==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-APR-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ELECTRON TRANSPORT 20-JUL-10 2XLH . COMPND 2 MOLECULE: CYTOCHROME C'; . SOURCE 2 ORGANISM_SCIENTIFIC: ACHROMOBACTER XYLOSOXIDANS; . AUTHOR M.A.HOUGH,S.V.ANTONYUK,S.BARBIERI,N.RUSTAGE,A.L.MCKAY,A.E.SE . 125 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7411.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 98 78.4 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 . 2 1.6 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 2.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 76 60.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.6 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 2 0 0 0 0 0 0 0 0 0 0 1 0 0 0 1 0 0 1 0 1 0 0 0 0 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 . 1 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 X 0 0 170 0, 0.0 2,-0.5 0, 0.0 57,-0.0 0.000 360.0 360.0 360.0 8.2 -30.5 6.8 3.3 2 2 A F 0 0 56 1,-0.1 6,-0.0 9,-0.0 4,-0.0 -0.921 360.0 360.0-116.1 125.8 -33.4 9.3 3.1 3 3 A A 0 0 115 -2,-0.5 -1,-0.1 2,-0.0 3,-0.0 0.847 360.0 360.0 -71.9 360.0 -36.9 8.4 2.2 4 ! 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 5 5 A P > 0 0 65 0, 0.0 4,-2.3 0, 0.0 3,-0.4 0.000 360.0 360.0 360.0 -35.5 -35.9 15.3 0.8 6 6 A E H > + 0 0 147 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.808 360.0 55.5 -58.3 -30.1 -37.2 16.4 4.3 7 7 A D H > S+ 0 0 79 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.876 107.0 48.9 -72.9 -36.2 -35.3 13.5 5.9 8 8 A A H > S+ 0 0 0 -3,-0.4 4,-2.7 2,-0.2 5,-0.2 0.902 110.9 51.2 -65.5 -41.8 -32.0 14.7 4.3 9 9 A V H X S+ 0 0 16 -4,-2.3 4,-2.5 2,-0.2 5,-0.2 0.936 111.0 47.3 -60.6 -48.8 -32.8 18.2 5.5 10 10 A K H X S+ 0 0 151 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.919 112.5 50.6 -61.5 -41.8 -33.4 17.0 9.1 11 11 A Y H X S+ 0 0 89 -4,-2.2 4,-2.7 2,-0.2 -1,-0.2 0.945 112.2 44.7 -59.8 -52.9 -30.2 14.9 9.0 12 12 A R H X S+ 0 0 6 -4,-2.7 4,-2.7 46,-0.2 5,-0.2 0.907 112.3 51.8 -65.5 -37.3 -27.9 17.7 7.8 13 13 A Q H X S+ 0 0 91 -4,-2.5 4,-2.3 -5,-0.2 -1,-0.2 0.902 112.1 47.3 -62.5 -40.1 -29.4 20.2 10.2 14 14 A S H X S+ 0 0 64 -4,-2.1 4,-2.2 -5,-0.2 -2,-0.2 0.910 112.2 49.2 -66.9 -43.1 -28.8 17.8 13.0 15 15 A A H X S+ 