==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-JUL-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 17-DEC-09 3L3M . COMPND 2 MOLECULE: POLY [ADP-RIBOSE] POLYMERASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR C.H.PARK . 348 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16957.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 236 67.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 2.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 56 16.1 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 . 1 0.3 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 . 33 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 31 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 95 27.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.9 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 1 0 1 1 0 2 0 2 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 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 0 0 PARALLEL BRIDGES PER LADDER . 3 0 3 0 0 1 0 1 2 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 . 1 0 1 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 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 2 A S 0 0 58 0, 0.0 7,-0.0 0, 0.0 124,-0.0 0.000 360.0 360.0 360.0 158.6 16.9 36.3 3.6 2 3 A K + 0 0 198 2,-0.0 0, 0.0 0, 0.0 0, 0.0 0.512 360.0 112.0 -87.0 -8.5 16.3 33.7 0.8 3 4 A L S S- 0 0 29 1,-0.1 137,-0.1 2,-0.1 126,-0.0 -0.318 77.2-101.2 -68.8 148.5 16.1 30.9 3.5 4 5 A P > - 0 0 61 0, 0.0 4,-2.3 0, 0.0 5,-0.2 -0.232 34.8-109.7 -63.4 156.8 12.8 29.1 4.2 5 6 A K H > S+ 0 0 152 1,-0.2 4,-2.5 2,-0.2 5,-0.3 0.963 116.1 51.7 -52.0 -61.4 10.9 30.2 7.3 6 7 A P H > S+ 0 0 27 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.839 111.8 47.7 -46.1 -42.8 11.6 27.0 9.4 7 8 A V H > S+ 0 0 0 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.903 109.5 52.9 -67.8 -41.3 15.4 27.3 8.7 8 9 A Q H X S+ 0 0 45 -4,-2.3 4,-1.8 -3,-0.2 -1,-0.2 0.896 111.4 46.5 -61.0 -38.4 15.2 31.0 9.6 9 10 A D H X S+ 0 0 65 -4,-2.5 4,-2.0 2,-0.2 -1,-0.2 0.816 110.0 53.7 -72.2 -31.6 13.6 30.0 12.9 10 11 A L H X S+ 0 0 0 -4,-1.7 4,-1.9 -5,-0.3 -2,-0.2 0.913 108.1 50.9 -67.0 -43.2 16.2 27.3 13.4 11 12 A I H X S+ 0 0 2 -4,-2.6 4,-1.4 1,-0.2 -2,-0.2 0.908 110.9 46.7 -60.0 -47.4 18.9 29.8 13.0 12 13 A K H < S+ 0 0 112 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.915 109.5 57.0 -62.8 -41.5 17.5 32.2 15.5 13 14 A M H >< S+ 0 0 38 -4,-2.0 3,-0.8 1,-0.2 -2,-0.2 0.894 110.8 39.6 -55.4 -50.8 16.9 29.3 18.0 14 15 A I H 3< S+ 0 0 6 -4,-1.9 194,-0.4 1,-0.2 -1,-0.2 0.700 116.5 49.1 -78.5 -20.8 20.6 28.2 18.1 15 16 A F T 3< S+ 0 0 12 -4,-1.4 2,-0.5 -5,-0.2 -1,-0.2 0.114 78.1 139.3-103.5 19.8 22.1 31.6 18.1 16 17 A D <> - 