==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JUN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 03-DEC-05 2C8F . COMPND 2 MOLECULE: MONO-ADP-RIBOSYLTRANSFERASE C3; . SOURCE 2 ORGANISM_SCIENTIFIC: CLOSTRIDIUM BOTULINUM; . AUTHOR E.A.STURA,J.MENETREY,G.FLATAU,P.BOQUET,A.MENEZ . 604 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 29758.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 429 71.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 27 4.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 108 17.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.5 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 . 46 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 64 10.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 161 26.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.5 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 1 0 0 0 0 0 2 3 3 5 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 0 0 0 0 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 PARALLEL BRIDGES PER LADDER . 9 3 0 6 0 0 6 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 3 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 45 E T 0 0 176 0, 0.0 2,-0.5 0, 0.0 78,-0.2 0.000 360.0 360.0 360.0-167.9 14.6 1.5 68.9 2 46 E Y - 0 0 60 76,-0.1 2,-0.5 149,-0.0 78,-0.2 -0.893 360.0-114.2-109.3 122.6 17.7 2.4 71.1 3 47 E Q B -a 80 0A 69 76,-1.7 78,-2.1 -2,-0.5 2,-0.6 -0.352 32.4-170.6 -52.2 103.9 17.7 5.0 73.8 4 48 E E - 0 0 76 -2,-0.5 2,-0.2 76,-0.2 130,-0.1 -0.932 19.6-137.0 -91.8 116.5 20.1 7.8 72.5 5 49 E F + 0 0 2 128,-0.6 3,-0.1 -2,-0.6 202,-0.0 -0.589 30.8 169.8 -76.4 143.2 20.6 10.2 75.4 6 50 E T + 0 0 33 -2,-0.2 202,-2.4 1,-0.2 2,-0.5 0.353 58.0 69.2-133.5 -9.2 20.5 13.9 74.5 7 51 E N > - 0 0 12 200,-0.2 4,-1.8 1,-0.1 3,-0.3 -0.981 67.2-147.6-124.7 121.2 20.5 15.5 77.9 8 52 E I H > S+ 0 0 70 -2,-0.5 4,-2.2 1,-0.2 5,-0.1 0.809 96.8 52.0 -55.8 -34.1 23.6 15.4 80.1 9 53 E D H > S+ 0 0 75 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.837 109.0 45.4 -76.7 -41.0 21.5 15.4 83.3 10 54 E Q H > S+ 0 0 67 -3,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.812 114.2 53.8 -69.2 -29.1 19.2 12.5 82.6 11 55 E A H X S+ 0 0 0 