==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/HYDROLASE INHIBITOR 08-OCT-11 3U4I . COMPND 2 MOLECULE: ADP-RIBOSYL CYCLASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR Q.LIU,Q.HAO,H.C.LEE,R.GRAEFF . 487 4 11 11 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25711.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 333 68.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 50 10.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 10 2.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 1 0.2 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 . 37 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 63 12.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 150 30.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 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 3 0 4 0 2 1 0 2 3 0 0 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 0 2 0 0 2 2 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 . 2 2 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 . 2 0 2 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 45 A R 0 0 216 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -54.4 22.4 -21.4 13.8 2 46 A W + 0 0 183 1,-0.2 2,-0.3 2,-0.0 0, 0.0 0.370 360.0 41.4-103.7 -2.9 23.2 -18.9 16.5 3 47 A R S S- 0 0 168 0, 0.0 2,-0.2 0, 0.0 -1,-0.2 -0.991 80.2-141.6-139.8 145.5 23.6 -16.3 13.8 4 48 A Q - 0 0 82 -2,-0.3 -2,-0.0 2,-0.1 124,-0.0 -0.663 18.0-122.5-109.6 164.8 21.4 -15.7 10.7 5 49 A T S S+ 0 0 107 -2,-0.2 2,-0.2 123,-0.1 -1,-0.1 0.899 93.0 35.0 -70.4 -44.7 22.2 -14.7 7.1 6 50 A W S S- 0 0 55 2,-0.2 -2,-0.1 124,-0.1 4,-0.1 -0.632 75.0-127.4-110.3 168.0 20.1 -11.6 6.9 7 51 A S S S+ 0 0 69 -2,-0.2 -1,-0.1 121,-0.1 -2,-0.0 0.621 81.9 78.6 -91.8 -15.4 19.2 -8.9 9.4 8 52 A G E S-A 129 0A 10 121,-1.6 121,-1.5 1,-0.1 -2,-0.2 -0.537 91.6 -83.8 -96.4 162.1 15.4 -9.1 9.0 9 53 A P E -A 128 0A 103 0, 0.0 119,-0.2 0, 0.0 -1,-0.1 -0.219 52.3-106.4 -60.2 150.1 12.8 -11.5 10.4 10 54 A G - 0 0 18 117,-0.6 116,-0.2 116,-0.3 119,-0.2 -0.032 51.2 -61.4 -73.6 179.1 12.2 -14.7 8.5 11 55 A T - 0 0 7 114,-2.0 104,-0.2 117,-0.2 -1,-0.2 -0.275 65.7 -93.5 -62.6 145.5 9.2 -15.6 6.3 12 56 A T > - 0 0 45 102,-2.4 3,-1.2 1,-0.1 -1,-0.1 -0.342 51.1 -98.7 -62.4 137.7 5.9 -15.8 8.1 13 57 A K T 3 S+ 0 0 174 1,-0.3 -1,-0.1 2,-0.1 5,-0.1 -0.239 106.4 13.1 -59.7 144.7 5.2 -19.4 9.2 14 58 A R T 3> S+ 0 0 163 -3,-0.1 4,-2.8 3,-0.1 -1,-0.3 0.808 79.9 162.2 60.1 31.0 2.8 -21.3 7.0 15 59 A F H <> + 0 0 0 -3,-1.2 4,-2.4 1,-0.2 