0 0 65 -3,-0.8 4,-0.9 1,-0.2 -3,-0.1 -0.520 37.4-165.1 -69.0 117.1 19.8 32.8 20.9 17 18 A V H > S+ 0 0 57 -2,-0.5 4,-1.9 1,-0.2 3,-0.3 0.861 87.5 55.4 -71.9 -37.3 21.9 35.0 23.3 18 19 A E H > S+ 0 0 97 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.827 102.5 57.9 -64.7 -32.0 19.3 34.9 26.1 19 20 A S H > S+ 0 0 29 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.840 104.5 52.2 -67.2 -32.9 19.4 31.1 25.9 20 21 A M H X S+ 0 0 3 -4,-0.9 4,-1.8 -3,-0.3 -2,-0.2 0.966 111.4 44.2 -66.9 -52.0 23.1 31.2 26.6 21 22 A K H X S+ 0 0 78 -4,-1.9 4,-2.4 1,-0.2 5,-0.3 0.842 111.4 55.4 -61.3 -35.3 22.7 33.4 29.7 22 23 A K H X S+ 0 0 122 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.905 105.7 51.7 -64.4 -41.0 19.8 31.3 30.9 23 24 A A H X S+ 0 0 4 -4,-1.8 4,-0.7 2,-0.2 -2,-0.2 0.891 112.3 46.9 -61.8 -40.8 22.0 28.2 30.7 24 25 A M H ><>S+ 0 0 0 -4,-1.8 3,-2.8 2,-0.2 5,-1.5 0.993 111.6 46.8 -63.9 -64.7 24.7 29.9 32.8 25 26 A V H ><5S+ 0 0 78 -4,-2.4 3,-2.3 1,-0.3 -1,-0.2 0.846 106.0 61.8 -45.9 -39.8 22.4 31.3 35.5 26 27 A E H 3<5S+ 0 0 134 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.833 102.9 51.6 -55.9 -32.8 20.8 27.9 35.6 27 28 A Y T <<5S- 0 0 30 -3,-2.8 -1,-0.3 -4,-0.7 -2,-0.2 0.378 122.4-108.9 -85.2 -0.5 24.3 26.7 36.7 28 29 A E T < 5 + 0 0 101 -3,-2.3 53,-3.5 -4,-0.3 2,-0.3 0.634 65.1 159.6 79.1 15.6 24.5 29.3 39.5 29 30 A I B < -A 80 0A 7 -5,-1.5 2,-1.0 51,-0.3 51,-0.3 -0.536 44.4-125.4 -74.1 132.9 27.0 31.2 37.5 30 31 A D > - 0 0 24 49,-2.2 4,-3.5 -2,-0.3 3,-0.4 -0.673 20.3-168.3 -81.0 105.2 27.5 34.9 38.4 31 32 A L T 4 S+ 0 0 44 -2,-1.0 -1,-0.2 1,-0.2 5,-0.1 0.698 85.6 60.6 -66.9 -19.4 27.0 36.7 35.1 32 33 A Q T 4 S+ 0 0 181 2,-0.2 -1,-0.2 1,-0.1 -2,-0.1 0.893 116.9 30.1 -73.6 -39.8 28.3 39.9 36.7 33 34 A K T 4 S+ 0 0 131 -3,-0.4 -2,-0.2 1,-0.2 -1,-0.1 0.868 135.6 29.6 -83.7 -42.9 31.7 38.2 37.4 34 35 A M S < S+ 0 0 9 -4,-3.5 -1,-0.2 45,-0.2 -2,-0.2 -0.658 80.3 177.6-121.9 75.5 31.6 35.9 34.4 35 36 A P >> - 0 0 52 0, 0.0 3,-1.4 0, 0.0 4,-0.5 -0.192 44.9-100.0 -70.9 168.8 29.7 37.5 31.6 36 37 A L G >4 S+ 0 0 16 1,-0.3 3,-1.7 2,-0.2 77,-0.1 0.918 122.4 53.8 -54.6 -50.8 29.2 35.8 28.2 37 38 A G G 34 S+ 0 0 57 1,-0.3 -1,-0.3 76,-0.0 -3,-0.0 0.586 104.3 58.9 -63.4 -9.9 32.0 37.9 26.5 38 39 A K G <4 S+ 0 0 131 -3,-1.4 -1,-0.3 2,-0.1 -2,-0.2 0.559 74.5 117.6 -96.2 -11.6 34.3 36.8 29.3 39 40 A L << - 0 0 15 -3,-1.7 2,-0.4 -4,-0.5 -3,-0.0 -0.347 47.2-166.8 -60.0 133.4 34.1 33.1 28.6 40 41 A S > - 0 0 42 1,-0.1 4,-1.5 -2,-0.0 5,-0.1 -0.975 29.2-145.3-130.4 140.5 37.4 31.6 27.6 41 42 A K H > S+ 0 0 60 -2,-0.4 4,-2.5 2,-0.2 5,-0.2 0.916 105.2 51.2 -65.1 -45.8 38.5 28.3 26.1 42 43 A R H > S+ 0 0 166 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.889 