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.969 110.9 42.3 -68.8 -54.5 22.3 10.6 81.3 12 56 E K H X S+ 0 0 34 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.853 115.8 51.0 -60.4 -36.6 24.3 11.1 84.6 13 57 E A H X S+ 0 0 60 -4,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.886 110.4 49.0 -68.3 -36.6 21.1 10.4 86.6 14 58 E W H X S+ 0 0 41 -4,-1.9 4,-1.6 2,-0.2 -2,-0.2 0.870 111.0 49.2 -74.1 -36.4 20.5 7.1 84.7 15 59 E G H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.949 111.0 51.4 -59.0 -50.6 24.1 6.0 85.1 16 60 E N H X S+ 0 0 73 -4,-2.2 4,-1.3 1,-0.2 -2,-0.2 0.899 106.4 52.5 -55.7 -45.0 23.9 6.7 88.8 17 61 E A H < S+ 0 0 56 -4,-2.3 4,-0.4 1,-0.2 3,-0.3 0.913 113.9 45.2 -58.8 -40.1 20.7 4.7 89.1 18 62 E Q H >< S+ 0 0 19 -4,-1.6 3,-1.0 1,-0.2 4,-0.3 0.901 108.9 55.1 -69.3 -39.9 22.5 1.8 87.5 19 63 E Y H >< S+ 0 0 37 -4,-2.7 3,-0.6 1,-0.2 4,-0.4 0.707 99.4 60.5 -68.9 -24.2 25.8 2.1 89.5 20 64 E K T 3< S+ 0 0 132 -4,-1.3 -1,-0.2 -3,-0.3 -2,-0.1 0.645 104.5 48.9 -82.4 -17.3 24.1 1.8 92.9 21 65 E K T < S+ 0 0 149 -3,-1.0 -1,-0.2 -4,-0.4 -2,-0.2 0.436 85.8 88.6 -99.8 -3.4 22.7 -1.6 92.2 22 66 E Y < - 0 0 20 -3,-0.6 -2,-0.1 -4,-0.3 -1,-0.1 0.953 69.3-158.7 -62.4 -46.7 25.9 -3.2 91.0 23 67 E G - 0 0 60 -4,-0.4 -3,-0.1 1,-0.1 -1,-0.1 0.854 22.5-174.5 64.5 39.9 27.1 -4.3 94.4 24 68 E L - 0 0 15 1,-0.1 -1,-0.1 49,-0.1 2,-0.1 -0.310 23.0-117.1 -68.6 146.5 30.7 -4.5 93.3 25 69 E S > - 0 0 40 1,-0.1 4,-1.3 -2,-0.0 -1,-0.1 -0.371 26.5-113.1 -72.2 161.9 33.6 -5.8 95.5 26 70 E K H > S+ 0 0 70 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.746 117.3 53.2 -71.1 -27.5 36.5 -3.4 96.4 27 71 E S H > S+ 0 0 48 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.879 107.6 50.4 -76.8 -37.2 39.0 -5.4 94.3 28 72 E E H > S+ 0 0 5 2,-0.2 4,-1.2 1,-0.2 -2,-0.2 0.828 111.7 50.9 -61.4 -34.5 36.7 -5.1 91.2 29 73 E K H X S+ 0 0 81 -4,-1.3 4,-2.2 2,-0.2 3,-0.2 0.912 109.3 48.1 -66.9 -46.4 36.6 -1.4 92.0 30 74 E E H X S+ 0 0 147 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.893 109.3 55.5 -60.7 -40.3 40.4 -1.1 92.2 31 75 E A H X S+ 0 0 7 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.815 109.3 46.1 -64.5 -33.6 40.7 -3.0 89.0 32 76 E I H X S+ 0 0 1 -4,-1.2 4,-2.3 -3,-0.2 