==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-JUN-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ELECTRON TRANSPORT 31-MAY-11 2YL7 . COMPND 2 MOLECULE: CYTOCHROME C'; . SOURCE 2 ORGANISM_SCIENTIFIC: ACHROMOBACTER XYLOSOXIDANS; . AUTHOR S.V.ANTONYUK,N.RUSTAGE,R.R.EADY,S.S.HASNAIN . 126 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7535.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 101 80.2 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 . 4 3.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 15 11.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 77 61.1 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 0 1 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 9.9 30.5 -6.7 3.2 2 2 A F - 0 0 55 1,-0.1 6,-0.0 9,-0.0 4,-0.0 -0.904 360.0-160.1-114.3 123.5 33.4 -9.3 3.1 3 3 A A S S+ 0 0 96 -2,-0.5 -1,-0.1 1,-0.1 3,-0.0 0.873 83.1 7.5 -67.0 -38.4 36.9 -8.3 2.4 4 4 A K S >> S- 0 0 138 1,-0.1 3,-1.6 59,-0.0 4,-1.1 -0.934 83.0-103.8-136.3 160.5 37.9 -11.9 1.4 5 5 A P H 3> S+ 0 0 53 0, 0.0 4,-2.2 0, 0.0 3,-0.5 0.872 118.7 64.7 -54.3 -35.2 36.0 -15.1 0.9 6 6 A E H 3> S+ 0 0 117 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.797 97.4 55.4 -59.1 -31.4 37.3 -16.3 4.3 7 7 A D H <> S+ 0 0 56 -3,-1.6 4,-2.1 2,-0.2 -1,-0.2 0.869 106.4 49.5 -70.6 -36.0 35.3 -13.5 5.9 8 8 A A H X S+ 0 0 0 -4,-1.1 4,-2.7 -3,-0.5 5,-0.2 0.904 111.1 50.6 -65.0 -42.1 32.1 -14.7 4.3 9 9 A V H X S+ 0 0 16 -4,-2.2 4,-2.4 1,-0.2 5,-0.2 0.943 110.1 49.0 -60.1 -48.2 32.8 -18.2 5.5 10 10 A K H X S+ 0 0 134 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.915 112.6 49.3 -59.1 -43.7 33.4 -17.0 9.1 11 11 A Y H X S+ 0 0 90 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.952 112.1 45.0 -60.2 -53.6 30.2 -15.0 9.0 12 12 A R H X S+ 0 0 16 -4,-2.7 4,-2.3 46,-0.2 -1,-0.2 0.873 112.7 51.8 -67.1 -33.8 27.9 -17.8 7.7 13 13 A Q H X S+ 0 0 96 -4,-2.4 4,-2.5 -5,-0.2 -1,-0.2 0.922 110.4 48.6 -64.9 -43.3 29.4 -20.3 10.1 14 14 A S H X S+ 0 0 77 -4,-2.2 4,-2.2 -5,-0.2 -2,-0.2 0.875 109.2 53.0 -63.8 -37.6 28.8 -18.0 13.1 15 15 A A H X S+ 0 0 7 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.930 109.5 49.4 -61.9 -43.4 25.2 -17.5 11.9 16 16 A G H X S+ 0 0 31 