==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION REGULATOR / RIBOSOMAL PROT11-AUG-09 3IMQ . COMPND 2 MOLECULE: N UTILIZATION SUBSTANCE PROTEIN B; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI K-12; . AUTHOR X.LUO,M.C.WAHL . 672 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 32179.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 497 74.0 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 . 76 11.3 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 . 38 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 62 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 306 45.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 0.7 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 2 0 3 1 0 3 3 1 1 2 5 3 0 0 3 0 0 0 0 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 . 0 0 1 0 2 2 2 3 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 1 0 0 0 1 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 3 A P >> 0 0 147 0, 0.0 3,-1.0 0, 0.0 4,-1.0 0.000 360.0 360.0 360.0 -94.7 40.1 -8.3 13.0 2 4 A A H 3> + 0 0 72 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.779 360.0 65.7 -56.5 -28.1 38.6 -11.1 10.8 3 5 A A H 3> S+ 0 0 32 1,-0.2 39,-2.4 2,-0.2 4,-1.3 0.804 98.9 50.7 -66.6 -30.6 40.1 -13.5 13.4 4 6 A R H <> S+ 0 0 69 -3,-1.0 4,-1.5 2,-0.2 -1,-0.2 0.785 108.3 51.3 -79.1 -30.9 37.7 -12.1 16.0 5 7 A R H X S+ 0 0 81 -4,-1.0 4,-2.2 2,-0.2 -2,-0.2 0.899 109.0 51.1 -68.9 -44.3 34.7 -12.6 13.7 6 8 A R H X S+ 0 0 65 -4,-2.3 4,-2.4 34,-0.2 -2,-0.2 0.852 106.3 55.8 -61.1 -34.2 35.8 -16.2 13.1 7 9 A A H X S+ 0 0 0 -4,-1.3 4,-2.5 2,-0.2 -1,-0.2 0.894 106.8 49.8 -63.9 -41.2 36.0 -16.6 16.9 8 10 A R H X S+ 0 0 9 -4,-1.5 4,-2.5 2,-0.2 -2,-0.2 0.933 109.8 50.1 -62.7 -46.3 32.4 -15.5 17.2 9 11 A E H X S+ 0 0 44 -4,-2.2 4,-1.7 1,-0.2 -2,-0.2 0.921 113.5 46.3 -58.8 -44.9 31.3 -18.0 14.5 10 12 A C H X S+ 0 0 2 -4,-2.4 4,-2.9 1,-0.2 5,-0.2 0.891 109.8 54.4 -65.9 -37.2 33.1 -20.7 16.3 11 13 A A H X S+ 0 0 0 -4,-2.5 4,-3.1 1,-0.2 5,-0.3 0.889 104.0 55.1 -65.8 -34.9 31.6 -19.6 19.6 12 14 A V H X S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.950 113.0 42.5 -57.8 -47.4 28.2 -19.9 18.1 13 15 A Q H X S+ 0 0 21 -4,-1.7 4,-1.9 2,-0.2 -2,-0.2 0.915 117.1 45.2 -65.0 -46.2 28.9 -23.5 17.2 14 16 A A H X S+ 0 0 0 -4,-2.9 4,-1.9 2,-0.2 -2,-0.2 0.887 112.9 50.5 -69.9 -38.4 30.6 -24.4 20.4 15 17 A L H X S+ 0 0 0 -4,-3.1 4,-2.1 -5,-0.2 -1,-0.2 0.880 107.9 54.7 -65.0 -37.8 27.9 -22.6 22.5 16 18 A Y H X S+ 0 0 0 -4,-2.2 4,-2.0 -5,-0.3 5,-0.3 0.902 107.1 50.3 -57.5 -45.3 25.3 -24.6 20.6 17 19 A S H X>S+ 0 0 5 -4,-1.9 4,-2.8 1,-0.2 5,-0.5 0.909 109.5 51.1 -59.7 -42.5 27.1 -27.8 21.5 18 20 A W H X5S+ 0 0 53 -4,-1.9 4,-1.1 1,-0.2 -1,-0.2 0.874 111.0 48.2 -64.5 -38.0 27.1 -26.8 25.1 19 21 A Q H <5S+ 0 0 28 -4,-2.1 -1,-0.2 2,-0.1 -2,-0.2 0.838 120.6 35.3 -70.8 -35.7 23.3 -26.1 25.0 20 22 A L H <5S+ 0 0 17 -4,-2.0 -2,-0.2 162,-0.2 -3,-0.2 0.899 124.6 36.7 -89.5 -42.8 22.3 -29.3 23.4 21 23 A S H <5S- 0 0 2 -4,-2.8 -3,-0.2 -5,-0.3 -2,-0.1 0.800 84.7-145.8 -78.8 -29.2 24.8 -31.8 24.9 22 24 A Q << + 0 0 171 -4,-1.1 2,-0.2 -5,-0.5 -4,-0.1 0.816 46.0 151.7 55.4 29.5 25.0 -30.4 28.4 23 25 A N - 0 0 25 -6,-0.4 -1,-0.2 1,-0.1 -2,-0.1 -0.547 61.0 -77.4 -72.8 152.5 28.6 -31.4 28.5 24 26 A D >> - 0 0 98 -2,-0.2 4,-2.3 1,-0.1 3,-0.7 -0.296 38.7-127.8 -40.3 129.4 31.0 -29.4 30.6 25 27 A I H 3> S+ 0 0 39 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.865 110.3 56.5 -56.9 -37.1 31.9 -26.1 28.9 26 28 A A H 3> S+ 0 0 51 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.810 108.5 45.5 -64.7 -33.0 35.6 -27.0 29.4 27 29 A D H <> S+ 0 0 89 -3,-0.7 4,-2.3 2,-0.2 5,-0.2 0.856 112.4 51.6 -77.1 -36.6 35.2 -30.3 27.5 28 30 A V H X S+ 0 0 9 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.938 113.0 46.1 -59.2 -46.9 33.2 -28.5 24.8 29 31 A E H X S+ 0 0 33 -4,-2.9 4,-2.3 1,-0.2 5,-0.2 0.920 114.4 46.3 -62.4 -48.7 36.0 -26.0 24.5 30 32 A Y H X S+ 0 0 164 -4,-2.0 4,-2.6 1,-0.2 -1,-0.2 0.912 113.6 47.1 -61.8 -47.9 38.8 -28.5 24.5 31 33 A Q H X S+ 0 0 46 -4,-2.3 4,-2.7 2,-0.2 5,-0.4 0.850 112.6 50.4 -66.7 -35.5 37.2 -30.8 21.9 32 34 A F H X S+ 0 0 10 -4,-2.0 4,-2.3 -5,-0.2 -1,-0.2 0.952 114.0 43.4 -66.2 -50.5 36.3 -28.0 19.6 33 35 A L H < S+ 0 0 42 -4,-2.3 5,-0.3 -5,-0.2 -2,-0.2 0.853 118.1 46.3 -67.3 -34.4 39.8 -26.6 19.6 34 36 A A H < S+ 0 0 63 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.972 123.1 30.5 -69.0 -53.7 41.3 -30.1 19.3 35 37 A E H < S+ 0 0 87 -4,-2.7 -3,-0.2 -5,-0.2 -2,-0.2 0.918 106.1 72.2 -78.5 -46.9 39.1 -31.4 16.5 36 38 A Q S < S- 0 0 74 -4,-2.3 2,-1.0 -5,-0.4 0, 0.0 -0.207 85.5-110.1 -73.1 160.8 38.1 -28.3 14.4 37 39 A D + 0 0 96 1,-0.1 3,-0.2 2,-0.0 -1,-0.1 -0.806 44.0 164.9 -89.8 99.4 40.4 -26.4 12.1 38 40 A V > + 0 0 27 -2,-1.0 3,-2.0 -5,-0.3 5,-0.1 -0.008 24.8 131.1-107.8 29.8 40.8 -23.1 13.9 39 41 A K T 3 S+ 0 0 166 1,-0.3 -1,-0.2 3,-0.1 4,-0.0 0.660 79.6 37.2 -55.7 -22.8 43.8 -21.8 11.9 40 42 A D T 3 S+ 0 0 70 -3,-0.2 2,-0.4 -38,-0.1 -1,-0.3 0.168 95.5 111.5-116.5 14.6 42.3 -18.4 11.3 41 43 A V S < S- 0 0 15 -3,-2.0 2,-1.5 -35,-0.1 -37,-0.2 -0.727 