5,-0.3 0.955 108.0 51.8 -75.3 -55.5 38.5 -0.5 87.1 33 77 E V H X S+ 0 0 47 -4,-2.2 4,-0.7 1,-0.2 131,-0.3 0.915 113.6 50.2 -48.7 -44.1 40.0 2.7 88.3 34 78 E S H >X S+ 0 0 49 -4,-2.0 3,-2.2 -5,-0.2 4,-1.7 0.985 105.8 54.8 -47.2 -66.3 43.3 1.0 87.1 35 79 E Y H 3< S+ 0 0 0 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.828 106.7 50.9 -40.1 -44.4 41.8 0.2 83.7 36 80 E T H 3< S+ 0 0 31 -4,-2.3 -1,-0.3 126,-0.2 3,-0.2 0.678 107.2 55.0 -76.1 -16.9 40.8 3.8 83.0 37 81 E K H << S+ 0 0 160 -3,-2.2 -2,-0.2 -4,-0.7 -1,-0.2 0.859 126.8 16.7 -77.3 -42.1 44.4 5.0 83.9 38 82 E S S X S+ 0 0 54 -4,-1.7 4,-1.7 1,-0.1 5,-0.2 -0.299 79.6 141.5-127.9 50.4 46.2 2.7 81.4 39 83 E A H > S+ 0 0 23 -3,-0.2 4,-1.9 1,-0.2 5,-0.2 0.896 71.2 49.7 -60.9 -47.0 43.4 1.6 79.0 40 84 E S H > S+ 0 0 97 2,-0.2 4,-4.3 1,-0.2 5,-0.2 0.912 107.8 52.5 -65.8 -45.0 45.3 1.7 75.7 41 85 E E H > S+ 0 0 62 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.942 112.0 47.5 -49.3 -51.0 48.3 -0.3 77.0 42 86 E I H X S+ 0 0 10 -4,-1.7 4,-2.2 2,-0.2 -1,-0.2 0.843 121.4 34.7 -66.0 -37.4 46.0 -3.1 78.2 43 87 E N H X S+ 0 0 15 -4,-1.9 4,-2.9 2,-0.2 5,-0.2 0.944 114.9 57.8 -79.6 -51.6 44.0 -3.2 75.0 44 88 E G H X S+ 0 0 35 -4,-4.3 4,-1.2 -5,-0.2 -2,-0.2 0.821 114.5 40.6 -37.0 -41.9 47.2 -2.4 73.0 45 89 E K H X S+ 0 0 68 -4,-2.5 4,-1.6 -5,-0.2 -1,-0.2 0.927 111.4 52.4 -80.0 -52.4 48.6 -5.6 74.7 46 90 E L H <>S+ 0 0 0 -4,-2.2 5,-2.1 1,-0.2 -2,-0.2 0.787 106.6 57.2 -57.4 -27.4 45.5 -7.8 74.4 47 91 E R H ><5S+ 0 0 120 -4,-2.9 3,-2.5 1,-0.2 -1,-0.2 0.994 105.2 47.9 -65.5 -60.4 45.3 -7.0 70.7 48 92 E Q H 3<5S+ 0 0 161 -4,-1.2 -2,-0.2 1,-0.3 -1,-0.2 0.783 115.4 47.7 -50.8 -28.2 48.9 -8.3 70.0 49 93 E N T ><5S- 0 0 68 -4,-1.6 3,-1.8 2,-0.0 -1,-0.3 0.251 106.0-126.6-100.1 16.3 48.1 -11.5 72.0 50 94 E K T < 5 - 0 0 47 -3,-2.5 -3,-0.2 1,-0.3 -2,-0.1 0.866 65.6 -61.9 35.8 51.4 44.7 -12.2 70.3 51 95 E G T 3 + 0 0 21 -2,-0.3 3,-0.7 1,-0.1 -1,-0.1 0.764 44.5 104.9-109.9 -36.2 45.7 -14.5 78.8 54 98 E N T 3 S+ 0 0 150 1,-0.3 2,-0.2 7,-0.0 -1,-0.1 0.594 86.8 46.5 -28.0 -35.4 47.2 -17.7 80.4 55 99 E G T 3 S+ 0 0 72 -3,-0.1 -1,-0.3 6,-0.0 3,-0.1 -0.415 83.9 109.8-115.1 60.1 50.7 -16.2 80.1 56 100 E F S < S- 0 0 20 -3,-0.7 5,-0.1 -2,-0.2 -3,-0.0 -0.765 76.0 -72.7-113.7 165.3 50.8 -12.6 81.4 57 101 E P > - 0 0 87 0, 0.0 4,-1.9 0, 0.0 3,-0.4 -0.157 47.8-114.9 -39.7 146.9 52.3 -10.8 84.5 58 102 E S H > S+ 0 0 108 1,-0.2 4,-2.0 2,-0.2 5,-0.3 0.884 113.3 61.4 -65.2 -39.4 50.3 -11.6 87.8 59 103 E N H > S+ 0 0 84 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.864 110.9 40.3 -49.2 -43.0 49.2 -8.0 88.2 60 104 E L H > S+ 0 0 20 -3,-0.4 4,-3.4 2,-0.2 5,-0.3 0.841 110.2 54.1 -80.4 -39.7 47.3 -8.2 84.8 61 105 E I H X S+ 0 0 39 -4,-1.9 4,-1.4 1,-0.2 -2,-0.2 0.870 114.0 44.3 -65.6 -33.9 45.8 -11.7 85.0 62 106 E K H X S+ 0 0 125 -4,-2.0 4,-1.3 -5,-0.2 -1,-0.2 0.873 117.8 47.0 -75.0 -35.4 44.3 -10.8 88.4 63 107 E Q H X S+ 0 0 26 -4,-1.1 4,-2.1 -5,-0.3 -2,-0.2 0.938 114.2 43.1 -67.9 -55.6 43.2 -7.4 86.8 64 108 E V H X S+ 0 0 0 -4,-3.4 4,-2.1 2,-0.2 -3,-0.2 0.813 112.9 53.8 -58.9 -38.4 41.7 -8.8 83.5 65 109 E E H X S+ 0 0 127 -4,-1.4 4,-1.5 -5,-0.3 -1,-0.2 0.882 111.0 46.6 -67.2 -39.0 39.9 -11.7 85.4 66 110 E L H X S+ 0 0 22 -4,-1.3 4,-2.1 2,-0.2 -2,-0.2 0.860 109.2 53.6 -67.8 -41.4 38.3 -9.2 87.7 67 111 E L H X S+ 0 0 0 -4,-2.1 4,-0.9 2,-0.2 -2,-0.2 0.939 111.5 45.9 -59.8 -44.1 37.3 -6.9 84.9 68 112 E D H < S+ 0 0 43 -4,-2.1 3,-0.2 1,-0.2 -2,-0.2 0.853 112.0 52.1 -66.7 -33.5 35.6 -9.8 83.2 69 113 E K H >< S+ 0 0 133 -4,-1.5 3,-1.9 1,-0.2 4,-0.4 0.818 98.1 65.8 -72.2 -32.6 33.9 -10.8 86.5 70 114 E S H >< S+ 0 0 0 -4,-2.1 3,-2.1 1,-0.3 4,-0.5 0.876 89.3 68.1 -55.6 -38.8 32.5 -7.3 87.0 71 115 E F T 3< S+ 0 0 1 -4,-0.9 -1,-0.3 1,-0.3 -2,-0.2 0.524 83.7 69.7 -68.9 -5.4 30.3 -7.8 84.0 72 116 E N T < S+ 0 0 103 -3,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.764 109.4 36.3 -73.7 -27.9 28.2 -10.4 85.9 73 117 E K S < S+ 0 0 88 -3,-2.1 2,-0.6 -4,-0.4 -2,-0.2 0.423 108.9 74.8 -98.2 -2.6 26.9 -7.5 88.0 74 118 E M + 0 0 1 -4,-0.5 82,-1.4 83,-0.1 2,-0.3 -0.878 54.8 143.2-121.4 99.8 26.8 -4.9 85.2 75 119 E K B -I 155 0B 96 -2,-0.6 80,-0.2 80,-0.2 79,-0.1 -0.986 45.9-121.0-135.6 143.2 24.0 -5.2 82.6 76 120 E T - 0 0 4 78,-1.8 77,-2.6 -2,-0.3 81,-0.1 -0.653 12.0-148.8 -81.8 135.3 22.0 -2.5 80.8 77 121 E P S S+ 0 0 65 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.454 76.7 28.0 -81.7 2.3 18.2 -2.7 81.4 78 122 E E S S- 