 -4,-1.8 4,-2.6 1,-0.2 -2,-0.2 0.928 110.5 49.6 -61.6 -44.2 -39.6 -38.4 -8.4 22 22 X L H X S+ 0 0 49 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.900 111.9 47.9 -60.6 -42.9 -36.7 -40.5 -9.9 23 23 X Y H X S+ 0 0 5 -4,-2.7 4,-2.5 2,-0.2 -2,-0.2 0.902 112.8 47.7 -66.9 -41.0 -34.2 -37.8 -9.1 24 24 X L H X S+ 0 0 40 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.899 111.4 51.5 -66.1 -38.9 -35.5 -37.4 -5.5 25 25 X R H X S+ 0 0 81 -4,-2.6 4,-2.5 -5,-0.2 -2,-0.2 0.901 110.7 49.1 -59.5 -43.7 -35.4 -41.2 -5.1 26 26 X A H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.924 109.1 51.8 -64.0 -43.5 -31.8 -41.2 -6.3 27 27 X S H X S+ 0 0 19 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.923 110.4 49.2 -57.2 -43.8 -30.9 -38.4 -3.9 28 28 X Y H X S+ 0 0 109 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.910 109.0 52.4 -63.6 -43.8 -32.5 -40.5 -1.1 29 29 X T H X S+ 0 0 21 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.928 109.9 48.8 -57.1 -45.5 -30.5 -43.6 -2.1 30 30 X Y H X S+ 0 0 0 -4,-2.6 4,-2.9 1,-0.2 -2,-0.2 0.855 106.1 56.5 -67.0 -33.2 -27.3 -41.6 -2.0 31 31 X L H X S+ 0 0 74 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.930 110.7 45.4 -59.6 -44.2 -28.1 -40.2 1.4 32 32 X S H X S+ 0 0 33 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.923 112.1 50.7 -67.1 -43.8 -28.4 -43.8 2.6 33 33 X L H X S+ 0 0 1 -4,-2.6 4,-1.6 1,-0.2 -2,-0.2 0.942 110.4 50.7 -57.9 -46.4 -25.2 -44.9 0.8 34 34 X G H X S+ 0 0 2 -4,-2.9 4,-0.6 1,-0.2 3,-0.3 0.933 111.6 45.0 -60.1 -49.4 -23.3 -42.0 2.4 35 35 X F H >< S+ 0 0 125 -4,-2.2 3,-0.5 1,-0.2 4,-0.3 0.800 105.9 61.4 -69.8 -25.9 -24.4 -42.7 6.0 36 36 X Y H >< S+ 0 0 34 -4,-1.9 3,-1.4 1,-0.2 7,-0.3 0.921 103.9 49.7 -62.4 -42.1 -23.7 -46.4 5.6 37 37 X F H 3< S+ 0 0 1 -4,-1.6 7,-2.7 -3,-0.3 11,-0.3 0.633 104.6 59.5 -74.8 -10.3 -20.0 -45.6 4.9 38 38 X D T << S+ 0 0 85 -4,-0.6 -1,-0.3 -3,-0.5 -2,-0.2 0.433 77.0 119.7 -92.4 -3.9 -20.0 -43.3 8.1 39 39 X R S X> S- 0 0 82 -3,-1.4 4,-2.4 -4,-0.3 3,-2.1 -0.358 75.6-123.1 -56.5 142.0 -20.9 -46.3 10.3 40 40 X D T 34 S+ 0 0 155 1,-0.3 -1,-0.1 2,-0.2 -3,-0.0 0.764 113.8 53.7 -62.6 -22.6 -18.2 -46.9 12.9 41 41 X D T 34 S+ 0 0 103 1,-0.0 -1,-0.3 0, 0.0 -2,-0.1 0.320 120.5 31.0 -93.0 7.4 -17.9 -50.5 11.6 42 42 X V T <4 S+ 0 0 32 -3,-2.1 -2,-0.2 -6,-0.1 -5,-0.1 0.586 78.2 172.1-121.4 -62.1 -17.4 -49.3 8.0 43 43 X A < + 0 0 66 -4,-2.4 2,-0.5 -7,-0.3 -5,-0.2 0.899 17.7 143.3 56.6 56.0 -15.6 -45.9 8.5 44 44 X L >> + 0 0 19 -7,-2.7 4,-2.1 1,-0.1 3,-1.0 -0.773 21.4 179.2-123.0 84.7 -14.7 -44.9 5.0 45 45 X E H 3> S+ 0 0 88 -2,-0.5 4,-3.0 1,-0.3 5,-0.2 0.845 76.7 58.6 -63.1 -34.2 -15.1 -41.1 5.1 46 46 X G H 3> S+ 0 0 2 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.858 109.7 46.6 -62.0 -31.6 -14.0 -40.5 1.5 47 47 X V H <> S+ 0 0 0 -3,-1.0 4,-2.3 2,-0.2 5,-0.3 0.910 109.9 52.8 -76.0 -43.7 -16.8 -42.8 0.4 48 48 X C H X S+ 0 0 14 -4,-2.1 4,-2.6 -11,-0.3 5,-0.2 0.955 112.5 45.8 -49.9 -50.9 -19.3 -41.1 2.7 49 49 X A H X S+ 0 0 18 -4,-3.0 4,-2.3 1,-0.2 -2,-0.2 0.891 108.9 55.4 -65.9 -38.2 -18.4 -37.7 1.2 50 50 X F H X S+ 0 0 28 -4,-1.8 4,-1.6 -5,-0.2 -1,-0.2 0.945 113.9 39.4 -59.5 -49.7 -18.6 -39.1 -2.4 51 51 X F H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.865 112.6 55.4 -73.4 -34.6 -22.1 -40.3 -2.0 52 52 X R H X S+ 0 0 118 -4,-2.6 4,-2.0 -5,-0.3 -1,-0.2 0.906 106.5 52.2 -62.7 -39.1 -23.3 -37.3 0.0 53 53 X E H X S+ 0 0 82 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.918 109.5 49.7 -62.1 -40.4 -22.1 -35.1 -2.8 54 54 X L H X S+ 0 0 3 -4,-1.6 4,-2.7 2,-0.2 5,-0.2 0.877 105.0 57.3 -66.9 -35.9 -24.1 -37.1 -5.2 55 55 X A H X S+ 0 0 2 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.926 109.5 45.9 -59.0 -42.2 -27.2 -36.8 -2.9 56 56 X E H X S+ 0 0 45 -4,-2.0 4,-2.6 1,-0.2 -2,-0.2 0.916 110.8 52.9 -67.7 -41.5 -26.9 -33.1 -3.2 57 57 X E H X S+ 0 0 68 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.901 110.4 47.2 -60.0 -43.8 -26.4 -33.2 -7.0 58 58 X K H X S+ 0 0 6 -4,-2.7 4,-2.2 2,-0.2 -1,-0.2 0.872 110.8 51.1 -68.1 -37.5 -29.5 -35.3 -7.5 59 59 X R H X S+ 0 0 75 -4,-1.9 4,-2.3 -5,-0.2 -2,-0.2 0.937 110.1 50.7 -62.3 -44.0 -31.6 -33.0 -5.3 60 60 X E H X S+ 0 0 89 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.892 107.6 53.9 -60.6 -39.0 -30.3 -30.1 -7.3 61 61 X G H X S+ 0 0 8 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.921 107.9 49.4 -61.1 -46.3 -31.4 -31.9 -10.5 62 62 X A H X S+ 0 0 0 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.907 110.9 50.4 -59.3 -42.7 -34.9 -32.3 -9.2 63 63 X E H X S+ 0 0 96 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.903 108.7 51.2 -64.9 -39.6 -35.0 -28.6 -8.3 64 64 X R H X S+ 0 0 111 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.896 110.3 49.9 -62.4 -42.5 -33.9 -27.7 -11.8 65 65 X L H X S+ 0 0 0 -4,-2.3 4,-2.7 2,-0.2 -1,-0.2 0.900 111.0 49.3 -60.1 -42.9 -36.6 -29.9 -13.3 66 66 X L H X S+ 0 0 33 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.891 109.4 51.1 -67.2 -39.7 -39.2 -28.3 -11.0 67 67 X K H X S+ 0 0 140 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.931 112.1 47.6 -61.7 -43.6 -38.0 -24.8 -12.0 68 68 X M H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 6,-0.3 0.909 106.0 57.9 -63.7 -43.9 -38.3 -25.7 -15.6 69 69 X Q H X>S+ 0 0 0 -4,-2.7 5,-2.3 1,-0.2 4,-0.7 0.944 112.1 41.7 -48.8 -52.2 -41.8 -27.2 -15.1 70 70 X N H ><5S+ 0 0 92 -4,-2.1 3,-0.7 1,-0.2 -1,-0.2 0.874 109.5 58.0 -66.9 -36.7 -43.0 -23.8 -13.8 71 71 X Q H 3<5S+ 0 0 113 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.859 110.3 44.7 -58.8 -36.0 -41.1 -21.9 -16.5 72 72 X R H 3<5S- 0 0 27 -4,-2.2 -66,-0.5 -3,-0.2 -1,-0.2 0.547 119.7-108.8 -86.7 -10.0 -43.1 -23.8 -19.1 73 73 X G T <<5S+ 0 0 2 -3,-0.7 -3,-0.2 -4,-0.7 -68,-0.2 0.550 74.0 135.9 90.9 7.7 -46.4 -23.4 -17.3 74 74 X G < - 0 0 0 -5,-2.3 2,-0.5 -6,-0.3 -1,-0.3 -0.277 53.7-116.8 -77.0 172.8 -46.7 -27.1 -16.2 75 75 X R - 0 0 105 -3,-0.1 2,-0.1 -2,-0.1 -58,-0.1 -0.965 17.8-125.7-124.8 121.1 -47.7 -28.0 -12.7 76 76 X A - 0 0 35 -2,-0.5 2,-0.4 -10,-0.1 -62,-0.1 -0.418 27.1-176.8 -62.0 130.3 -45.6 -29.9 -10.2 77 77 X L - 0 0 114 -2,-0.1 2,-0.3 -63,-0.1 -2,-0.0 -0.983 9.7-155.6-131.2 122.9 -47.2 -33.0 -8.8 78 78 X F - 0 0 124 -2,-0.4 2,-0.3 -58,-0.1 -60,-0.1 -0.743 7.8-168.0-101.2 145.4 -45.3 -34.9 -6.1 79 79 X Q - 0 0 134 -2,-0.3 -2,-0.0 -62,-0.2 0, 0.0 -0.776 40.0 -70.3-119.9 169.1 -45.7 -38.6 -5.3 80 80 X D - 0 0 151 -2,-0.3 2,-0.6 1,-0.1 -1,-0.1 -0.234 46.8-130.9 -53.2 145.9 -44.5 -40.8 -2.4 81 81 X L - 0 0 77 -57,-0.1 2,-0.1 -3,-0.1 -1,-0.1 -0.932 20.2-135.6-104.1 116.7 -40.7 -41.3 -2.4 82 82 X Q - 0 0 115 -2,-0.6 3,-0.1 1,-0.1 -54,-0.1 -0.409 24.3-106.9 -72.7 146.5 -39.9 -45.0 -2.0 83 83 X K - 0 0 146 1,-0.1 -1,-0.1 -2,-0.1 -54,-0.1 -0.254 49.6 -80.1 -64.9 157.8 -37.1 -45.9 0.4 84 84 X P - 0 0 15 0, 0.0 -1,-0.1 0, 0.0 -58,-0.1 -0.190 40.6-111.7 -60.4 158.7 -33.8 -47.1 -1.1 85 85 X S S S+ 0 0 105 -3,-0.1 2,-0.3 2,-0.1 -2,-0.1 