0 0 7 -4,-2.7 4,-2.1 2,-0.2 5,-0.2 0.921 112.8 47.5 -61.1 -43.4 -25.2 17.1 11.9 16 16 A L H X S+ 0 0 53 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.883 109.0 54.6 -68.0 -38.8 -24.5 20.8 11.6 17 17 A T H X S+ 0 0 97 -4,-2.3 4,-1.9 -5,-0.2 -1,-0.2 0.922 108.4 49.0 -57.3 -47.5 -26.0 21.4 15.0 18 18 A L H X S+ 0 0 88 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.914 111.7 49.6 -63.2 -36.9 -23.6 18.8 16.5 19 19 A M H X S+ 0 0 19 -4,-2.1 4,-2.8 1,-0.2 5,-0.4 0.897 107.8 54.0 -66.0 -41.0 -20.5 20.4 14.7 20 20 A A H X S+ 0 0 63 -4,-2.3 4,-2.7 -5,-0.2 5,-0.3 0.950 110.1 45.5 -61.9 -41.7 -21.4 23.7 16.0 21 21 A S H X S+ 0 0 52 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.910 114.9 46.8 -67.5 -43.4 -21.5 22.4 19.5 22 22 A H H < S+ 0 0 32 -4,-2.4 -2,-0.2 2,-0.2 -1,-0.2 0.836 120.3 40.5 -70.1 -28.9 -18.2 20.5 19.3 23 23 A F H >< S+ 0 0 33 -4,-2.8 3,-1.9 -5,-0.2 4,-0.2 0.954 117.6 45.0 -75.2 -57.2 -16.5 23.5 17.6 24 24 A G H >< S+ 0 0 31 -4,-2.7 3,-1.8 -5,-0.4 -3,-0.2 0.777 98.5 69.8 -64.8 -27.9 -18.0 26.3 19.7 25 25 A R T 3< S+ 0 0 133 -4,-1.9 -1,-0.3 1,-0.3 4,-0.2 0.682 94.9 58.9 -66.6 -13.1 -17.5 24.6 23.0 26 26 A M T X> S+ 0 0 2 -3,-1.9 4,-2.5 1,-0.2 3,-0.6 0.550 77.4 93.9 -89.2 -7.6 -13.8 25.1 22.5 27 27 A T H <> S+ 0 0 44 -3,-1.8 4,-2.2 1,-0.3 6,-0.2 0.903 84.2 49.2 -52.9 -48.8 -14.1 28.9 22.3 28 28 A P H 34>S+ 0 0 47 0, 0.0 6,-1.7 0, 0.0 5,-1.5 0.835 111.5 51.2 -61.6 -33.3 -13.4 29.5 26.0 29 29 A V H X45S+ 0 0 15 -3,-0.6 3,-1.3 -4,-0.2 -2,-0.2 0.947 109.7 46.8 -67.0 -48.1 -10.3 27.3 25.8 30 30 A V H 3<5S+ 0 0 19 -4,-2.5 -1,-0.2 1,-0.3 -3,-0.2 0.884 114.0 50.4 -67.1 -29.9 -8.8 29.0 22.8 31 31 A K T 3<5S- 0 0 143 -4,-2.2 -1,-0.3 -5,-0.3 -2,-0.2 0.538 112.8-119.6 -78.5 -7.6 -9.5 32.4 24.5 32 32 A G T < 5S+ 0 0 61 -3,-1.3 -3,-0.2 -4,-0.4 -2,-0.1 0.471 84.5 116.4 81.7 2.7 -7.8 31.2 27.8 33 33 A Q S - 0 0 88 -2,-0.7 4,-2.3 1,-0.1 5,-0.2 -0.963 17.1-156.2-110.0 108.5 -6.3 20.0 28.9 38 38 A A H > S+ 0 0 42 -2,-0.6 4,-2.6 1,-0.2 5,-0.2 0.878 90.8 50.0 -59.1 -42.2 -4.6 18.6 25.8 39 39 A A H > S+ 0 0 72 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.918 110.1 50.6 -64.2 -43.7 -6.2 15.2 26.2 40 40 A Q H > S+ 0 0 119 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.933 113.9 44.6 -56.5 -50.4 -9.7 