==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 23-JAN-13 4IWJ . COMPND 2 MOLECULE: FERRITIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDO-NITZSCHIA MULTISERIES; . AUTHOR S.PFAFFEN,M.E.P.MURPHY . 1269 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 52633.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1064 83.8 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 . 6 0.5 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 . 20 1.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 103 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 906 71.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 29 2.3 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 3 5 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 8 8 2 14 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 . 3 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 0 104 0, 0.0 4,-1.9 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -32.4 -21.7 6.1 -77.2 2 2 A E H > + 0 0 150 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.837 360.0 56.2 -66.4 -33.5 -25.0 7.0 -78.9 3 3 A E H > S+ 0 0 103 2,-0.2 4,-3.0 1,-0.2 5,-0.3 0.967 106.3 49.0 -65.2 -45.7 -24.5 4.2 -81.3 4 4 A L H > S+ 0 0 6 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.929 114.4 45.9 -61.4 -40.5 -24.3 1.6 -78.5 5 5 A L H X S+ 0 0 52 -4,-1.9 4,-2.0 1,-0.2 -1,-0.2 0.859 112.7 49.8 -71.1 -36.5 -27.4 3.0 -76.9 6 6 A D H X S+ 0 0 69 -4,-2.6 4,-2.2 2,-0.2 -1,-0.2 0.905 113.4 46.5 -61.8 -48.8 -29.4 3.2 -80.2 7 7 A L H X S+ 0 0 29 -4,-3.0 4,-1.4 -5,-0.2 -2,-0.2 0.836 108.2 55.7 -68.3 -33.0 -28.4 -0.4 -81.0 8 8 A F H X S+ 0 0 0 -4,-2.1 4,-1.4 -5,-0.3 -2,-0.2 0.930 112.4 43.5 -63.9 -42.6 -29.4 -1.6 -77.5 9 9 A N H X S+ 0 0 20 -4,-2.0 4,-1.7 1,-0.2 60,-0.2 0.857 109.5 54.6 -68.2 -35.3 -32.8 -0.1 -78.0 10 10 A R H X S+ 0 0 141 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.846 102.9 60.0 -64.7 -28.3 -33.1 -1.4 -81.5 11 11 A Q H X S+ 0 0 3 -4,-1.4 4,-2.4 2,-0.2 5,-0.2 0.925 102.6 51.2 -69.5 -40.2 -32.4 -5.0 -80.0 12 12 A V H X S+ 0 0 2 -4,-1.4 4,-2.7 1,-0.2 5,-0.2 0.957 111.3 47.5 -55.8 -51.1 -35.5 -4.7 -77.7 13 13 A T H X S+ 0 0 24 -4,-1.7 4,-2.5 1,-0.2 -1,-0.2 0.876 110.5 53.0 -59.8 -40.1 -37.6 -3.9 -80.8 14 14 A Q H X S+ 0 0 48 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.905 108.6 48.5 -64.3 -41.4 -36.1 -6.7 -82.7 15 15 A E H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.937 115.5 44.6 -67.0 -42.8 -36.9 -9.3 -80.0 16 16 A F H X S+ 0 0 10 -4,-2.7 4,-2.1 2,-0.2 -2,-0.2 0.860 111.6 53.0 -67.8 -32.5 -40.5 -8.0 -79.8 17 