0.663 96.2 34.4 -70.3 -19.9 -33.5 -50.6 -2.3 86 86 X Q - 0 0 84 1,-0.1 3,-0.1 -57,-0.1 -54,-0.0 -0.945 53.5-157.0-132.9 154.4 -31.0 -51.7 0.5 87 87 X D S S+ 0 0 129 -2,-0.3 2,-0.4 1,-0.3 -1,-0.1 0.659 93.5 34.2 -94.8 -29.1 -30.4 -50.9 4.2 88 88 X E - 0 0 118 1,-0.0 -1,-0.3 -52,-0.0 -55,-0.1 -0.988 69.1-157.3-128.4 141.2 -26.8 -52.0 4.0 89 89 X W - 0 0 4 -2,-0.4 9,-0.2 1,-0.3 2,-0.1 0.270 23.3-144.7-111.9 11.1 -24.6 -51.5 1.0 90 90 X G - 0 0 30 4,-0.1 -1,-0.3 5,-0.1 2,-0.1 -0.356 54.1 -6.3 70.7-142.3 -21.8 -54.1 1.3 91 91 X T S > S- 0 0 56 -2,-0.1 4,-2.5 1,-0.1 5,-0.2 -0.297 76.0 -98.0 -85.3 172.0 -18.3 -53.4 0.1 92 92 X T H > S+ 0 0 1 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.941 126.3 48.7 -58.6 -45.8 -17.0 -50.3 -1.8 93 93 X P H > S+ 0 0 11 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.906 109.7 53.1 -60.6 -37.4 -17.2 -52.2 -5.1 94 94 X D H > S+ 0 0 76 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.934 112.3 45.1 -58.4 -46.3 -20.8 -53.3 -4.2 95 95 X A H X S+ 0 0 0 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.907 112.2 49.6 -65.8 -44.3 -21.7 -49.7 -3.6 96 96 X M H X S+ 0 0 0 -4,-2.7 4,-2.1 2,-0.2 -1,-0.2 0.893 110.7 51.3 -64.7 -36.9 -20.1 -48.3 -6.7 97 97 X K H X S+ 0 0 96 -4,-2.5 4,-2.5 -5,-0.2 -2,-0.2 0.939 109.8 49.3 -62.4 -47.2 -21.9 -51.0 -8.8 98 98 X A H X S+ 0 0 25 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.894 110.0 52.4 -57.7 -40.8 -25.2 -50.0 -7.2 99 99 X A H X S+ 0 0 0 -4,-2.3 4,-2.8 2,-0.2 -1,-0.2 0.888 108.4 49.4 -64.2 -41.6 -24.4 -46.4 -8.0 100 100 X I H X S+ 0 0 20 -4,-2.1 4,-2.9 2,-0.2 5,-0.2 0.923 110.1 50.8 -63.6 -44.3 -23.7 -47.1 -11.7 101 101 X V H X S+ 0 0 103 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.937 112.2 48.6 -57.7 -45.5 -27.0 -49.1 -12.0 102 102 X L H X S+ 0 0 31 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.939 112.3 46.4 -60.0 -49.3 -28.8 -46.1 -10.5 103 103 X E H X S+ 0 0 0 -4,-2.8 4,-3.0 1,-0.2 -1,-0.2 0.895 109.7 54.0 -64.3 -38.6 -27.2 -43.6 -12.8 104 104 X K H X S+ 0 0 129 -4,-2.9 4,-2.6 1,-0.2 -1,-0.2 0.893 107.7 51.9 -62.0 -36.3 -27.8 -45.7 -15.8 105 105 X S H X S+ 0 0 62 -4,-2.0 4,-1.9 -5,-0.2 -2,-0.2 0.898 111.7 45.4 -67.5 -38.2 -31.5 -45.8 -14.8 106 106 X L H X S+ 0 0 2 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.925 112.2 52.3 -66.9 -43.9 -31.6 -42.0 -14.6 107 107 X N H X S+ 0 0 31 -4,-3.0 4,-2.5 1,-0.2 -2,-0.2 0.916 109.2 49.4 -58.8 -43.8 -29.8 -41.7 -17.9 108 108 X Q H X S+ 0 0 99 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.887 109.1 52.4 -64.0 -38.6 -32.3 -44.0 -19.5 109 109 X A H X S+ 0 0 19 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.893 110.2 48.6 -62.3 -39.3 -35.1 -41.9 -18.1 110 110 X L H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.917 111.3 49.6 -65.0 -43.5 -33.5 -38.8 -19.5 111 111 X L H X S+ 0 0 75 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.906 110.1 51.2 -61.8 -42.9 -33.1 -40.4 -22.9 112 112 X D H X S+ 0 0 96 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.906 111.6 47.1 -60.5 -43.2 -36.8 -41.5 -22.8 113 113 X L H X S+ 0 0 6 -4,-2.2 4,-2.8 2,-0.2 -2,-0.2 0.892 109.7 52.8 -67.3 -38.8 -37.9 -38.0 -22.1 114 114 X H H X S+ 0 0 56 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.892 108.8 51.2 -61.8 -39.6 -35.6 -36.5 -24.8 115 115 X A H X S+ 0 0 60 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.884 109.9 49.0 -64.1 -40.6 -37.3 -39.0 -27.3 116 116 X L H X S+ 0 0 47 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.915 109.5 52.5 -64.5 -44.7 -40.7 -37.8 -26.1 117 117 X G H <>S+ 0 0 0 -4,-2.8 5,-2.4 2,-0.2 4,-0.3 0.917 110.7 47.8 -53.4 -46.2 -39.6 -34.2 -26.6 118 118 X S H ><5S+ 0 0 88 -4,-2.4 3,-1.2 1,-0.2 -2,-0.2 0.920 111.3 49.8 -62.2 -44.7 -38.5 -35.1 -30.1 119 119 X A H 3<5S+ 0 0 84 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.772 115.8 43.6 -64.7 -27.9 -41.8 -36.9 -30.8 120 120 X Q T 3<5S- 0 0 69 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.2 0.351 110.8-122.1 -97.3 4.8 -43.7 -33.8 -29.5 121 121 X A T < 5 + 0 0 68 -3,-1.2 -3,-0.2 -4,-0.3 -4,-0.1 0.955 59.2 150.6 47.2 59.4 -41.4 -31.3 -31.4 122 122 X D >< + 0 0 2 -5,-2.4 4,-1.9 1,-0.1 3,-0.3 -0.781 16.5 171.3-120.2 80.8 -40.4 -29.6 -28.1 123 123 X P H > S+ 0 0 89 0, 0.0 4,-1.9 0, 0.0 5,-0.2 0.756 74.5 60.4 -67.3 -24.9 -36.9 -28.2 -28.7 124 124 X H H > S+ 0 0 90 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.926 108.9 43.8 -67.8 -40.9 -36.8 -26.3 -25.5 125 125 X L H > S+ 0 0 0 -3,-0.3 4,-2.3 2,-0.2 5,-0.2 0.931 112.1 51.7 -64.7 -48.0 -37.2 -29.4 -23.4 126 126 X C H X S+ 0 0 35 -4,-1.9 4,-1.2 1,-0.2 -1,-0.2 0.887 114.5 42.9 -62.3 -39.1 -34.8 -31.5 -25.5 127 127 X D H X S+ 0 0 103 -4,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.843 109.6 56.7 -74.1 -37.6 -32.0 -28.9 -25.1 128 128 X F H X S+ 0 0 12 -4,-2.0 4,-1.9 -5,-0.2 5,-0.3 0.916 108.4 49.3 -56.2 -43.8 -32.8 -28.3 -21.4 129 129 X L H X>S+ 0 0 0 -4,-2.3 5,-2.8 1,-0.2 4,-1.1 0.829 111.6 46.9 -69.0 -34.2 -32.2 -32.0 -20.8 130 130 X E H <>S+ 0 0 89 -4,-1.2 5,-2.1 3,-0.2 6,-0.4 0.955 113.2 47.1 -73.5 -48.1 -28.9 -32.2 -22.6 131 131 X S H <5S+ 0 0 75 -4,-2.3 -2,-0.2 1,-0.2 -3,-0.1 0.898 126.0 25.1 -61.1 -48.5 -27.4 -29.1 -21.0 132 132 X H H <5S+ 0 0 69 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.600 138.6 12.7 -95.8 -10.1 -28.2 -29.8 -17.4 133 133 X F T X5S+ 0 0 4 -4,-1.1 4,-2.6 -5,-0.3 -3,-0.2 0.697 112.7 55.7-135.6 -55.4 -28.6 -33.6 -17.4 134 134 X L H > S+ 0 0 108 -6,-0.4 4,-2.8 1,-0.2 -2,-0.2 0.901 107.9 51.0 -61.8 -41.9 -23.5 -34.5 -16.6 137 137 X E H X S+ 0 0 4 -4,-2.6 4,-3.0 2,-0.2 5,-0.3 0.927 109.0 50.1 -60.8 -46.2 -24.7 -38.2 -16.6 138 138 X V H X S+ 0 0 86 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.945 114.1 44.9 -59.6 -46.4 -22.1 -39.2 -19.2 139 139 X K H X S+ 0 0 113 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.915 115.3 47.9 -61.8 -44.7 -19.3 -37.5 -17.2 140 140 X L H X S+ 0 0 15 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.911 110.7 49.5 -65.4 -43.8 -20.6 -39.0 -13.9 141 141 X I H X S+ 0 0 33 -4,-3.0 4,-2.5 2,-0.2 -1,-0.2 0.886 109.7 52.2 -65.2 -38.1 -20.9 -42.5 -15.2 142 142 X K H X S+ 0 0 128 -4,-2.1 4,-2.6 -5,-0.3 -2,-0.2 0.940 110.2 48.9 -61.0 -45.9 -17.4 -42.4 -16.7 143 143 X K H X S+ 0 0 115 -4,-2.2 4,-2.8 1,-0.2 -2,-0.2 0.926 112.6 47.7 -58.0 -46.0 -16.1 -41.3 -13.3 144 144 X M H X S+ 0 0 0 -4,-2.6 4,-3.0 2,-0.2 -1,-0.2 0.892 111.2 50.3 -64.0 -40.7 -18.0 -44.1 -11.6 145 145 X G H X S+ 0 0 25 -4,-2.5 4,-2.6 2,-0.2 -1,-0.2 0.926 111.1 49.4 -61.6 -44.4 -16.7 -46.7 -14.1 146 146 X D H X S+ 0 0 67 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.927 112.4 48.5 -60.3 -45.2 -13.2 -45.4 -13.5 147 147 X H H X S+ 0 0 24 -4,-2.8 4,-3.0 2,-0.2 5,-0.3 0.943 110.5 50.0 -59.1 -49.6 -13.7 -45.7 -9.8 148 148 X L H X S+ 0 0 22 -4,-3.0 4,-2.8 1,-0.2 5,-0.2 0.918 110.0 51.1 -57.4 -42.7 -15.1 -49.2 -10.0 149 149 X T H X S+ 0 0 69 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.928 