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.923 108.2 53.6 -58.4 -44.5 24.8 -21.3 11.9 17 17 A T H X S+ 0 0 93 -4,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.921 112.4 43.4 -55.3 -48.1 26.3 -21.5 15.4 18 18 A L H X S+ 0 0 86 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.901 112.3 53.2 -69.6 -38.1 23.8 -19.0 16.7 19 19 A M H X S+ 0 0 24 -4,-2.6 4,-2.5 1,-0.2 5,-0.3 0.893 107.7 51.9 -58.7 -43.3 20.9 -20.6 14.8 20 20 A A H X S+ 0 0 64 -4,-2.7 4,-2.5 1,-0.2 5,-0.3 0.892 111.4 47.0 -63.7 -40.3 21.7 -23.9 16.3 21 21 A S H X S+ 0 0 54 -4,-1.8 4,-1.8 -5,-0.2 -2,-0.2 0.922 114.6 44.6 -67.6 -45.2 21.7 -22.5 19.8 22 22 A H H < S+ 0 0 32 -4,-2.5 -2,-0.2 2,-0.2 -1,-0.2 0.823 122.0 39.1 -72.1 -28.9 18.4 -20.6 19.4 23 23 A F H >< S+ 0 0 35 -4,-2.5 3,-1.9 -5,-0.2 4,-0.3 0.946 118.3 45.9 -76.8 -56.1 16.7 -23.6 17.7 24 24 A G H >< S+ 0 0 31 -4,-2.5 3,-1.8 -5,-0.3 -3,-0.2 0.781 98.6 69.2 -64.2 -28.5 18.2 -26.4 19.8 25 25 A R T 3< S+ 0 0 132 -4,-1.8 -1,-0.3 -5,-0.3 4,-0.2 0.685 95.5 58.1 -65.6 -15.9 17.6 -24.6 23.2 26 26 A M T X> S+ 0 0 2 -3,-1.9 4,-2.5 1,-0.2 3,-0.6 0.556 77.9 93.4 -87.3 -8.1 13.8 -25.2 22.6 27 27 A T H <> S+ 0 0 40 -3,-1.8 4,-2.2 -4,-0.3 6,-0.2 0.899 85.0 48.9 -52.8 -47.7 14.2 -29.0 22.3 28 28 A P H 34>S+ 0 0 50 0, 0.0 6,-1.8 0, 0.0 5,-1.5 0.837 111.4 51.8 -64.0 -30.6 13.4 -29.6 26.0 29 29 A V H X45S+ 0 0 14 -3,-0.6 3,-1.1 -4,-0.2 -2,-0.2 0.942 110.0 46.1 -68.4 -48.2 10.4 -27.3 25.8 30 30 A V H 3<5S+ 0 0 21 -4,-2.5 -1,-0.2 1,-0.3 -3,-0.2 0.873 114.3 50.0 -67.1 -28.9 8.9 -29.1 22.8 31 31 A K T 3<5S- 0 0 137 -4,-2.2 -1,-0.3 -5,-0.3 -2,-0.2 0.546 113.0-120.7 -79.3 -10.9 9.5 -32.5 24.6 32 32 A G T < 5S+ 0 0 60 -3,-1.1 -3,-0.2 -4,-0.4 -2,-0.1 0.481 83.8 116.9 83.0 2.7 7.9 -31.2 27.8 33 33 A Q S - 0 0 86 -2,-0.7 4,-2.3 1,-0.2 5,-0.2 -0.967 17.8-154.9-111.8 110.2 6.4 -20.1 28.9 38 38 A A H > S+ 0 0 41 -2,-0.6 4,-2.6 1,-0.2 5,-0.2 0.873 91.0 49.2 -58.0 -43.0 4.7 -18.6 25.9 39 39 A A H > S+ 0 0 70 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.903 109.9 51.3 -65.4 -40.6 6.3 -15.2 26.2 40 40 A Q H > S+ 0 0 120 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.934 113.9 44.1 -60.7 -46.0 9.8 -16.7 26.5 41 41 A I H X S+ 0 0 5 -4,-2.3 4,-2.9 2,-0.2 5,-0.3 0.903 110.1 55.3 -68.9 -39.5 9.4 -18.8 23.4 42 42 A K H X S+ 0 0 109 -4,-2.6 4,-1.8 55,-0.3 -1,-0.2 0.936 111.3 44.9 -56.1 -47.0 7.8 -16.0 21.4 43 43 A A H X S+ 0 0 61 -4,-2.3 4,-1.5 1,-0.2 -1,-0.2 0.904 113.4 50.0 -65.6 -41.1 10.9 -13.8 22.2 44 44 A N H X S+ 0 0 18 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.908 109.0 51.0 -65.7 -40.7 13.3 -16.6 21.4 45 45 A V H X S+ 0 0 2 -4,-2.9 4,-2.7 1,-0.2 -1,-0.2 0.865 105.1 57.6 -66.3 -32.4 11.6 -17.4 18.1 46 46 A E H X S+ 0 0 89 -4,-1.8 4,-1.7 -5,-0.3 -1,-0.2 0.861 107.8 47.1 -64.9 -35.3 11.8 -13.7 17.1 47 47 A V H X S+ 0 0 61 -4,-1.5 4,-2.6 2,-0.2 -2,-0.2 0.937 112.2 49.7 -64.7 -48.3 15.7 -13.9 17.6 48 48 A L H X S+ 0 0 3 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.884 107.3 55.8 -59.0 -38.9 15.8 -17.1 15.6 49 49 A K H X S+ 0 0 99 -4,-2.7 4,-0.7 2,-0.2 -1,-0.2 0.935 109.6 45.5 -56.5 -51.4 13.7 -15.4 12.8 50 50 A T H >< S+ 0 0 82 -4,-1.7 3,-1.0 1,-0.2 4,-0.3 0.946 115.8 46.2 -59.1 -48.4 16.3 -12.6 12.6 51 51 A L H >< S+ 0 0 19 -4,-2.6 3,-1.9 1,-0.2 -1,-0.2 0.875 103.7 62.1 -62.6 -37.4 19.2 -15.0 12.5 52 52 A S H 3< S+ 0 0 1 -4,-2.6 -1,-0.2 1,-0.3 4,-0.2 0.634 99.5 55.6 -74.8 -7.9 17.7 -17.4 10.0 53 53 A A T << S+ 0 0 50 -3,-1.0 4,-0.4 -4,-0.7 -1,-0.3 0.528 97.2 71.4 -86.5 -12.1 17.6 -14.6 7.3 54 54 A L S < S+ 0 0 61 -3,-1.9 3,-0.5 -4,-0.3 4,-0.4 0.817 79.4 61.6 -84.0 -37.0 21.4 -14.0 7.7 55 55 A P S > S+ 0 0 5 0, 0.0 3,-1.8 0, 0.0 -1,-0.2 0.847 90.7 67.5 -62.4 -33.5 23.4 -16.9 6.2 56 56 A W G > S+ 0 0 47 1,-0.3 3,-1.8 -4,-0.2 -2,-0.1 0.849 93.5 54.6 -68.9 -34.3 22.3 -16.7 2.6 57 57 A A G 3 S+ 0 0 79 -3,-0.5 3,-0.5 -4,-0.4 -1,-0.3 0.619 99.7 65.8 -70.8 -10.1 23.8 -13.4 1.7 58 58 A A G < S+ 0 0 1 -3,-1.8 -1,-0.3 -4,-0.4 -46,-0.2 0.241 86.7 67.9 -97.2 12.7 27.2 -14.8 2.9 59 59 A F S < S+ 0 0 38 -3,-1.8 -1,-0.2 -47,-0.1 3,-0.1 -0.249 79.5 142.3-112.1 36.8 27.2 -17.4 0.1 60 60 A G > - 0 0 22 -3,-0.5 3,-2.0 1,-0.2 -2,-0.1 -0.032 63.8 -55.2 -75.7 173.9 27.7 -14.5 -2.5 61 61 A P T 3 S+ 0 0 133 0, 0.0 -1,-0.2 0, 0.0 12,-0.0 -0.248 126.0 14.0 -59.0 139.8 29.8 -14.7 -5.6 62 62 A G T 3 S+ 0 0 45 -3,-0.1 -2,-0.1 1,-0.1 -3,-0.0 0.452 91.7 113.0 82.4 0.1 33.4 -15.6 -4.9 63 63 A T < + 0 0 12 -3,-2.0 -1,-0.1 -55,-0.1 -3,-0.1 0.061 35.0 146.7 -97.9 28.0 32.8 -16.8 -1.3 64 64 