5,-0.3 0.895 68.6 49.1 -48.5 -51.7 3.3 -18.7 4.3 16 60 A P H > S+ 0 0 30 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.934 114.7 43.9 -54.7 -51.6 2.0 -20.9 1.4 17 61 A E H > S+ 0 0 104 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.888 113.3 52.6 -63.1 -40.2 -1.1 -22.0 3.3 18 62 A T H X S+ 0 0 39 -4,-2.8 4,-2.2 2,-0.2 -1,-0.2 0.909 109.9 45.5 -63.9 -46.1 -1.8 -18.4 4.5 19 63 A V H X S+ 0 0 1 -4,-2.4 4,-2.2 -5,-0.2 -1,-0.2 0.939 113.6 51.0 -63.9 -46.3 -1.7 -16.8 1.1 20 64 A L H X S+ 0 0 53 -4,-2.0 4,-2.1 -5,-0.3 -2,-0.2 0.907 112.0 45.8 -57.7 -45.4 -3.8 -19.5 -0.5 21 65 A A H X S+ 0 0 59 -4,-2.3 4,-2.8 2,-0.2 -1,-0.2 0.872 109.9 53.9 -68.4 -38.0 -6.5 -19.2 2.3 22 66 A R H X S+ 0 0 63 -4,-2.2 4,-2.7 2,-0.2 -1,-0.2 0.901 108.3 51.2 -61.6 -38.9 -6.6 -15.4 2.1 23 67 A a H X S+ 0 0 1 -4,-2.2 4,-2.8 2,-0.2 -2,-0.2 0.941 110.5 48.3 -62.9 -49.1 -7.2 -15.7 -1.7 24 68 A V H X S+ 0 0 63 -4,-2.1 4,-1.3 2,-0.2 -2,-0.2 0.954 113.6 46.4 -53.8 -55.0 -10.1 -18.1 -1.1 25 69 A K H X S+ 0 0 109 -4,-2.8 4,-1.4 1,-0.2 3,-0.5 0.914 113.7 48.7 -57.9 -45.6 -11.7 -15.9 1.5 26 70 A Y H X S+ 0 0 4 -4,-2.7 4,-2.3 1,-0.2 3,-0.3 0.930 111.2 49.4 -60.7 -45.2 -11.2 -12.7 -0.6 27 71 A T H < S+ 0 0 20 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.671 108.3 53.6 -73.3 -15.1 -12.7 -14.4 -3.7 28 72 A E H < S+ 0 0 136 -4,-1.3 -1,-0.2 -3,-0.5 -2,-0.2 0.785 114.7 41.6 -84.1 -30.2 -15.8 -15.7 -1.8 29 73 A I H < S+ 0 0 96 -4,-1.4 -2,-0.2 -3,-0.3 -3,-0.1 0.968 107.7 56.8 -79.8 -57.4 -16.6 -12.2 -0.5 30 74 A H >< - 0 0 56 -4,-2.3 3,-1.6 -5,-0.1 -1,-0.2 -0.674 69.8-156.5 -86.6 112.4 -16.0 -9.9 -3.5 31 75 A P G > S+ 0 0 78 0, 0.0 3,-1.7 0, 0.0 -1,-0.1 0.801 86.9 59.9 -63.2 -34.3 -18.2 -11.1 -6.4 32 76 A E G 3 S+ 0 0 90 1,-0.3 3,-0.2 2,-0.1 40,-0.1 0.584 109.8 44.8 -72.3 -9.3 -16.1 -9.6 -9.3 33 77 A M G X S+ 0 0 5 -3,-1.6 3,-0.6 -7,-0.2 -1,-0.3 0.129 80.9 110.0-111.0 16.6 -13.1 -11.7 -8.2 34 78 A R T < S+ 0 0 183 -3,-1.7 -2,-0.1 1,-0.2 -1,-0.1 0.472 75.5 52.2 -75.0 -1.7 -15.3 -14.8 -7.8 35 79 A H T 3 S+ 0 0 150 -3,-0.2 -1,-0.2 -4,-0.1 -2,-0.1 0.687 77.1 118.2-105.8 -26.1 -13.7 -16.5 -10.8 36 80 A V < - 0 0 24 -3,-0.6 2,-0.8 1,-0.1 -3,-0.0 -0.085 64.3-130.3 -44.3 134.3 -10.0 -16.1 -10.0 37 81 A D > - 0 0 95 1,-0.1 4,-1.4 31,-0.1 3,-0.3 -0.836 16.0-161.9 -93.0 110.4 -8.2 -19.5 -9.6 38 82 A a H > S+ 0 0 13 -2,-0.8 4,-2.5 1,-0.2 5,-0.2 0.802 85.0 59.7 -70.3 -28.1 -6.3 -19.2 -6.3 39 83 A Q H > S+ 0 0 90 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.917 108.8 