16.6 26.5 41 41 A I H X S+ 0 0 6 -4,-2.3 4,-2.9 2,-0.2 5,-0.2 0.912 110.3 54.6 -65.7 -40.3 -9.2 18.8 23.4 42 42 A K H X S+ 0 0 106 -4,-2.6 4,-1.8 55,-0.3 -1,-0.2 0.926 111.5 45.2 -56.1 -49.2 -7.7 15.9 21.4 43 43 A A H X S+ 0 0 60 -4,-2.3 4,-1.7 2,-0.2 -1,-0.2 0.903 113.3 49.4 -63.2 -41.6 -10.7 13.8 22.1 44 44 A N H X S+ 0 0 18 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.910 109.4 51.2 -67.6 -40.1 -13.2 16.5 21.3 45 45 A V H X S+ 0 0 2 -4,-2.9 4,-2.7 1,-0.2 -1,-0.2 0.860 105.1 57.3 -68.3 -29.3 -11.5 17.4 18.0 46 46 A E H X S+ 0 0 84 -4,-1.8 4,-2.0 -5,-0.2 -1,-0.2 0.916 108.2 47.1 -62.9 -42.8 -11.6 13.7 17.1 47 47 A V H X S+ 0 0 64 -4,-1.7 4,-2.6 1,-0.2 -2,-0.2 0.950 111.9 50.3 -60.2 -47.0 -15.4 13.8 17.6 48 48 A L H X S+ 0 0 2 -4,-2.5 4,-2.7 1,-0.2 -2,-0.2 0.881 106.4 56.2 -59.5 -39.1 -15.5 17.0 15.5 49 49 A K H X S+ 0 0 107 -4,-2.7 4,-0.6 2,-0.2 -1,-0.2 0.935 110.1 44.9 -54.8 -52.8 -13.5 15.3 12.8 50 50 A T H >< S+ 0 0 84 -4,-2.0 3,-1.1 1,-0.2 4,-0.4 0.946 116.0 45.7 -58.0 -50.0 -16.1 12.6 12.5 51 51 A L H >< S+ 0 0 22 -4,-2.6 3,-1.7 1,-0.2 -2,-0.2 0.865 103.2 64.4 -64.5 -35.4 -19.0 15.0 12.6 52 52 A S H 3< S+ 0 0 2 -4,-2.7 -1,-0.2 1,-0.3 4,-0.2 0.607 99.8 53.4 -65.9 -18.3 -17.4 17.3 10.0 53 53 A A T << S+ 0 0 49 -3,-1.1 4,-0.4 -4,-0.6 -1,-0.3 0.562 97.5 70.5 -87.7 -13.2 -17.5 14.7 7.3 54 54 A L S < S+ 0 0 62 -3,-1.7 3,-0.5 -4,-0.4 4,-0.3 0.802 79.8 61.9 -84.6 -35.3 -21.2 14.0 7.7 55 55 A P S > S+ 0 0 0 0, 0.0 3,-1.8 0, 0.0 -1,-0.2 0.854 91.2 67.1 -62.5 -32.1 -23.4 16.9 6.4 56 56 A W G > S+ 0 0 38 1,-0.3 3,-1.9 2,-0.2 -2,-0.1 0.853 92.0 57.5 -69.5 -33.0 -22.3 16.8 2.8 57 57 A A G 3 S+ 0 0 80 -3,-0.5 3,-0.4 -4,-0.4 -1,-0.3 0.634 99.2 64.2 -71.2 -9.9 -23.8 13.5 1.8 58 58 A A G < S+ 0 0 1 -3,-1.8 -1,-0.3 -4,-0.3 -46,-0.2 0.222 87.4 67.7 -99.2 13.3 -27.2 14.9 2.9 59 59 A F S < S+ 0 0 28 -3,-1.9 -1,-0.2 -47,-0.1 3,-0.1 -0.247 79.5 143.5-112.2 35.1 -27.1 17.6 0.2 60 60 A G > - 0 0 19 -3,-0.4 3,-1.9 1,-0.2 -2,-0.1 -0.049 63.1 -53.9 -72.5 171.2 -27.5 14.8 -2.4 61 61 A P T 3 S+ 0 0 134 0, 0.0 -1,-0.2 0, 0.0 12,-0.0 -0.240 126.1 9.0 -55.5 137.6 -29.5 15.1 -5.5 62 62 A G T 3 S+ 0 0 44 -3,-0.1 -2,-0.1 1,-0.1 -3,-0.0 0.603 89.3 118.8 71.2 15.9 -33.1 16.2 -4.9 63 63 A T < + 0 0 13 -3,-1.9 -1,-0.1 -55,-0.1 -3,-0.1 -0.021 