A E + 0 0 100 -5,-0.1 2,-0.3 -4,-0.0 -55,-0.1 -0.259 32.2 80.4 -54.9 147.2 33.5 -20.6 -1.9 65 65 A G > + 0 0 34 3,-0.3 3,-1.7 1,-0.1 -2,-0.0 -0.855 50.9 59.4 141.2 179.6 35.2 -22.4 1.4 66 66 A G T 3 S- 0 0 35 -2,-0.3 -1,-0.1 1,-0.2 -56,-0.0 -0.216 115.2 -37.2 56.0-151.4 34.5 -23.9 4.6 67 67 A D T 3 S+ 0 0 92 -58,-0.1 58,-3.1 58,-0.1 2,-0.3 0.160 97.1 127.5 -93.4 14.5 32.2 -26.9 4.5 68 68 A A B < -A 124 0A 11 -3,-1.7 -3,-0.3 56,-0.2 56,-0.2 -0.588 59.1-131.2 -64.6 134.2 30.0 -25.4 1.9 69 69 A R > - 0 0 64 54,-2.9 3,-1.6 -2,-0.3 4,-0.2 -0.605 16.8-119.4 -78.1 149.8 29.6 -28.0 -0.9 70 70 A P T >> S+ 0 0 81 0, 0.0 3,-1.2 0, 0.0 4,-1.1 0.776 103.8 81.9 -64.8 -21.5 30.2 -26.7 -4.4 71 71 A E H 3> S+ 0 0 68 1,-0.2 4,-0.7 2,-0.2 8,-0.2 0.615 76.5 74.7 -59.1 -10.9 26.6 -27.6 -5.4 72 72 A I H <4 S+ 0 0 8 -3,-1.6 7,-0.2 51,-0.2 -1,-0.2 0.831 102.7 34.2 -66.5 -46.0 25.4 -24.2 -3.8 73 73 A W H X4 S+ 0 0 54 -3,-1.2 3,-0.7 -4,-0.2 -2,-0.2 0.829 114.9 52.4 -88.8 -33.2 26.6 -21.8 -6.6 74 74 A S H 3< S+ 0 0 91 -4,-1.1 2,-0.2 1,-0.3 -2,-0.1 0.743 116.8 40.1 -77.3 -21.1 26.2 -23.9 -9.7 75 75 A D T 3X S+ 0 0 77 -4,-0.7 4,-2.1 1,-0.1 -1,-0.3 -0.559 74.8 159.5-118.3 60.6 22.5 -24.6 -8.9 76 76 A A H <> S+ 0 0 63 -3,-0.7 4,-2.2 1,-0.2 5,-0.2 0.884 70.2 50.6 -59.6 -42.0 21.6 -21.2 -7.6 77 77 A A H > S+ 0 0 74 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.901 111.0 49.3 -64.0 -38.5 17.9 -21.5 -8.0 78 78 A S H > S+ 0 0 66 -3,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.917 111.4 46.4 -68.3 -47.5 17.8 -24.8 -6.2 79 79 A F H X S+ 0 0 18 -4,-2.1 4,-2.3 -7,-0.2 5,-0.2 0.907 112.0 53.9 -55.4 -42.9 19.8 -23.6 -3.2 80 80 A K H X S+ 0 0 125 -4,-2.2 4,-2.7 -5,-0.3 5,-0.2 0.911 104.2 54.1 -63.0 -39.8 17.6 -20.5 -3.1 81 81 A Q H X S+ 0 0 143 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.920 109.3 49.5 -57.8 -44.3 14.4 -22.7 -3.0 82 82 A K H X S+ 0 0 78 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.910 112.8 44.3 -65.2 -43.6 15.8 -24.5 0.0 83 83 A Q H X S+ 0 0 27 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.894 115.4 48.8 -69.7 -34.6 16.7 -21.4 2.0 84 84 A Q H X S+ 0 0 87 -4,-2.7 4,-2.0 -5,-0.2 -2,-0.2 0.904 112.2 48.2 -69.4 -39.0 13.4 -19.7 1.1 85 85 A A H X S+ 0 0 38 -4,-2.5 4,-2.4 -5,-0.2 -2,-0.2 0.910 110.9 52.1 -66.0 -41.6 11.4 -22.9 2.1 86 86 A F H X S+ 0 0 12 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.939 109.1 48.7 -57.1 -48.5 13.4 -23.0 5.4 87 87 A Q H X S+ 0 0 48 -4,-2.4 4,-1.9 1,-0.2 -1,-0.2 0.871 109.1 53.9 -64.4 -33.5 12.5 -19.3 6.1 88 88 A D H X S+ 0 0 104 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.910 106.5 52.0 -58.8 -46.8 8.8 -20.2 5.3 89 89 A N H X S+ 0 0 42 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.878 107.7 52.8 -58.1 -40.7 9.1 -23.1 7.9 90 90 A I H X S+ 0 0 6 -4,-2.1 4,-2.8 1,-0.2 -1,-0.2 0.905 104.2 55.7 -63.9 -37.8 10.5 -20.4 10.3 91 91 A V H X S+ 0 0 90 -4,-1.9 4,-2.5 1,-0.2 -2,-0.2 0.913 106.7 50.1 -58.7 -41.9 7.4 -18.2 9.6 92 92 A K H X S+ 0 0 96 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.902 110.9 49.0 -62.4 -41.1 5.2 -21.2 10.6 93 93 A L H X S+ 0 0 0 -4,-2.0 4,-2.6 15,-0.2 -2,-0.2 0.910 110.7 50.7 -63.8 -43.3 7.2 -21.5 13.9 94 94 A S H X S+ 0 0 11 -4,-2.8 4,-3.0 2,-0.2 5,-0.2 0.895 109.5 50.8 -58.8 -44.3 6.8 -17.7 14.5 95 95 A A H X S+ 0 0 58 -4,-2.5 4,-1.8 2,-0.2 -2,-0.2 0.923 111.8 47.3 -62.4 -42.4 3.0 -18.0 14.0 96 96 A A H X>S+ 0 0 3 -4,-2.2 5,-2.2 1,-0.2 4,-0.7 0.926 115.4 45.2 -62.6 -45.8 2.8 -20.9 16.4 97 97 A A H ><5S+ 0 0 2 -4,-2.6 3,-0.8 1,-0.2 -55,-0.3 0.900 112.1 51.0 -65.2 -46.9 5.0 -19.0 19.0 98 98 A D H 3<5S+ 0 0 86 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.828 111.5 49.2 -60.3 -33.6 3.1 -15.8 18.6 99 99 A A H 3<5S- 0 0 73 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.597 106.8-127.3 -78.7 -13.3 -0.2 -17.7 19.1 100 100 A G T <<5 + 0 0 33 -3,-0.8 2,-0.8 -4,-0.7 -3,-0.2 0.823 56.7 151.8 68.8 29.9 1.0 -19.4 22.2 101 101 A D >< - 0 0 55 -5,-2.2 4,-2.4 -6,-0.2 -1,-0.2 -0.830 28.8-172.7-106.3 102.7 0.0 -22.7 20.7 102 102 A L H > S+ 0 0 62 -2,-0.8 4,-2.5 2,-0.2 5,-0.2 0.841 85.3 51.5 -64.5 -39.4 2.2 -25.5 22.0 103 103 A D H > S+ 0 0 114 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.935 113.3 45.8 -64.7 -43.6 0.8 -28.2 19.6 104 104 A K H > S+ 0 0 124 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.894 111.1 54.0 -62.7 -38.8 1.5 -25.9 16.7 105 105 A L H X S+ 0 0 1 -4,-2.4 4,-2.7 -9,-0.2 -2,-0.2 0.929 107.5 49.8 -62.5 -46.5 4.9 -25.2 18.1 106 106 A R H X S+ 