72.4-127.3 -99.2 136.3 40.6 -18.0 14.7 42 44 A D > - 0 0 47 -39,-2.4 4,-1.8 -2,-0.4 5,-0.1 -0.689 36.0-172.7 -73.5 91.5 41.5 -15.5 17.5 43 45 A V H > S+ 0 0 54 -2,-1.5 4,-2.5 1,-0.2 -1,-0.2 0.880 74.5 54.7 -67.4 -42.0 41.7 -18.4 19.9 44 46 A L H > S+ 0 0 110 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.935 111.1 46.5 -55.1 -47.7 42.1 -16.4 23.1 45 47 A Y H > S+ 0 0 2 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.826 108.6 56.0 -66.3 -33.8 38.9 -14.4 22.3 46 48 A F H X S+ 0 0 0 -4,-1.8 4,-2.2 2,-0.2 -1,-0.2 0.947 108.7 47.5 -59.4 -48.6 37.1 -17.6 21.5 47 49 A R H X S+ 0 0 116 -4,-2.5 4,-2.7 1,-0.2 5,-0.3 0.875 111.1 50.9 -62.5 -37.4 38.0 -18.9 24.9 48 50 A E H X S+ 0 0 77 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.833 109.2 50.2 -72.9 -33.2 36.9 -15.7 26.6 49 51 A L H X S+ 0 0 0 -4,-2.1 4,-2.1 2,-0.2 5,-0.3 0.930 113.2 46.7 -65.2 -45.3 33.5 -15.7 24.8 50 52 A L H X S+ 0 0 0 -4,-2.2 4,-2.8 1,-0.2 3,-0.5 0.979 118.6 39.5 -60.7 -58.2 32.9 -19.3 25.9 51 53 A A H X S+ 0 0 46 -4,-2.7 4,-2.1 1,-0.2 -1,-0.2 0.875 115.4 56.1 -53.6 -40.5 33.9 -18.7 29.5 52 54 A G H < S+ 0 0 4 -4,-2.0 -1,-0.2 -5,-0.3 -2,-0.2 0.800 115.2 34.3 -70.3 -30.8 32.1 -15.4 29.3 53 55 A V H < S+ 0 0 0 -4,-2.1 3,-0.4 -3,-0.5 4,-0.3 0.843 116.1 55.5 -89.7 -37.8 28.8 -16.7 28.3 54 56 A A H < S+ 0 0 18 -4,-2.8 3,-0.4 -5,-0.3 -2,-0.2 0.839 112.8 39.6 -66.1 -37.2 29.0 -20.0 30.2 55 57 A T S < S+ 0 0 107 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.1 0.564 124.8 38.6 -89.1 -10.1 29.6 -18.4 33.6 56 58 A N S > S+ 0 0 53 -3,-0.4 4,-2.9 -4,-0.2 3,-0.3 0.087 73.5 125.1-126.4 24.1 27.1 -15.5 33.1 57 59 A T H > S+ 0 0 24 -3,-0.4 4,-2.8 -4,-0.3 5,-0.2 0.906 76.4 44.8 -55.5 -53.4 24.3 -17.2 31.3 58 60 A A H > S+ 0 0 86 1,-0.2 4,-1.2 2,-0.2 -1,-0.3 0.805 114.6 50.2 -63.0 -33.1 21.5 -16.2 33.6 59 61 A Y H > S+ 0 0 117 -3,-0.3 4,-1.0 2,-0.2 -1,-0.2 0.931 112.3 46.3 -70.6 -45.4 22.8 -12.6 33.9 60 62 A L H >< S+ 0 0 0 -4,-2.9 3,-1.1 1,-0.2 4,-0.4 0.943 111.9 50.3 -60.5 -49.0 23.0 -12.3 30.1 61 63 A D H >X S+ 0 0 8 -4,-2.8 4,-2.6 1,-0.3 3,-1.3 0.828 104.1 61.7 -58.8 -31.0 19.6 -13.7 29.5 62 64 A G H 3< S+ 0 0 38 -4,-1.2 -1,-0.3 1,-0.3 -2,-0.2 0.799 98.3 54.7 -65.8 -30.2 18.3 -11.3 32.1 63 65 A L T << S+ 0 0 38 -3,-1.1 -1,-0.3 -4,-1.0 -2,-0.2 0.603 117.7 39.0 -72.6 -10.6 19.4 -8.4 30.0 64 66 A M T X4 S+ 0 0 0 -3,-1.3 3,-2.4 -4,-0.4 4,-0.5 0.800 91.9 80.3-110.0 -43.3 17.2 -9.9 27.2 65 67 A K G >< S+ 0 0 118 -4,-2.6 3,-1.0 1,-0.3 -3,-0.1 0.742 86.6 59.2 -47.5 -43.2 14.0 -11.4 28.8 66 68 A P G 3 S+ 0 0 88 