37.8 153.1 -96.5 29.1 -32.6 17.0 -1.2 64 64 A E + 0 0 100 -5,-0.1 2,-0.3 -56,-0.0 -55,-0.1 -0.233 27.2 71.8 -56.7 147.0 -33.5 20.8 -1.6 65 65 A G > + 0 0 33 3,-0.3 3,-1.8 -57,-0.1 -2,-0.0 -0.921 50.9 69.6 138.1-177.0 -35.0 22.7 1.5 66 66 A G T 3 S- 0 0 36 -2,-0.3 -1,-0.1 1,-0.2 -56,-0.0 -0.247 115.1 -39.8 58.8-144.1 -34.2 24.1 4.9 67 67 A D T 3 S+ 0 0 107 -58,-0.1 58,-3.1 2,-0.1 2,-0.3 0.151 99.0 130.4-102.3 19.4 -32.0 27.1 4.7 68 68 A A B < -A 124 0A 11 -3,-1.8 -3,-0.3 56,-0.2 56,-0.2 -0.566 57.0-130.7 -73.6 124.7 -29.8 25.7 1.9 69 69 A R > - 0 0 78 54,-2.9 3,-1.8 -2,-0.3 4,-0.3 -0.598 16.6-121.0 -72.7 149.1 -29.4 28.1 -1.0 70 70 A P T >> S+ 0 0 79 0, 0.0 3,-2.0 0, 0.0 4,-1.1 0.760 103.5 78.3 -61.5 -26.6 -30.1 26.7 -4.5 71 71 A E H 3> S+ 0 0 76 1,-0.3 4,-1.2 2,-0.2 8,-0.2 0.684 75.0 77.7 -61.4 -17.8 -26.6 27.5 -5.7 72 72 A I H <4 S+ 0 0 7 -3,-1.8 -1,-0.3 51,-0.2 7,-0.3 0.881 105.6 33.2 -54.4 -35.1 -25.3 24.4 -3.8 73 73 A W H X4 S+ 0 0 56 -3,-2.0 3,-0.5 -4,-0.3 -2,-0.2 0.755 108.2 60.2 -98.9 -29.4 -26.7 22.4 -6.7 74 74 A S H 3< S+ 0 0 100 -4,-1.1 2,-0.2 1,-0.3 -1,-0.2 0.686 118.0 32.8 -76.0 -18.2 -26.3 24.4 -9.8 75 75 A D T 3X + 0 0 73 -4,-1.2 4,-1.8 1,-0.1 -1,-0.3 -0.667 68.6 171.2-132.5 80.2 -22.5 24.5 -9.2 76 76 A A H <> S+ 0 0 70 -3,-0.5 4,-2.0 1,-0.2 5,-0.1 0.825 74.9 57.9 -55.1 -28.9 -21.6 21.2 -7.6 77 77 A A H > S+ 0 0 65 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.911 104.4 46.5 -78.3 -39.1 -17.9 21.9 -8.1 78 78 A S H > S+ 0 0 48 -3,-0.3 4,-1.8 2,-0.2 -1,-0.2 0.874 113.5 49.2 -69.3 -40.3 -17.7 25.1 -6.1 79 79 A F H X S+ 0 0 18 -4,-1.8 4,-2.3 -7,-0.3 5,-0.2 0.912 111.1 50.8 -63.3 -44.6 -19.7 23.7 -3.2 80 80 A K H X S+ 0 0 130 -4,-2.0 4,-2.8 -5,-0.3 5,-0.3 0.917 107.3 52.5 -59.3 -44.1 -17.5 20.6 -3.1 81 81 A Q H X S+ 0 0 142 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.925 109.6 52.3 -54.1 -45.3 -14.4 22.8 -3.1 82 82 A K H X S+ 0 0 72 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.895 112.9 40.6 -56.5 -53.2 -15.9 24.6 -0.1 83 83 A Q H X S+ 0 0 28 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.901 116.3 49.9 -69.4 -38.3 -16.7 21.5 2.0 84 84 A Q H X S+ 0 0 87 -4,-2.8 4,-1.8 -5,-0.2 -2,-0.2 0.897 111.5 48.7 -68.4 -38.8 -13.4 19.8 1.1 85 85 A A H X S+ 0 0 49 -4,-2.6 4,-2.0 -5,-0.3 -1,-0.2 0.916 110.7 51.4 -63.6 -45.2 -11.4 22.9 2.0 86 86 A F H X S+ 0 0 14 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.940 109.1 51.2 -53.2 -48.1 -13.4 23.1 5.3 87 87 A Q H X S+ 0 0 39 -4,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.870 106.8 53.2 -63.4 -33.5 -12.5 19.5 6.0 88 88 A D H X S+ 0 0 105 -4,-1.8 4,-1.6 2,-0.2 -1,-0.2 0.860 105.8 53.1 -71.9 -30.5 -8.8 20.3 5.4 89 89 A N H X S+ 0 0 39 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.892 106.2 54.1 -64.0 -35.7 -9.0 23.1 7.9 90 90 A I H X S+ 0 0 4 -4,-2.2 4,-2.8 1,-0.2 -2,-0.2 0.899 103.1 56.8 -60.9 -38.9 -10.4 20.5 10.3 91 91 A V H X S+ 0 0 87 -4,-1.8 4,-2.5 1,-0.2 -1,-0.2 0.912 105.9 49.8 -58.4 -41.6 -7.3 18.4 9.5 92 92 A K H X S+ 0 0 96 -4,-1.6 4,-2.2 2,-0.2 -1,-0.2 0.904 110.6 50.0 -63.9 -39.6 -5.1 21.3 10.6 93 93 A L H X S+ 0 0 0 -4,-1.9 4,-2.6 15,-0.2 -2,-0.2 0.911 110.1 50.5 -63.2 -44.2 -7.1 21.6 13.9 94 94 A S H X S+ 0 0 11 -4,-2.8 4,-2.8 2,-0.2 -2,-0.2 0.892 109.5 51.0 -57.6 -44.7 -6.7 17.8 14.4 95 95 A A H X S+ 0 0 58 -4,-2.5 4,-1.8 2,-0.2 -2,-0.2 0.922 111.4 47.4 -60.1 -43.7 -3.0 18.1 13.9 96 96 A A H X>S+ 0 0 2 -4,-2.2 5,-2.3 2,-0.2 4,-0.7 0.927 115.0 45.9 -63.6 -45.8 -2.7 21.0 16.4 97 97 A A H ><5S+ 0 0 2 -4,-2.6 3,-0.8 1,-0.2 -55,-0.3 0.904 112.0 50.4 -62.6 -43.3 -4.9 19.0 19.0 98 98 A D H 3<5S+ 0 0 86 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.827 112.0 48.8 -67.7 -32.0 -3.0 15.8 18.5 99 99 A A H 3<5S- 0 0 70 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.601 105.7-128.5 -79.0 -11.1 0.3 17.7 19.0 100 100 A G T <<5 + 0 0 32 -3,-0.8 2,-0.9 -4,-0.7 -3,-0.2 0.832 55.9 153.7 60.6 33.9 -1.0 19.4 22.2 101 101 A D >< - 0 0 53 -5,-2.3 4,-2.3 -6,-0.2 -1,-0.2 -0.824 26.9-173.8-101.3 102.0 0.1 22.7 20.5 102 102 A L H > S+ 0 0 66 -2,-0.9 4,-2.6 1,-0.2 5,-0.2 0.877 83.5 51.3 -62.8 -45.7 -2.0 25.5 21.9 103 103 A D H > S+ 0 0 114 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.915 113.0 46.3 -57.1 -47.4 -0.7 28.2 19.6 104 104 A K H > S+ 0 0 132 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.873 110.0 55.0 -65.5 -36.1 -1.4 26.0 16.7 105 105 A L H X S+ 0 0 1 -4,-2.3 4,-2.7 -9,-0.2 -2,-0.2 0.928 106.9 49.8 -62.4 -45.4 -4.8 25.2 18.0 106 106 A R H X S+ 0 0 151 -4,-2.6 4,-1.9 2,-0.2 -1,-0.2 0.920 113.8 45.7 -56.0 -46.6 -5.8 28.9 18.3 107 107 A A H X S+ 0 0 53 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.944 114.6 46.4 -68.0 -43.8 -4.7 29.6 14.8 108 108 A A H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 -15,-0.2 0.867 108.4 56.7 -65.1 -38.6 -6.4 26.6 13.3 109 109 A F H X S+ 0 0 22 -4,-2.7 4,-2.5 -5,-0.2 -1,-0.2 0.915 107.9 48.1 -60.2 -44.3 -9.6 27.3 15.2 110 110 A G H X S+ 0 0 41 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.910 111.5 49.7 -63.5 -40.7 -9.8 30.8 13.7 111 111 A D H X S+ 0 0 69 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.900 110.2 50.7 -67.6 -38.5 -9.2 29.4 10.2 112 112 A V H X S+ 0 0 1 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.955 109.8 50.5 -58.1 -50.4 -11.9 26.8 10.7 113 113 A G H X S+ 0 0 25 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.898 108.3 51.9 -57.7 -40.8 -14.3 29.4 11.8 114 114 A A H X S+ 0 0 60 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.877 108.2 52.8 -61.8 -37.8 -13.6 31.5 8.8 115 115 A S H X S+ 0 0 19 -4,-1.8 4,-1.8 2,-0.2 -2,-0.2 0.872 107.1 51.3 -66.2 -40.8 -14.3 28.5 6.6 116 116 A C H X S+ 0 0 37 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.965 113.2 45.3 -58.0 -50.2 -17.7 27.9 8.2 117 117 A K H X S+ 0 0 123 -4,-2.2 4,-2.8 1,-0.2 -2,-0.2 0.893 107.6 57.6 -65.1 -38.9 -18.6 31.6 7.6 118 118 A A H X S+ 0 0 41 -4,-2.5 4,-1.4 1,-0.2 -1,-0.2 0.908 110.0 45.0 -59.7 -43.0 -17.3 31.5 3.9 119 119 A C H X S+ 0 0 22 -4,-1.8 4,-2.7 2,-0.2 5,-0.3 0.951 112.4 50.4 -66.5 -46.1 -19.6 28.7 3.1 120 120 A H H X S+ 0 0 104 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.903 105.4 58.0 -56.3 -41.1 -22.6 30.3 4.9 121 121 A D H < S+ 0 0 70 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.913 120.0 28.4 -54.0 -45.1 -22.0 33.6 3.0 122 122 A A H < S+ 0 0 34 -4,-1.4 -1,-0.2 -3,-0.3 -2,-0.2 0.754 134.3 24.1 -86.5 -32.4 -22.4 31.7 -0.3 123 123 A Y H < S+ 0 0 26 -4,-2.7 -54,-2.9 -5,-0.1 2,-0.4 0.452 97.7 79.5-129.3 -5.2 -24.7 28.8 0.4 124 124 A A B < S-A 68 0A 30 -4,-2.1 -56,-0.2 -5,-0.3 2,-0.1 -0.937 74.6-119.0-112.1 135.8 -27.0 29.4 3.5 125 125 A K 0 0 113 -58,-3.1 -2,-0.1 -2,-0.4 -58,-0.0 -0.406 360.0 360.0 -68.8 144.5 -30.1 31.6 3.3 126 126 A K 0 0 208 -2,-0.1 -1,-0.1 -5,-0.1 -5,-0.0 0.176 360.0 360.0 -86.9 360.0 -30.3 34.7 5.5