0 0 62 73,-0.1 75,-0.1 76,-0.1 72,-0.1 -0.993 94.4 -79.7-155.0 155.9 17.4 -1.4 77.9 79 123 E N - 0 0 53 -2,-0.3 -76,-1.7 -78,-0.2 2,-0.3 -0.316 59.9-177.4 -44.5 127.9 18.6 -1.0 74.3 80 124 E I E -aB 3 150A 0 70,-2.2 70,-2.9 -78,-0.2 2,-0.5 -0.993 29.8-134.3-147.6 149.4 21.1 1.8 74.3 81 125 E M E - B 0 149A 15 -78,-2.1 -76,-0.4 -2,-0.3 2,-0.3 -0.884 24.9-175.3-102.6 125.2 23.3 3.9 72.0 82 126 E L E - B 0 148A 0 66,-2.1 66,-3.1 -2,-0.5 2,-0.3 -0.910 10.7-144.4-120.7 155.9 26.9 4.5 73.1 83 127 E F E +CB 132 147A 11 49,-2.4 49,-1.6 -2,-0.3 2,-0.3 -0.764 15.2 179.6-122.1 161.7 29.5 6.6 71.4 84 128 E R E - B 0 146A 61 62,-1.3 62,-2.0 -2,-0.3 2,-0.3 -0.913 18.9-142.9-164.4 129.7 33.2 6.6 70.7 85 129 E G E - B 0 145A 2 -2,-0.3 2,-0.3 60,-0.2 60,-0.2 -0.693 24.7-177.7 -88.0 150.0 35.9 8.7 69.0 86 130 E D E - B 0 144A 13 58,-1.5 58,-1.6 -2,-0.3 -2,-0.0 -0.986 20.5-129.2-144.4 148.5 38.8 7.0 67.2 87 131 E D > - 0 0 85 -2,-0.3 3,-1.7 56,-0.2 4,-0.2 -0.455 42.0 -91.6 -89.4 170.9 42.0 8.1 65.3 88 132 E P G > S+ 0 0 19 0, 0.0 3,-3.0 0, 0.0 4,-0.5 0.844 117.1 70.5 -52.4 -41.8 42.9 6.8 61.7 89 133 E A G > S+ 0 0 51 1,-0.3 3,-1.3 7,-0.2 7,-0.1 0.745 82.6 77.3 -50.4 -26.6 45.1 3.9 62.8 90 134 E Y G < S+ 0 0 27 -3,-1.7 -1,-0.3 1,-0.3 3,-0.1 0.815 94.6 47.9 -52.1 -32.8 41.8 2.3 63.9 91 135 E L G < S- 0 0 3 -3,-3.0 -1,-0.3 1,-0.3 -2,-0.2 0.617 128.4 -73.3 -86.5 -13.0 41.1 1.5 60.2 92 136 E G X> - 0 0 19 -3,-1.3 3,-1.9 -4,-0.5 4,-0.8 -0.533 46.6 -78.7 132.1 161.1 44.5 0.0 59.4 93 137 E T T 34 S+ 0 0 126 1,-0.3 4,-0.5 2,-0.2 3,-0.2 0.741 124.2 60.6 -64.3 -27.5 48.2 1.0 58.9 94 138 E E T 34 S+ 0 0 91 1,-0.2 -1,-0.3 2,-0.1 -5,-0.1 0.484 107.0 45.8 -77.7 -8.1 47.4 2.1 55.3 95 139 E F T X> S+ 0 0 8 -3,-1.9 4,-1.5 -7,-0.1 3,-0.7 0.530 87.0 91.5-106.3 -13.5 44.9 4.7 56.6 96 140 E Q T 3< S+ 0 0 99 -4,-0.8 -7,-0.2 1,-0.2 4,-0.2 0.896 106.3 15.2 -50.8 -53.1 47.1 6.1 59.4 97 141 E N T 34 S+ 0 0 151 -4,-0.5 -1,-0.2 1,-0.1 -2,-0.1 0.190 127.1 55.8-111.8 22.0 48.7 8.9 57.3 98 142 E T T <4 S+ 0 0 70 -3,-0.7 12,-0.3 12,-0.0 -2,-0.2 0.529 83.2 79.8-119.7 -11.9 46.3 8.9 54.3 99 143 E L S < S+ 0 0 1 -4,-1.5 8,-2.0 11,-0.1 2,-0.6 0.773 85.1 62.1 -77.4 -29.5 42.9 9.5 55.9 100 144 E L B S-J 106 0C 77 6,-0.2 6,-0.2 -5,-0.2 -1,-0.1 -0.887 73.5-139.6-106.9 121.3 43.1 13.2 56.4 101 145 E N > - 0 0 59 4,-3.1 3,-1.5 -2,-0.6 6,-0.1 -0.341 36.6-107.1 -56.0 153.4 43.5 15.8 53.6 102 146 E S T 3 S+ 0 0 136 1,-0.3 -1,-0.1 2,-0.1 4,-0.0 0.866 118.0 65.7 -62.0 -32.9 45.9 18.6 54.6 103 147 E N T 3 S- 0 0 110 1,-0.1 -1,-0.3 2,-0.1 3,-0.1 0.151 123.3-101.0 -72.9 18.5 42.9 21.0 55.1 104 148 E G S < S+ 0 0 32 -3,-1.5 2,-0.2 1,-0.3 -2,-0.1 0.327 89.1 108.2 84.0 -8.3 41.7 18.9 58.0 105 149 E T S S- 0 0 37 1,-0.1 -4,-3.1 -5,-0.1 -1,-0.3 -0.476 76.7 -82.0 -99.6 174.8 38.9 17.0 56.1 106 150 E I B -J 100 0C 7 84,-1.8 2,-0.4 -6,-0.2 -6,-0.2 -0.502 40.4-116.3 -78.4 136.2 38.7 13.5 54.9 107 151 E N > - 0 0 45 -8,-2.0 4,-2.4 -2,-0.2 5,-0.2 -0.603 18.7-142.7 -73.0 129.2 40.3 12.3 51.7 108 152 E K H > S+ 0 0 139 -2,-0.4 4,-1.5 1,-0.2 -1,-0.1 0.835 99.8 44.1 -68.1 -37.9 37.6 11.2 49.3 109 153 E T H > S+ 0 0 88 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.954 112.4 51.9 -66.7 -50.8 39.7 8.3 47.9 110 154 E A H > S+ 0 0 10 -12,-0.3 4,-1.8 1,-0.2 -2,-0.2 0.862 110.7 49.7 -55.1 -38.7 40.9 7.2 51.4 111 155 E F H X S+ 0 0 5 -4,-2.4 4,-3.2 2,-0.2 -1,-0.2 0.898 107.7 52.4 -69.1 -42.7 37.3 7.1 52.6 112 156 E E H X S+ 0 0 81 -4,-1.5 4,-2.4 2,-0.2 -2,-0.2 0.923 110.3 48.1 -57.1 -51.1 36.0 5.1 49.6 113 157 E K H X S+ 0 0 141 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.889 113.9 47.1 -55.9 -43.1 38.6 2.4 50.1 114 158 E A H X S+ 0 0 0 -4,-1.8 4,-1.9 -5,-0.2 5,-0.4 0.932 109.9 53.3 -66.1 -51.1 37.7 2.3 53.9 115 159 E K H X S+ 0 0 66 -4,-3.2 4,-2.4 1,-0.2 -2,-0.2 0.887 112.4 45.3 -39.5 -50.4 34.0 2.1 53.0 116 160 E A H < S+ 0 0 75 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.920 112.1 50.6 -68.5 -43.6 34.8 -0.9 50.8 117 161 E K H < S+ 0 0 83 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.828 128.4 18.3 -62.9 -31.6 37.0 -2.6 53.3 118 162 E F H >< S+ 0 0 26 -4,-1.9 3,-2.0 -5,-0.1 63,-0.3 0.686 85.2 115.7-122.1 -28.2 34.6 -2.4 56.2 119 163 E L T 3< S+ 0 0 58 -4,-2.4 63,-0.2 -5,-0.4 3,-0.1 -0.295 95.5 1.7 -55.0 130.2 31.0 -1.7 55.0 120 164 E N T 3 S+ 0 0 110 61,-2.0 2,-0.3 1,-0.2 -1,-0.3 0.640 107.3 120.7 60.8 23.8 28.7 -4.6 55.9 121 165 E K < - 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