108.5 52.0 -59.4 -41.1 41.8 28.3 28.0 43 44 A Q H > S+ 0 0 30 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.840 109.7 49.4 -66.8 -31.6 39.9 28.9 31.3 44 45 A I H X S+ 0 0 0 -4,-1.5 4,-2.5 2,-0.2 -2,-0.2 0.912 109.4 51.3 -74.0 -39.6 37.6 26.0 30.5 45 46 A Q H X S+ 0 0 86 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.950 111.4 48.0 -58.9 -48.7 40.6 23.7 29.8 46 47 A A H X S+ 0 0 43 -4,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.859 110.5 52.2 -59.3 -38.0 42.1 24.8 33.1 47 48 A A H X S+ 0 0 0 -4,-1.6 4,-2.1 2,-0.2 -1,-0.2 0.875 106.4 53.5 -66.6 -38.4 38.8 24.1 34.8 48 49 A Y H X S+ 0 0 5 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.916 106.9 52.9 -60.9 -44.0 38.7 20.6 33.2 49 50 A S H X S+ 0 0 47 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.889 106.8 50.7 -59.0 -44.5 42.2 20.0 34.7 50 51 A I H X S+ 0 0 8 -4,-1.8 4,-1.9 1,-0.2 -1,-0.2 0.930 108.9 53.4 -59.8 -44.3 41.1 20.9 38.2 51 52 A L H X S+ 0 0 0 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.892 107.9 49.8 -56.9 -44.4 38.1 18.6 37.8 52 53 A S H X S+ 0 0 18 -4,-2.1 4,-2.2 169,-0.4 -1,-0.2 0.899 108.0 53.0 -62.9 -41.5 40.4 15.7 36.9 53 54 A E H X S+ 0 0 77 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.852 107.8 52.3 -62.5 -34.6 42.7 16.4 39.9 54 55 A V H X S+ 0 0 0 -4,-1.9 4,-2.6 2,-0.2 -1,-0.2 0.921 105.9 53.5 -66.8 -43.8 39.6 16.2 42.1 55 56 A Q H X S+ 0 0 37 -4,-2.0 4,-2.6 1,-0.2 -2,-0.2 0.940 111.4 46.5 -55.4 -47.0 38.6 12.8 40.6 56 57 A Q H X S+ 0 0 125 -4,-2.2 4,-2.2 1,-0.2 5,-0.3 0.928 111.7 49.9 -62.4 -43.7 42.1 11.6 41.5 57 58 A A H X>S+ 0 0 7 -4,-2.5 5,-2.8 1,-0.2 4,-1.7 0.835 113.0 48.7 -62.8 -33.8 41.9 13.1 45.0 58 59 A V H <5S+ 0 0 42 -4,-2.6 -2,-0.2 3,-0.2 -1,-0.2 0.891 111.9 47.2 -73.3 -42.0 38.5 11.3 45.4 59 60 A S H <5S+ 0 0 87 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.818 116.9 43.0 -70.2 -33.0 39.7 8.0 44.2 60 61 A Q H <5S- 0 0 172 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.840 110.9-119.0 -81.1 -35.0 42.8 8.0 46.4 61 62 A G T <5 - 0 0 53 -4,-1.7 -3,-0.2 -5,-0.3 -4,-0.1 0.826 31.7-149.0 94.5 43.5 41.0 9.3 49.4 62 63 A S < - 0 0 31 -5,-2.8 2,-4.1 1,-0.2 5,-0.1 -0.106 26.2-106.9 -45.8 134.7 43.0 12.5 49.8 63 64 A S - 0 0 123 1,-0.1 -1,-0.2 2,-0.1 3,-0.0 -0.105 57.2-112.6 -63.1 47.6 43.2 13.6 53.5 64 65 A D S S+ 0 0 108 -2,-4.1 2,-5.1 1,-0.2 -1,-0.1 0.127 100.4 74.8 47.0-169.4 40.7 16.4 52.8 65 66 A S S > S+ 0 0 90 1,-0.3 4,-2.0 -3,-0.1 -1,-0.2 -0.084 98.1 61.6 63.6 -47.9 41.8 20.0 53.0 66 67 A Q H > S+ 0 0 88 -2,-5.1 4,-2.3 2,-0.2 -1,-0.3 0.869 101.6 50.0 -71.0 -36.6 43.4 19.2 49.6 67 68 A I H > S+ 0 0 9 1,-0.2 4,-2.1 2,-0.2 23,-0.2 0.786 109.5 53.5 -69.0 -27.6 39.9 18.5 48.4 68 69 