45.1 -61.5 -43.1 -3.9 -22.1 -7.0 40 84 A S H > S+ 0 0 32 -3,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.784 109.7 55.0 -72.6 -28.2 -2.6 -20.3 -10.0 41 85 A V H X S+ 0 0 2 -4,-1.4 4,-2.3 2,-0.2 -2,-0.2 0.944 110.1 46.5 -67.3 -46.0 -2.4 -17.0 -8.1 42 86 A W H X S+ 0 0 15 -4,-2.5 4,-3.1 1,-0.2 5,-0.2 0.931 110.9 52.1 -58.4 -48.3 -0.2 -18.8 -5.5 43 87 A D H X S+ 0 0 78 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.905 110.9 48.4 -53.9 -43.1 1.9 -20.3 -8.3 44 88 A A H X S+ 0 0 16 -4,-2.1 4,-0.7 2,-0.2 21,-0.4 0.887 112.1 48.2 -66.7 -39.9 2.4 -16.9 -9.8 45 89 A F H >X S+ 0 0 0 -4,-2.3 3,-1.3 1,-0.2 4,-0.6 0.959 111.9 49.8 -63.6 -53.1 3.3 -15.4 -6.4 46 90 A K H >X S+ 0 0 76 -4,-3.1 4,-2.6 1,-0.3 3,-1.1 0.873 105.0 58.7 -49.0 -46.6 5.8 -18.3 -5.7 47 91 A G H 3< S+ 0 0 42 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.715 94.8 65.3 -64.2 -21.7 7.4 -17.8 -9.1 48 92 A A H << S+ 0 0 0 -3,-1.3 -1,-0.3 -4,-0.7 10,-0.2 0.816 123.1 8.5 -70.6 -29.3 8.3 -14.2 -8.4 49 93 A F H X< S+ 0 0 1 -3,-1.1 3,-1.4 -4,-0.6 68,-0.3 0.581 93.3 110.5-131.1 -15.6 10.8 -15.1 -5.6 50 94 A I T 3< S+ 0 0 29 -4,-2.6 72,-0.1 1,-0.3 3,-0.1 -0.456 94.8 3.4 -69.5 138.2 11.4 -18.8 -5.4 51 95 A S T 3 S+ 0 0 50 70,-0.7 69,-1.1 72,-0.3 2,-0.3 0.561 107.6 117.9 62.0 10.1 15.0 -19.9 -6.4 52 96 A K S < S- 0 0 63 -3,-1.4 65,-0.2 67,-0.2 -1,-0.2 -0.811 78.6-102.3-105.9 148.0 15.9 -16.2 -6.9 53 97 A H > - 0 0 85 -2,-0.3 3,-2.2 3,-0.2 65,-0.1 -0.554 31.6-134.9 -65.2 124.7 18.5 -14.3 -5.0 54 98 A P T 3 S+ 0 0 5 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.349 102.0 53.8 -71.4 7.8 16.5 -12.3 -2.4 55 99 A b T 3 S+ 0 0 28 84,-0.1 83,-0.2 1,-0.1 84,-0.1 0.203 102.5 57.9-118.2 11.0 18.6 -9.2 -3.2 56 100 A D < + 0 0 98 -3,-2.2 2,-0.4 80,-0.1 -3,-0.2 -0.170 68.9 139.5-132.2 42.1 18.0 -9.2 -7.0 57 101 A I - 0 0 1 81,-2.0 2,-0.3 -3,-0.1 -8,-0.1 -0.703 29.4-168.0 -90.9 137.2 14.2 -9.1 -7.3 58 102 A T >> - 0 0 24 -2,-0.4 3,-0.7 -10,-0.2 4,-0.6 -0.770 36.5-109.0-121.4 168.2 12.7 -6.9 -10.0 59 103 A E G >4 S+ 0 0 42 -2,-0.3 3,-0.7 1,-0.3 4,-0.3 0.800 117.0 63.0 -67.4 -25.3 9.2 -5.6 -10.9 60 104 A E G >4 S+ 0 0 135 1,-0.2 3,-1.5 2,-0.2 -1,-0.3 0.848 90.9 65.7 -67.3 -33.1 9.2 -7.9 -13.9 61 105 A D G <4 S+ 0 0 30 -3,-0.7 4,-0.3 1,-0.3 -1,-0.2 0.865 105.3 45.7 -53.2 -35.4 9.4 -10.9 -11.5 62 106 A Y G S+ 0 0 61 -3,-1.5 4,-2.6 -4,-0.3 5,-0.2 0.846 80.4 54.7 -64.5 -36.8 4.1 -9.2 -13.5 64 108 A P H > S+ 0 0 71 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.931 112.7 44.5 -58.8 -43.5 2.5 -12.7 -13.8 65 109 A L H > S+ 0 0 1 -21,-0.4 4,-2.2 -4,-0.3 -2,-0.2 0.918 112.3 52.1 -63.8 -45.3 1.0 -12.1 -10.3 66 110 A M H < S+ 0 0 5 -4,-2.5 4,-0.2 1,-0.2 -1,-0.2 0.903 109.0 50.9 -57.3 -43.3 -0.0 -8.5 -11.3 67 111 A K H >< S+ 0 0 159 -4,-2.6 3,-1.0 1,-0.2 -1,-0.2 0.919 112.3 45.2 -62.8 -44.7 -1.8 -9.8 -14.4 68 112 A L H 3< S+ 0 0 66 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.818 114.0 50.6 -68.6 -30.4 -3.7 -12.4 -12.4 69 113 A G T 3< S+ 0 0 7 -4,-2.2 37,-0.3 -5,-0.1 -1,-0.2 0.289 75.3 142.6 -92.8 10.0 -4.6 -9.9 -9.7 70 114 A T < + 0 0 94 -3,-1.0 2,-0.3 -4,-0.2 -3,-0.1 -0.258 25.3 171.4 -52.9 134.8 -5.9 -7.2 -12.1 71 115 A Q - 0 0 36 2,-0.0 2,-0.6 -38,-0.0 -2,-0.0 -0.992 33.4-126.8-152.9 137.8 -8.9 -5.5 -10.5 72 116 A T - 0 0 132 -2,-0.3 -40,-0.1 -40,-0.1 -2,-0.0 -0.782 27.9-173.9 -88.8 122.3 -11.1 -2.4 -11.1 73 117 A V - 0 0 16 -2,-0.6 2,-0.5 82,-0.1 5,-0.1 -0.876 41.4 -94.8-110.5 147.7 -11.4 -0.0 -8.2 74 118 A P > - 0 0 51 0, 0.0 3,-2.0 0, 0.0 25,-0.2 -0.505 39.6-148.9 -62.2 112.1 -13.8 3.0 -8.1 75 119 A c G > S+ 0 0 48 -2,-0.5 82,-2.1 1,-0.3 3,-0.5 0.744 89.1 51.3 -66.9 -24.7 -11.2 5.6 -9.3 76 120 A N G 3 S+ 0 0 72 1,-0.2 -1,-0.3 80,-0.2 83,-0.2 0.327 101.4 61.7 -91.6 7.9 -12.7 8.5 -7.4 77 121 A K G < + 0 0 97 -3,-2.0 22,-2.6 81,-0.0 2,-0.3 -0.014 69.6 139.3-123.5 30.4 -12.9 6.8 -4.0 78 122 A I B < -b 99 0B 1 -3,-0.5 83,-1.8 81,-0.3 2,-0.5 -0.611 32.4-164.2 -84.3 130.2 -9.2 6.0 -3.3 79 123 A L E -c 161 0C 1 20,-3.0 22,-0.4 -2,-0.3 2,-0.2 -0.966 7.0-173.5-111.7 115.5 -7.7 6.5 0.2 80 124 A L E -c 162 0C 4 81,-2.9 83,-2.0 -2,-0.5 2,-0.3 -0.609 7.4-176.1 -94.0 163.7 -3.9 6.6 0.5 81 125 A W E -c 163 0C 55 81,-0.3 2,-0.4 -2,-0.2 83,-0.2 -0.991 19.1-150.7-155.9 159.5 -2.0 6.6 3.9 82 126 A S E S-c 164 0C 9 81,-1.9 83,-0.7 -2,-0.3 -2,-0.0 -0.955 77.7 -26.3-137.6 119.7 1.4 6.9 5.4 83 127 A R S S+ 0 0 101 -2,-0.4 81,-0.1 1,-0.1 85,-0.0 0.670 116.0 89.3 57.8 19.5 2.4 5.4 8.8 84 128 A I > + 0 0 31 79,-0.2 4,-1.5 1,-0.1 -1,-0.1 -0.263 42.1 144.5-138.8 50.5 -1.2 5.5 10.1 85 129 A K H > + 0 0 57 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.867 61.7 59.3 -67.1 -42.5 -2.7 2.2 9.0 86 130 A D H > S+ 0 0 120 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.926 109.3 42.8 -52.5 -55.0 -5.1 1.3 11.9 87 131 A L H > S+ 0 0 14 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.917 112.3 54.5 -59.5 -42.5 -7.2 4.4 11.6 88 132 A A H X S+ 0 0 0 -4,-1.5 4,-1.8 1,-0.2 -1,-0.2 0.902 112.6 43.2 -62.7 -40.1 -7.3 4.2 7.8 89 