17 A T H X S+ 0 0 26 -4,-2.5 4,-2.4 -5,-0.2 -2,-0.2 0.931 110.6 47.5 -64.2 -45.2 -40.7 -8.0 -83.6 18 18 A A H X S+ 0 0 0 -4,-2.5 4,-2.8 1,-0.2 5,-0.2 0.917 108.3 55.7 -61.3 -43.8 -39.5 -11.6 -83.6 19 19 A S H X S+ 0 0 4 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.914 110.9 44.1 -55.9 -43.9 -42.1 -12.5 -80.9 20 20 A Q H X S+ 0 0 13 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.877 110.6 54.0 -72.9 -32.3 -44.9 -11.1 -83.1 21 21 A V H X S+ 0 0 20 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.959 109.1 49.1 -68.2 -41.3 -43.6 -12.8 -86.2 22 22 A Y H X S+ 0 0 0 -4,-2.8 4,-2.3 1,-0.2 -1,-0.2 0.884 109.4 53.1 -58.0 -44.1 -43.7 -16.2 -84.4 23 23 A L H X S+ 0 0 0 -4,-1.9 4,-2.4 -5,-0.2 -1,-0.2 0.933 107.4 50.7 -58.9 -43.1 -47.2 -15.4 -83.3 24 24 A S H X S+ 0 0 5 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.913 109.4 50.8 -61.7 -40.5 -48.1 -14.8 -86.9 25 25 A A H X S+ 0 0 0 -4,-2.5 4,-2.8 2,-0.2 -1,-0.2 0.915 108.1 53.4 -60.5 -45.3 -46.6 -18.2 -87.9 26 26 A S H X S+ 0 0 2 -4,-2.3 4,-3.0 2,-0.2 5,-0.2 0.912 110.0 48.3 -53.8 -42.9 -48.7 -19.8 -85.0 27 27 A I H X S+ 0 0 8 -4,-2.4 4,-2.9 2,-0.2 5,-0.2 0.947 110.6 49.0 -67.9 -45.6 -51.8 -18.3 -86.5 28 28 A W H X S+ 0 0 26 -4,-2.5 4,-1.5 1,-0.2 -1,-0.2 0.942 114.0 47.1 -61.8 -46.5 -51.1 -19.4 -90.0 29 29 A F H <>S+ 0 0 0 -4,-2.8 5,-3.4 -5,-0.2 -2,-0.2 0.941 113.5 47.4 -61.8 -47.4 -50.4 -22.9 -88.8 30 30 A D H ><5S+ 0 0 39 -4,-3.0 3,-1.5 3,-0.2 -2,-0.2 0.914 110.6 50.7 -55.8 -44.2 -53.5 -23.1 -86.7 31 31 A Q H 3<5S+ 0 0 78 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.780 113.8 47.5 -64.6 -29.5 -55.7 -21.7 -89.4 32 32 A N T 3<5S- 0 0 60 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.250 119.9-109.2 -98.0 15.5 -54.2 -24.4 -91.7 33 33 A D T < 5S+ 0 0 30 -3,-1.5 2,-0.6 1,-0.1 -3,-0.2 0.774 77.7 130.5 65.2 34.9 -54.6 -27.2 -89.1 34 34 A W >< + 0 0 12 -5,-3.4 4,-2.5 -6,-0.2 5,-0.2 -0.642 22.4 162.0-109.1 71.8 -50.9 -27.7 -88.2 35 35 A E H > + 0 0 56 -2,-0.6 4,-2.0 1,-0.2 -1,-0.2 0.788 69.0 56.4 -70.9 -27.3 -51.5 -27.6 -84.5 36 36 A G H > S+ 0 0 10 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.963 112.4 40.0 -65.2 -51.8 -48.2 -29.2 -83.6 37 37 A M H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.869 112.9 57.6 -64.3 -37.2 -46.2 -26.5 -85.6 38 38 A A H X S+ 0 0 2 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.922 106.1 48.7 -61.3 -42.2 -48.5 -23.8 -84.2 39 39 A A H X S+ 0 0 58 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.890 110.1 51.4 -65.7 -39.6 -47.7 -24.8 -80.6 40 40 A Y H X S+ 0 0 31 -4,-1.8 