A L H > S+ 0 0 87 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.873 108.6 46.6 -75.3 -38.7 39.0 21.9 49.8 69 70 A D H X S+ 0 0 79 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.904 112.6 51.0 -69.8 -39.7 41.8 23.7 48.0 70 71 A L H X S+ 0 0 6 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.962 112.4 46.7 -59.3 -51.1 40.8 21.9 44.8 71 72 A S H X S+ 0 0 3 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.910 112.8 48.6 -57.7 -46.5 37.2 22.9 45.3 72 73 A N H X S+ 0 0 78 -4,-2.5 4,-1.3 1,-0.2 -1,-0.2 0.885 109.8 54.2 -60.9 -40.0 38.2 26.5 46.1 73 74 A R H X S+ 0 0 121 -4,-2.6 4,-1.6 1,-0.2 -2,-0.2 0.881 108.0 48.6 -63.0 -39.6 40.4 26.5 43.0 74 75 A F H X S+ 0 0 0 -4,-2.1 4,-3.0 1,-0.2 -2,-0.2 0.904 113.2 45.6 -68.6 -41.4 37.5 25.4 40.7 75 76 A Y H < S+ 0 0 22 -4,-2.0 5,-0.4 2,-0.2 -1,-0.2 0.689 109.6 56.2 -76.6 -17.7 35.0 28.1 42.0 76 77 A T H < S+ 0 0 117 -4,-1.3 -1,-0.2 -5,-0.2 -2,-0.2 0.871 113.0 41.9 -78.0 -37.2 37.7 30.7 41.8 77 78 A L H < S+ 0 0 53 -4,-1.6 -2,-0.2 1,-0.3 -3,-0.1 0.975 125.1 34.1 -70.8 -56.6 38.1 29.9 38.1 78 79 A I S < S- 0 0 0 -4,-3.0 2,-0.5 -5,-0.1 -1,-0.3 -0.815 90.4-144.9-106.6 91.6 34.4 29.5 37.4 79 80 A P - 0 0 20 0, 0.0 -49,-2.2 0, 0.0 2,-0.3 -0.411 21.2-176.1 -60.1 106.2 32.7 32.2 39.7 80 81 A H B -A 29 0A 16 -2,-0.5 2,-0.6 -5,-0.4 -51,-0.3 -0.708 21.6-136.2-103.8 157.0 29.3 31.0 41.0 81 82 A D + 0 0 91 -53,-3.5 3,-0.1 -2,-0.3 -50,-0.0 -0.952 36.0 153.7-116.5 110.9 26.8 32.9 43.1 82 83 A F - 0 0 69 -2,-0.6 2,-1.0 1,-0.1 -1,-0.1 0.709 39.9-141.8-106.1 -30.2 25.4 30.8 45.9 83 84 A G - 0 0 58 2,-0.0 2,-0.3 0, 0.0 -1,-0.1 -0.661 64.9 -16.4 101.5 -74.5 24.5 33.5 48.5 84 85 A M S S+ 0 0 163 -2,-1.0 -3,-0.0 2,-0.1 0, 0.0 -0.883 105.3 62.1-151.8-178.8 25.4 31.7 51.6 85 86 A K S S- 0 0 170 -2,-0.3 -1,-0.0 2,-0.0 -2,-0.0 0.269 103.3-102.5 76.1 -11.1 26.3 28.3 53.2 86 87 A K - 0 0 158 2,-0.0 -2,-0.1 3,-0.0 3,-0.1 0.292 48.2 -57.2 75.4 154.5 29.2 28.3 50.7 87 88 A P - 0 0 45 0, 0.0 -16,-0.0 0, 0.0 -15,-0.0 -0.214 68.3 -88.4 -62.2 151.8 29.6 26.4 47.4 88 89 A P - 0 0 73 0, 0.0 2,-0.6 0, 0.0 -2,-0.0 -0.258 42.0-113.0 -62.2 151.3 29.3 22.6 47.4 89 90 A L - 0 0 72 -3,-0.1 2,-2.0 1,-0.1 6,-0.1 -0.786 17.7-135.9 -90.2 118.1 32.4 20.6 48.1 90 91 A L + 0 0 1 -2,-0.6 -19,-0.1 -23,-0.2 -20,-0.1 -0.543 57.9 134.3 -73.0 84.6 33.5 18.6 45.0 91 92 A N + 0 0 79 -2,-2.0 2,-0.3 -20,-0.0 -1,-0.2 0.013 53.8 45.7-126.7 28.2 34.3 15.5 47.0 92 93 A N S >> S- 0 0 57 1,-0.1 4,-1.8 -3,-0.0 3,-0.6 -0.987 82.9-104.9-164.9 158.8 32.7 12.7 45.0 93 94 A A H 3> S+ 0 0 35 -2,-0.3 4,-2.3 1,-0.3 5,-0.2 0.872 118.4 57.7 -53.8 -41.2 32.3 11.3 41.5 94 95 A D H 3> S+ 0 0 113 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.881 105.4 51.0 -58.6 -39.8 28.7 12.6 41.3 95 96 A S H <> S+ 0 0 20 -3,-0.6 4,-2.2 2,-0.2 -2,-0.2 0.949 111.1 45.1 -63.8 -52.1 30.0 16.2 41.9 96 97 A V H X S+ 0 0 1 -4,-1.8 4,-2.9 1,-0.2 5,-0.3 0.880 108.7 58.0 -61.8 -37.9 32.7 16.2 39.2 97 98 A Q H X S+ 0 0 73 -4,-2.3 4,-2.2 -5,-0.2 -1,-0.2 0.925 109.0 45.1 -57.3 -46.9 30.3 14.6 36.7 98 99 A A H X S+ 0 0 41 -4,-1.7 4,-1.7 2,-0.2 -2,-0.2 0.939 115.1 46.4 -63.3 -48.6 27.8 17.5 37.2 99 100 A K H X S+ 0 0 41 -4,-2.2 4,-1.8 1,-0.2 -2,-0.2 0.861 112.7 50.4 -63.0 -37.2 30.6 20.2 37.0 100 101 A A H X S+ 0 0 11 -4,-2.9 4,-2.4 2,-0.2 -1,-0.2 0.894 106.0 56.2 -67.5 -38.9 32.1 18.5 33.9 101 102 A E H X S+ 0 0 78 -4,-2.2 4,-1.6 -5,-0.3 -2,-0.2 0.894 108.3 48.6 -59.5 -38.9 28.7 18.4 32.3 102 103 A M H X S+ 0 0 2 -4,-1.7 4,-2.8 2,-0.2 -1,-0.2 0.865 107.7 54.2 -69.3 -38.3 28.5 22.2 32.8 103 104 A L H X S+ 0 0 0 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.906 105.3 52.9 -64.3 -41.8 32.0 22.7 31.3 104 105 A D H X S+ 0 0 52 -4,-2.4 4,-1.5 1,-0.2 -1,-0.2 0.941 113.7 44.6 -57.1 -47.6 31.1 20.9 28.1 105 106 A N H X S+ 0 0 3 -4,-1.6 4,-2.5 1,-0.2 3,-0.3 0.933 110.7 51.2 -63.6 -48.1 28.1 23.2 27.7 106 107 A L H X S+ 0 0 2 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.858 107.4 57.2 -56.1 -37.0 29.9 26.4 28.6 107 108 A L H X S+ 0 0 23 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.895 109.6 42.5 -61.2 -43.8 32.5 25.4 26.0 108 109 A D H X S+ 0 0 19 -4,-1.5 4,-2.5 -3,-0.3 -2,-0.2 0.829 112.3 53.7 -74.8 -31.1 29.8 25.2 23.3 109 110 A I H X S+ 0 0 0 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.902 109.5 48.9 -68.6 -38.4 28.2 28.4 24.4 110 111 A E H X S+ 0 0 17 -4,-2.4 4,-2.7 -5,-0.2 5,-0.3 0.915 110.9 50.3 -65.1 -42.4 31.6 30.1 24.1 111 112 A V H X S+ 0 0 2 -4,-1.9 4,-1.8 1,-0.2 -2,-0.2 0.921 111.8 47.9 -60.7 -45.3 32.0 28.6 20.6 112 113 A A H X S+ 0 0 1 -4,-2.5 4,-2.2 93,-0.2 -1,-0.2 0.876 113.0 48.8 -63.7 -39.5 28.5 29.9 19.7 113 114 A Y H X S+ 0 0 49 -4,-2.3 4,-0.7 2,-0.2 -2,-0.2 0.931 112.7 44.8 -67.4 -48.2 29.3 33.3 21.1 114 115 A S H X S+ 0 0 54 -4,-2.7 4,-1.7 1,-0.2 -1,-0.2 0.813 115.1 50.0 -67.3 -29.6 32.6 33.8 19.4 115 116 A L H < S+ 0 0 40 -4,-1.8 -1,-0.2 -5,-0.3 -2,-0.2 0.908 110.8 49.0 -71.8 -43.6 31.2 32.5 16.2 116 117 A L H < S+ 0 0 29 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.550 116.6 43.5 -73.5 -9.5 28.2 34.9 16.5 117 118 A R H < S+ 0 0 134 -4,-0.7 4,-0.2 -3,-0.1 -1,-0.2 0.697 97.9 84.3-106.6 -28.8 30.6 37.8 17.1 118 119 A G S < S+ 0 0 35 -4,-1.7 2,-0.1 -5,-0.2 16,-0.1 -0.236 76.4 35.6 -70.7 163.8 33.2 37.1 14.5 119 120 A G S S- 0 0 69 1,-0.1 2,-1.0 2,-0.1 11,-0.0 -0.376 109.9 -32.0 88.7-169.3 32.8 38.3 10.9 120 121 A S - 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