112.2 47.1 -61.5 -43.6 -12.2 -50.3 -12.2 150 150 X N H X S+ 0 0 58 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.928 113.7 45.5 -64.7 -45.4 -9.7 -48.9 -9.6 151 151 X I H X S+ 0 0 0 -4,-3.0 4,-2.8 1,-0.2 5,-0.3 0.924 112.9 51.2 -67.4 -38.7 -11.4 -50.5 -6.6 152 152 X Q H X S+ 0 0 86 -4,-2.8 4,-1.4 -5,-0.3 -1,-0.2 0.887 109.4 51.0 -61.6 -39.1 -11.7 -53.9 -8.4 153 153 X R H X S+ 0 0 153 -4,-2.1 4,-0.5 -5,-0.2 -1,-0.2 0.894 114.7 44.7 -64.3 -39.0 -8.0 -53.7 -9.3 154 154 X L H >X S+ 0 0 52 -4,-2.0 4,-2.1 1,-0.2 3,-0.7 0.887 112.5 47.0 -73.2 -42.9 -7.2 -53.1 -5.7 155 155 X V H 3< S+ 0 0 37 -4,-2.8 4,-0.3 1,-0.2 -1,-0.2 0.680 101.4 66.0 -81.2 -16.2 -9.5 -55.6 -4.0 156 156 X G H 3< S+ 0 0 71 -4,-1.4 -1,-0.2 -5,-0.3 -2,-0.2 0.765 110.2 39.8 -68.6 -27.6 -8.4 -58.4 -6.4 157 157 X S H << S- 0 0 100 -3,-0.7 2,-0.3 -4,-0.5 -2,-0.2 0.949 142.5 -16.5 -79.6 -64.6 -5.0 -57.9 -4.7 158 158 X Q X - 0 0 122 -4,-2.1 4,-2.7 1,-0.1 -1,-0.2 -0.939 58.9-152.2-149.5 118.4 -6.0 -57.5 -1.0 159 159 X A H > S+ 0 0 57 -2,-0.3 4,-2.6 -4,-0.3 5,-0.2 0.953 92.6 37.1 -63.4 -57.5 -9.6 -56.6 0.0 160 160 X G H > S+ 0 0 60 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.946 122.7 43.6 -59.6 -51.7 -9.1 -54.7 3.3 161 161 X L H > S+ 0 0 96 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.891 113.6 52.3 -60.2 -44.4 -6.0 -52.9 2.2 162 162 X G H X S+ 0 0 2 -4,-2.7 4,-2.4 -8,-0.2 5,-0.2 0.917 108.7 48.8 -61.3 -45.6 -7.4 -52.1 -1.2 163 163 X E H X S+ 0 0 33 -4,-2.6 4,-2.0 -5,-0.2 -1,-0.2 0.911 113.4 47.5 -62.9 -41.0 -10.6 -50.5 0.2 164 164 X Y H X S+ 0 0 134 -4,-2.1 4,-2.4 -5,-0.2 -2,-0.2 0.940 112.5 49.0 -62.3 -48.0 -8.5 -48.4 2.6 165 165 X L H X S+ 0 0 58 -4,-2.7 4,-2.8 1,-0.2 5,-0.4 0.892 110.2 50.9 -64.1 -38.0 -6.1 -47.3 -0.1 166 166 X F H X>S+ 0 0 1 -4,-2.4 4,-2.2 1,-0.2 5,-1.8 0.931 112.0 46.6 -64.4 -45.1 -8.8 -46.4 -2.6 167 167 X E H <>S+ 0 0 4 -4,-2.0 5,-2.3 -5,-0.2 -1,-0.2 0.898 118.8 41.8 -63.5 -37.8 -10.6 -44.2 0.0 168 168 X R H <5S+ 0 0 92 -4,-2.4 -2,-0.2 3,-0.2 -1,-0.2 0.875 125.7 29.8 -76.3 -39.3 -7.3 -42.5 1.1 169 169 X L H <5S+ 0 0 139 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.2 0.650 131.1 25.5-106.4 -19.4 -5.7 -42.0 -2.3 170 170 X T T <5S+ 0 0 66 -4,-2.2 -3,-0.2 -5,-0.4 -4,-0.1 0.764 129.2 26.3-105.3 -47.7 -8.6 -41.6 -4.8 171 171 X L T