4,-1.9 2,-0.2 -1,-0.2 0.915 111.8 46.3 -61.5 -48.7 -44.0 -24.7 -81.3 41 41 A M H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.877 110.2 54.5 -61.6 -39.8 -44.3 -21.2 -82.8 42 42 A L H X S+ 0 0 72 -4,-2.4 4,-1.8 2,-0.2 -1,-0.2 0.892 108.2 48.3 -60.0 -42.1 -46.4 -20.0 -79.9 43 43 A A H X S+ 0 0 63 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.896 112.0 50.3 -68.9 -36.2 -43.7 -21.2 -77.4 44 44 A E H X S+ 0 0 13 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.865 104.6 57.3 -67.2 -37.5 -41.1 -19.4 -79.4 45 45 A S H X S+ 0 0 0 -4,-2.2 4,-1.8 2,-0.2 -1,-0.2 0.911 109.3 46.0 -55.7 -43.3 -43.2 -16.2 -79.5 46 46 A A H X S+ 0 0 36 -4,-1.8 4,-2.0 1,-0.2 -2,-0.2 0.892 110.6 52.9 -71.1 -35.3 -43.2 -16.2 -75.7 47 47 A E H X S+ 0 0 55 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.874 107.6 50.4 -67.8 -39.8 -39.5 -16.9 -75.5 48 48 A E H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.874 108.2 53.1 -64.5 -39.4 -38.6 -14.0 -77.8 49 49 A R H X S+ 0 0 13 -4,-1.8 4,-2.8 2,-0.2 -2,-0.2 0.921 107.7 52.2 -60.6 -38.4 -40.7 -11.7 -75.7 50 50 A E H X S+ 0 0 114 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.913 107.2 52.3 -66.6 -37.0 -38.6 -13.0 -72.6 51 51 A H H X S+ 0 0 18 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.934 109.8 48.3 -58.2 -48.9 -35.4 -12.1 -74.5 52 52 A G H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.911 111.6 49.7 -57.4 -48.2 -36.8 -8.6 -75.0 53 53 A L H X S+ 0 0 21 -4,-2.8 4,-2.4 2,-0.2 -1,-0.2 0.822 107.5 55.4 -55.5 -35.0 -37.7 -8.3 -71.3 54 54 A G H X S+ 0 0 26 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.912 109.8 46.1 -68.0 -45.5 -34.2 -9.5 -70.4 55 55 A F H X S+ 0 0 0 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.897 111.9 50.8 -61.0 -40.8 -32.7 -6.7 -72.5 56 56 A V H X S+ 0 0 6 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.926 111.0 48.9 -65.0 -42.6 -35.1 -4.1 -71.0 57 57 A D H X S+ 0 0 72 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.946 113.2 46.4 -66.1 -47.4 -34.2 -5.3 -67.4 58 58 A F H X S+ 0 0 7 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.929 112.1 51.2 -56.6 -46.1 -30.4 -5.1 -68.1 59 59 A A H <>S+ 0 0 0 -4,-2.6 5,-3.1 2,-0.2 4,-0.3 0.920 108.8 50.8 -57.6 -48.0 -30.8 -1.6 -69.7 60 60 A N H ><5S+ 0 0 10 -4,-2.6 3,-1.2 1,-0.2 -1,-0.2 0.946 113.1 46.1 -58.2 -47.9 -32.7 -0.3 -66.7 61 61 A K H 3<5S+ 0 0 47 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.899 117.0 44.1 -61.4 -39.1 -30.0 -1.6 -64.2 62 62 A R T 3<5S- 0 0 64 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.2 0.318 114.0-115.3 -90.8 