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.733 108.3 48.9 -59.6 -19.8 12.0 -8.1 29.0 67 69 A Y G < S+ 0 0 71 -3,-2.4 2,-0.3 57,-0.0 -2,-0.2 0.489 88.8 90.4-105.3 -6.1 12.4 -7.7 25.3 68 70 A L < - 0 0 17 -3,-1.0 4,-0.1 -4,-0.5 7,-0.0 -0.649 68.2-144.1 -84.6 144.5 11.3 -11.1 24.1 69 71 A S S S+ 0 0 100 -2,-0.3 2,-0.2 2,-0.1 -1,-0.1 0.472 84.6 37.0 -83.0 2.7 7.6 -11.5 23.3 70 72 A R S S- 0 0 156 -5,-0.1 -2,-0.2 1,-0.1 2,-0.1 -0.778 100.8 -66.3-142.4 173.7 8.0 -15.1 24.7 71 73 A L > - 0 0 117 -2,-0.2 3,-1.6 1,-0.1 4,-0.3 -0.366 45.7-118.0 -64.5 150.4 9.7 -17.3 27.3 72 74 A L G > S+ 0 0 16 1,-0.3 3,-1.8 2,-0.2 -1,-0.1 0.890 113.3 59.7 -55.6 -43.5 13.5 -17.7 26.9 73 75 A E G 3 S+ 0 0 136 1,-0.3 -1,-0.3 7,-0.0 4,-0.1 0.456 94.5 64.7 -72.7 0.2 13.1 -21.4 26.4 74 76 A E G < S+ 0 0 106 -3,-1.6 -1,-0.3 2,-0.1 2,-0.2 0.479 81.9 102.7 -94.5 -6.5 10.9 -20.8 23.2 75 77 A L S < S- 0 0 16 -3,-1.8 5,-0.0 -4,-0.3 -3,-0.0 -0.523 84.9-101.7 -76.2 143.0 13.9 -19.2 21.5 76 78 A G > - 0 0 5 -2,-0.2 4,-2.1 1,-0.1 5,-0.1 -0.300 30.4-120.0 -55.8 146.5 15.8 -21.1 18.8 77 79 A Q H > S+ 0 0 45 81,-0.2 4,-1.9 2,-0.2 5,-0.1 0.913 113.1 46.4 -59.5 -46.7 19.0 -22.5 20.1 78 80 A V H > S+ 0 0 7 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.908 110.4 53.8 -63.1 -45.8 21.2 -20.7 17.6 79 81 A E H > S+ 0 0 26 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.884 107.9 51.8 -50.1 -44.3 19.3 -17.4 18.3 80 82 A K H X S+ 0 0 28 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.934 110.7 46.4 -63.3 -47.7 20.0 -17.9 22.0 81 83 A A H X S+ 0 0 0 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.906 112.4 49.5 -59.0 -47.7 23.8 -18.3 21.5 82 84 A V H X S+ 0 0 1 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.947 114.2 45.9 -58.9 -49.3 24.1 -15.3 19.0 83 85 A L H X S+ 0 0 0 -4,-2.2 4,-3.0 1,-0.2 5,-0.3 0.899 111.0 51.8 -63.8 -41.8 22.2 -13.1 21.5 84 86 A R H X S+ 0 0 15 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.920 110.4 49.6 -60.3 -44.4 24.3 -14.3 24.5 85 87 A I H X S+ 0 0 3 -4,-2.6 4,-2.1 2,-0.2 -2,-0.2 0.915 113.5 45.7 -57.5 -45.5 27.4 -13.5 22.5 86 88 A A H X S+ 0 0 1 -4,-2.3 4,-2.9 2,-0.2 -2,-0.2 0.937 113.8 47.4 -65.7 -48.1 26.2 -10.0 21.6 87 89 A L H X S+ 0 0 0 -4,-3.0 4,-2.4 1,-0.2 5,-0.3 0.857 109.5 54.0 -65.5 -38.3 25.0 -9.2 25.2 88 90 A Y H X S+ 0 0 27 -4,-2.6 4,-3.1 -5,-0.3 5,-0.4 0.953 111.7 45.7 -57.2 -49.2 28.2 -10.4 26.7 89 91 A E H X S+ 0 0 1 -4,-2.1 4,-2.1 1,-0.2 7,-0.2 0.946 113.0 49.7 -60.4 -46.1 30.1 -8.1 24.3 90 92 A L H < S+ 0 0 3 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.864 