0 0 147 -4,-2.5 4,-2.0 2,-0.2 -1,-0.2 0.924 114.1 44.8 -55.9 -48.6 5.9 -28.9 18.3 107 107 A A H X S+ 0 0 55 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.931 115.3 46.2 -66.1 -45.8 4.8 -29.5 14.8 108 108 A A H X S+ 0 0 0 -4,-2.6 4,-2.5 1,-0.2 -15,-0.2 0.871 109.0 56.4 -64.8 -36.9 6.5 -26.4 13.3 109 109 A F H X S+ 0 0 22 -4,-2.7 4,-2.6 -5,-0.2 -1,-0.2 0.922 107.2 49.5 -60.5 -45.0 9.7 -27.2 15.3 110 110 A G H X S+ 0 0 40 -4,-2.0 4,-2.2 1,-0.2 -1,-0.2 0.901 110.8 49.2 -61.4 -41.8 9.9 -30.6 13.7 111 111 A D H X S+ 0 0 68 -4,-1.9 4,-1.7 2,-0.2 -2,-0.2 0.902 110.4 50.6 -69.1 -36.6 9.4 -29.2 10.2 112 112 A V H X S+ 0 0 1 -4,-2.5 4,-2.3 2,-0.2 3,-0.2 0.949 110.3 49.9 -59.9 -49.8 12.1 -26.5 10.8 113 113 A G H X S+ 0 0 22 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.900 108.9 51.9 -58.3 -40.6 14.6 -29.2 12.0 114 114 A A H X S+ 0 0 58 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.867 108.7 51.8 -62.3 -36.2 13.8 -31.3 8.9 115 115 A S H X S+ 0 0 23 -4,-1.7 4,-1.9 -3,-0.2 -2,-0.2 0.896 108.3 50.1 -69.5 -41.1 14.5 -28.3 6.7 116 116 A C H X S+ 0 0 35 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.957 114.8 45.1 -56.8 -50.1 17.9 -27.6 8.4 117 117 A K H X S+ 0 0 122 -4,-2.3 4,-2.9 1,-0.2 -2,-0.2 0.889 108.9 55.1 -65.3 -41.3 18.9 -31.2 7.9 118 118 A A H X S+ 0 0 44 -4,-2.5 4,-1.4 2,-0.2 -1,-0.2 0.896 111.5 44.4 -61.9 -40.3 17.7 -31.4 4.3 119 119 A C H X S+ 0 0 23 -4,-1.9 4,-2.8 2,-0.2 3,-0.3 0.950 113.8 48.9 -69.0 -46.7 19.8 -28.5 3.3 120 120 A H H X S+ 0 0 74 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.909 108.8 54.6 -57.7 -41.9 22.9 -29.7 5.2 121 121 A D H < S+ 0 0 88 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.871 119.2 32.9 -60.0 -37.9 22.5 -33.2 3.6 122 122 A A H < S+ 0 0 33 -4,-1.4 -2,-0.2 -3,-0.3 -1,-0.2 0.788 134.0 22.5 -85.5 -32.4 22.5 -31.7 0.1 123 123 A Y H < S+ 0 0 24 -4,-2.8 -54,-2.9 -5,-0.1 2,-0.5 0.398 100.6 79.2-128.5 -0.3 24.9 -28.7 0.5 124 124 A R B < S-A 68 0A 125 -4,-2.2 -56,-0.2 -5,-0.3 -57,-0.0 -0.957 75.0-120.2-118.1 131.4 27.2 -29.1 3.5 125 125 A K 0 0 102 -58,-3.1 -58,-0.1 -2,-0.5 -2,-0.1 -0.336 360.0 360.0 -65.7 149.2 30.4 -31.3 3.4 126 126 A K 0 0 226 -5,-0.1 -1,-0.1 -2,-0.0 -5,-0.0 -0.211 360.0 360.0 -84.4 360.0 30.6 -34.2 5.8