8.4 -27.2 -0.2 -66.4 63 63 A N T < 5 + 0 0 133 -3,-1.2 -3,-0.2 -4,-0.3 -4,-0.1 0.849 61.9 151.0 58.0 35.8 -28.9 3.2 -67.0 64 64 A I < - 0 0 2 -5,-3.1 -1,-0.2 -6,-0.2 -2,-0.1 -0.899 49.7-126.9 -89.6 112.4 -29.3 2.6 -70.8 65 65 A P - 0 0 71 0, 0.0 2,-0.5 0, 0.0 -56,-0.1 -0.367 24.2-154.6 -67.4 134.3 -32.5 4.7 -71.4 66 66 A I - 0 0 0 600,-0.0 2,-0.5 -10,-0.0 -61,-0.0 -0.960 15.3-176.5-108.5 132.1 -35.1 2.5 -73.2 67 67 A E - 0 0 122 -2,-0.5 2,-0.3 645,-0.0 645,-0.0 -0.978 27.2-131.9-122.1 119.9 -37.8 4.1 -75.4 68 68 A L - 0 0 13 -2,-0.5 2,-0.2 591,-0.1 3,-0.1 -0.501 22.2-154.9 -73.6 127.0 -40.2 1.4 -76.7 69 69 A Q - 0 0 76 -2,-0.3 641,-0.0 -60,-0.2 -1,-0.0 -0.511 31.7 -80.2 -90.8 169.2 -40.9 1.6 -80.4 70 70 A A - 0 0 44 -2,-0.2 -1,-0.2 642,-0.1 -53,-0.1 -0.296 39.9-128.2 -56.6 150.7 -43.9 0.4 -82.3 71 71 A V B -A 710 0A 4 639,-2.8 639,-3.0 -3,-0.1 -1,-0.1 -0.929 31.9-128.3-102.4 116.1 -43.8 -3.3 -83.0 72 72 A P - 0 0 65 0, 0.0 3,-0.1 0, 0.0 -52,-0.1 -0.229 24.0 -98.4 -69.9 150.9 -44.4 -3.6 -86.7 73 73 A A - 0 0 34 1,-0.1 635,-0.1 2,-0.0 636,-0.1 -0.394 45.9-104.9 -62.4 138.5 -47.2 -5.8 -88.1 74 74 A P - 0 0 14 0, 0.0 4,-0.1 0, 0.0 -1,-0.1 -0.436 38.1-174.1 -64.7 139.5 -45.7 -9.1 -89.3 75 75 A V > + 0 0 121 2,-0.1 3,-1.5 -2,-0.1 4,-0.4 0.790 64.5 71.5-112.1 -29.6 -45.6 -9.1 -93.0 76 76 A S G >> S+ 0 0 58 1,-0.2 3,-1.9 2,-0.2 4,-0.9 0.818 83.8 75.9 -54.4 -31.3 -44.5 -12.6 -94.3 77 77 A X G 34 S+ 0 0 38 1,-0.3 3,-0.5 2,-0.2 -1,-0.2 0.793 83.8 64.4 -56.3 -30.2 -47.9 -14.2 -93.3 78 78 A A G <4 S+ 0 0 70 -3,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.831 110.7 35.6 -67.4 -27.3 -49.7 -12.7 -96.2 79 79 A E T <4 S+ 0 0 161 -3,-1.9 -1,-0.2 -4,-0.4 -2,-0.2 0.515 85.6 116.9-105.2 -2.7 -47.7 -14.6 -98.7 80 80 A W < + 0 0 16 -4,-0.9 4,-0.0 -3,-0.5 -3,-0.0 -0.461 27.1 166.8 -65.6 134.7 -47.1 -18.0 -96.9 81 81 A S + 0 0 99 1,-0.3 -1,-0.1 -2,-0.1 3,-0.0 0.488 61.5 16.1-125.0 -12.8 -48.7 -21.0 -98.8 82 82 A S S >> S- 0 0 29 1,-0.1 4,-1.3 0, 0.0 3,-0.7 -0.951 85.0 -97.4-152.2 166.7 -47.2 -24.2 -97.2 83 83 A P H 3> S+ 0 0 6 0, 0.0 4,-2.5 0, 0.0 5,-0.3 0.840 119.8 64.6 -60.8 -33.6 -45.3 -24.9 -94.0 84 84 A E H 3> S+ 0 0 71 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.895 99.8 50.1 -55.6 -40.5 -42.1 -24.8 -95.9 85 85 A D H <> S+ 0 0 60 -3,-0.7 4,-1.9 2,-0.2 -1,-0.2 0.881 112.1 49.4 -62.4 -42.6 -42.6 -21.0 -96.6 86 86 A V H X S+ 0 0 0 -4,-1.3 4,-2.7 1,-0.2 -2,-0.2 0.951 111.6 46.6 -63.8 -52.3 -43.3 -20.4 -92.9 87 87 A W H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.857 110.0 54.5 -58.9 -38.8 -40.2 -22.2 -91.7 88 88 A Q H X S+ 0 0 70 -4,-2.1 4,-2.3 -5,-0.3 -1,-0.2 0.923 109.3 47.7 -58.2 -43.1 -38.1 -20.4 -94.3 89 89 A S H X S+ 0 0 21 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.900 110.8 52.1 -67.1 -40.1 -39.3 -17.0 -93.0 90 90 A I H X S+ 0 0 0 -4,-2.7 4,-2.3 2,-0.2 -1,-0.2 0.900 107.1 51.6 -64.2 -43.1 -38.6 -18.1 -89.4 91 91 A L H X S+ 0 0 23 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.943 111.5 48.5 -52.5 -50.7 -35.0 -19.2 -90.3 92 92 A E H X S+ 0 0 97 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.885 108.6 53.2 -58.2 -37.4 -34.5 -15.7 -91.9 93 93 A L H X S+ 0 0 20 -4,-2.3 4,-2.9 2,-0.2 -1,-0.2 0.933 111.1 47.2 -64.8 -41.0 -35.9 -14.0 -88.7 94 94 A E H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.918 109.4 52.3 -70.7 -37.9 -33.4 -15.9 -86.6 95 95 A Q H X S+ 0 0 65 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.907 112.2 47.0 -58.6 -38.9 -30.5 -15.1 -89.0 96 96 A A H X S+ 0 0 27 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.907 108.9 53.6 -70.7 -40.0 -31.6 -11.4 -88.6 97 97 A N H X S+ 0 0 0 -4,-2.9 4,-1.7 2,-0.2 -2,-0.2 0.912 110.9 48.9 -55.4 -46.5 -31.8 -11.8 -84.7 98 98 A T H X S+ 0 0 25 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.930 111.1 47.4 -63.1 -49.3 -28.2 -13.1 -84.8 99 99 A R H X S+ 0 0 144 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.857 109.9 53.7 -58.7 -38.3 -26.9 -10.3 -87.0 100 100 A S H X S+ 0 0 24 -4,-2.1 4,-1.7 2,-0.2 -1,-0.2 0.856 110.9 46.4 -67.0 -35.1 -28.6 -7.7 -84.7 101 101 A L H X S+ 0 0 1 -4,-1.7 4,-2.6 2,-0.2 -2,-0.2 0.884 112.3 50.4 -70.6 -42.1 -26.8 -9.3 -81.7 102 102 A L H X S+ 0 0 58 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.896 109.5 50.5 -65.9 -37.6 -23.5 -9.3 -83.5 103 103 A N H X S+ 0 0 92 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.903 112.1 48.0 -65.7 -44.4 -23.8 -5.7 -84.5 104 104 A L H X S+ 0 0 0 -4,-1.7 4,-2.4 2,-0.2 -2,-0.2 0.926 111.6 49.9 -56.0 -49.4 -24.6 -4.8 -80.8 105 105 A A H X S+ 0 0 0 -4,-2.6 4,-3.1 1,-0.2 -2,-0.2 0.897 108.8 53.4 -59.5 -42.0 -21.7 -6.8 -79.6 106 106 A E H X S+ 0 0 63 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.935 110.0 46.2 -55.1 -47.7 -19.5 -5.0 -82.2 107 107 A A H X S+ 0 0 4 -4,-2.1 4,-1.6 2,-0.2 -2,-0.2 0.911 113.3 50.2 -61.8 -43.4 -20.6 -1.5 -80.9 108 108 A A H <>S+ 0 0 0 -4,-2.4 5,-3.2 2,-0.2 -2,-0.2 0.936 109.8 51.6 -62.2 -43.1 -20.0 -2.8 -77.3 109 109 A S H ><5S+ 0 0 39 -4,-3.1 3,-1.8 3,-0.2 -2,-0.2 0.941 107.9 51.1 -58.1 -49.0 -16.5 -4.0 -78.2 110 110 A T H 3<5S+ 0 0 108 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