123.1 30.9 -61.0 -38.5 27.8 -5.1 25.1 91 93 A S H < S+ 0 0 32 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.779 133.5 25.1 -92.8 -29.0 28.0 -5.6 28.8 92 94 A K H < S+ 0 0 96 -4,-3.1 2,-0.5 -5,-0.3 -3,-0.2 0.495 106.4 69.6-116.9 -7.3 31.5 -7.0 29.3 93 95 A R >< + 0 0 33 -4,-2.1 3,-1.3 -5,-0.4 -1,-0.2 -0.802 38.2 168.1-125.8 92.3 33.7 -5.9 26.4 94 96 A S T 3 S+ 0 0 121 -2,-0.5 -1,-0.1 1,-0.3 4,-0.1 0.683 79.3 68.4 -74.4 -17.1 34.6 -2.2 26.1 95 97 A D T 3 S+ 0 0 78 2,-0.1 -1,-0.3 -6,-0.1 -6,-0.0 0.436 90.2 75.1 -80.8 -0.4 37.1 -3.1 23.4 96 98 A V S < S- 0 0 3 -3,-1.3 -3,-0.1 -7,-0.2 2,-0.1 -0.970 86.5-129.6-111.0 121.8 34.2 -4.0 21.2 97 99 A P > - 0 0 67 0, 0.0 4,-2.2 0, 0.0 3,-0.3 -0.397 19.7-114.8 -69.7 148.8 32.3 -1.0 19.8 98 100 A Y H > S+ 0 0 23 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.885 115.9 47.5 -42.2 -55.8 28.5 -0.8 20.1 99 101 A K H > S+ 0 0 168 1,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.861 108.8 55.2 -61.0 -39.8 27.9 -1.1 16.3 100 102 A V H > S+ 0 0 52 -3,-0.3 4,-2.8 2,-0.2 5,-0.3 0.920 106.6 50.1 -61.1 -45.9 30.3 -4.0 16.0 101 103 A A H X S+ 0 0 0 -4,-2.2 4,-1.6 2,-0.2 -1,-0.2 0.936 115.6 42.4 -60.2 -46.4 28.5 -6.1 18.6 102 104 A I H X S+ 0 0 17 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.959 117.0 45.7 -67.2 -49.3 25.1 -5.5 16.9 103 105 A N H X S+ 0 0 78 -4,-2.9 4,-2.1 1,-0.2 -2,-0.2 0.866 110.9 52.4 -62.6 -40.2 26.3 -6.0 13.3 104 106 A E H X S+ 0 0 21 -4,-2.8 4,-2.1 -5,-0.2 -1,-0.2 0.851 109.7 50.9 -63.9 -35.5 28.3 -9.1 14.2 105 107 A A H X S+ 0 0 4 -4,-1.6 4,-2.7 -5,-0.3 -2,-0.2 0.940 108.2 51.8 -65.4 -47.9 25.2 -10.6 15.8 106 108 A I H X S+ 0 0 24 -4,-2.5 4,-1.4 1,-0.2 -2,-0.2 0.896 111.5 47.2 -53.3 -42.6 23.2 -9.8 12.7 107 109 A E H X S+ 0 0 71 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.870 111.3 50.1 -73.7 -36.4 25.7 -11.6 10.5 108 110 A L H X S+ 0 0 5 -4,-2.1 4,-2.5 2,-0.2 5,-0.3 0.909 107.8 53.3 -64.3 -40.2 25.9 -14.6 12.7 109 111 A A H X S+ 0 0 2 -4,-2.7 4,-1.3 1,-0.2 -2,-0.2 0.843 109.9 51.1 -65.9 -29.3 22.0 -14.8 12.7 110 112 A K H < S+ 0 0 94 -4,-1.4 -2,-0.2 -5,-0.2 -1,-0.2 0.934 114.6 39.8 -68.9 -50.4 22.2 -14.8 8.9 111 113 A S H < S+ 0 0 39 -4,-2.2 76,-1.7 1,-0.2 -2,-0.2 0.969 130.0 27.0 -65.2 -51.0 24.8 -17.6 8.6 112 114 A F H < S+ 0 0 8 -4,-2.5 -1,-0.2 74,-0.2 -3,-0.2 0.512 116.6 52.5 -96.2 -7.3 23.5 -19.9 11.3 113 115 A G S < S- 0 0 12 -4,-1.3 74,-0.1 -5,-0.3 78,-0.0 -0.481 85.0 -66.4-122.4-169.9 19.8 -19.1 11.5 114 116 A A >> - 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