133 A H H X S+ 0 0 27 -4,-2.4 4,-1.5 2,-0.2 -1,-0.2 0.868 111.5 51.8 -72.0 -39.3 -8.6 0.6 7.9 90 134 A Q H X S+ 0 0 96 -4,-2.4 4,-0.7 -5,-0.2 -2,-0.2 0.927 110.8 52.6 -62.5 -40.2 -11.1 1.3 10.7 91 135 A F H >X S+ 0 0 8 -4,-2.5 3,-0.9 -5,-0.2 4,-0.5 0.928 109.9 43.7 -60.0 -51.4 -12.4 4.2 8.6 92 136 A T H 3X S+ 0 0 5 -4,-1.8 4,-1.3 1,-0.2 -1,-0.2 0.764 106.4 65.0 -69.6 -21.5 -13.0 2.2 5.4 93 137 A Q H 3< S+ 0 0 132 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.734 87.1 71.8 -70.6 -23.6 -14.6 -0.6 7.3 94 138 A V H << S- 0 0 44 -3,-0.9 -1,-0.2 -4,-0.7 -2,-0.1 0.946 129.9 -26.8 -62.9 -54.9 -17.6 1.4 8.5 95 139 A Q H < S- 0 0 99 -4,-0.5 -1,-0.2 -3,-0.1 -2,-0.2 0.115 88.2 -98.7-150.3 25.6 -19.6 1.8 5.3 96 140 A R < + 0 0 206 -4,-1.3 -4,-0.1 -5,-0.2 -3,-0.1 0.938 62.0 159.0 47.7 56.8 -16.9 1.6 2.5 97 141 A D S S+ 0 0 61 -6,-0.4 2,-0.3 1,-0.1 -5,-0.1 0.785 70.1 2.7 -71.6 -28.0 -16.7 5.3 2.1 98 142 A M S S- 0 0 23 -6,-0.1 2,-0.4 -7,-0.1 -20,-0.2 -0.925 71.1-118.5-150.9 172.2 -13.3 4.7 0.5 99 143 A F B -b 78 0B 47 -22,-2.6 -20,-3.0 -2,-0.3 2,-0.2 -0.980 18.7-166.1-120.0 125.8 -10.8 2.0 -0.7 100 144 A T > - 0 0 0 -2,-0.4 3,-1.9 -22,-0.2 4,-0.2 -0.600 41.8-100.7 -95.9 170.0 -7.2 1.5 0.6 101 145 A L G > S+ 0 0 13 -22,-0.4 3,-1.9 1,-0.3 6,-0.5 0.862 122.1 61.2 -57.8 -34.4 -4.7 -0.7 -1.1 102 146 A E G 3 S+ 0 0 16 1,-0.3 -1,-0.3 5,-0.2 9,-0.1 0.564 91.4 67.7 -73.6 -5.2 -5.3 -3.5 1.4 103 147 A D G < S+ 0 0 39 -3,-1.9 -1,-0.3 4,-0.1 -2,-0.2 0.487 89.0 84.5 -88.6 -4.7 -9.0 -3.6 0.2 104 148 A T S <> S- 0 0 12 -3,-1.9 4,-2.2 -4,-0.2 5,-0.2 -0.535 93.7-111.7 -89.3 163.4 -7.7 -4.9 -3.1 105 149 A L H > S+ 0 0 0 -36,-0.2 4,-2.4 2,-0.2 5,-0.1 0.959 115.9 43.7 -58.7 -52.3 -6.9 -8.6 -3.7 106 150 A L H > S+ 0 0 15 -37,-0.3 4,-1.6 1,-0.2 5,-0.2 0.933 115.0 47.2 -64.2 -47.4 -3.2 -8.2 -3.9 107 151 A G H > S+ 0 0 0 -6,-0.5 4,-1.4 1,-0.2 -1,-0.2 0.874 112.6 52.2 -59.8 -37.5 -2.9 -5.8 -1.0 108 152 A Y H < S+ 0 0 83 -4,-2.2 -2,-0.2 -7,-0.3 -1,-0.2 0.888 106.0 53.3 -66.6 -41.8 -5.1 -8.2 1.1 109 153 A L H < S+ 0 0 0 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.912 118.6 33.1 -58.9 -44.9 -2.9 -11.2 0.3 110 154 A A H >< S+ 0 0 1 -4,-1.6 3,-2.4 -5,-0.1 -1,-0.2 0.588 81.4 130.2 -92.6 -15.5 0.4 -9.7 1.4 111 155 A D T 3< S- 0 0 28 -4,-1.4 3,-0.1 1,-0.3 -3,-0.0 -0.167 86.0 -4.3 -50.1 126.7 -0.7 -7.4 4.3 112 156 A D T 3 S+ 0 0 123 1,-0.2 -1,-0.3 0, 0.0 2,-0.2 0.522 106.9 119.0 70.3 9.2 1.4 -7.9 7.4 113 157 A L < - 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