==== 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 TRANSFERASE 04-SEP-08 2ZSA . COMPND 2 MOLECULE: PANTOTHENATE KINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR B.CHETNANI,S.DAS,P.KUMAR,A.SUROLIA,M.VIJAYAN . 307 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15878.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 217 70.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 22 7.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 23 7.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 1 0.3 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 . 18 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 44 14.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 92 30.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 3.6 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 0 1 3 1 0 0 0 0 1 1 2 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 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 0 0 0 PARALLEL BRIDGES PER LADDER . 1 0 0 0 2 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 ANTIPARALLEL BRIDGES PER LADDER . 1 0 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 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 6 A E 0 0 232 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 125.2 100.2 42.0 0.2 2 7 A P - 0 0 128 0, 0.0 3,-0.0 0, 0.0 0, 0.0 -0.045 360.0-171.1 -48.7 146.8 99.3 39.1 2.5 3 8 A S - 0 0 54 2,-0.2 303,-0.1 1,-0.1 0, 0.0 -0.978 34.8-136.8-142.5 152.1 95.6 38.1 2.8 4 9 A P S S+ 0 0 53 0, 0.0 302,-2.9 0, 0.0 303,-2.6 0.638 90.2 63.5 -82.3 -12.2 93.5 35.8 4.9 5 10 A Y E -A 305 0A 57 300,-0.3 2,-0.3 301,-0.2 300,-0.2 -0.527 63.8-153.8-107.0 174.1 91.8 34.6 1.7 6 11 A V E -A 304 0A 50 298,-2.1 298,-3.1 -2,-0.2 2,-0.3 -0.962 15.8-145.5-147.7 125.9 92.6 32.8 -1.5 7 12 A E E -A 303 0A 126 -2,-0.3 2,-0.3 296,-0.2 296,-0.2 -0.720 17.1-175.0 -96.6 146.1 90.7 33.3 -4.7 8 13 A F E -A 302 0A 36 294,-2.7 294,-1.8 -2,-0.3 2,-0.3 -0.910 17.9-143.0-134.2 161.6 90.0 30.5 -7.3 9 14 A D E > -A 301 0A 63 -2,-0.3 4,-2.7 292,-0.2 5,-0.3 -0.719 43.8 -97.5-113.1 169.2 88.5 30.2 -10.7 10 15 A R H > S+ 0 0 33 290,-1.2 4,-2.4 -2,-0.3 5,-0.1 0.888 124.4 57.4 -56.5 -37.8 86.5 27.2 -11.7 11 16 A R H > S+ 0 0 166 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.951 112.4 38.6 -54.7 -56.0 89.5 25.7 -13.4 12 17 A Q H > S+ 0 0 101 1,-0.2 4,-0.6 2,-0.2 3,-0.4 0.902 117.1 49.0 -64.1 -45.8 91.7 25.9 -10.3 13 18 A W H >< S+ 0 0 4 -4,-2.7 3,-0.8 1,-0.2 -1,-0.2 0.834 104.4 62.1 -65.3 -32.2 89.0 24.9 -7.8 14 19 A R H >< S+ 0 0 96 -4,-2.4 3,-1.5 -5,-0.3 4,-0.3 0.854 94.7 59.9 -62.3 -37.7 88.1 21.9 -10.1 15 20 A A H >< S+ 0 0 61 -4,-1.1 3,-1.0 -3,-0.4 -1,-0.2 0.767 91.6 70.2 -63.7 -25.2 91.5 20.3 -9.7 16 21 A L T << S+ 0 0 64 -3,-0.8 -1,-0.3 -4,-0.6 -2,-0.2 0.393 75.4 85.0 -75.1 4.8 91.0 20.1 -5.9 17 22 A R T X + 0 0 65 -3,-1.5 3,-1.8 1,-0.2 -1,-0.2 0.873 62.9 164.2 -72.1 -37.6 88.3 17.4 -6.4 18 23 A M T < - 0 0 131 -3,-1.0 -1,-0.2 1,-0.3 -2,-0.1 -0.260 69.8 -17.8 55.0-133.6 91.0 14.6 -6.5 19 24 A S T 3 S+ 0 0 112 2,-0.1 -1,-0.3 0, 0.0 -2,-0.1 0.571 92.2 141.5 -80.5 -7.8 89.5 11.2 -6.1 20 25 A T < - 0 0 16 -3,-1.8 2,-0.2 1,-0.1 29,-0.1 -0.059 48.2-133.7 -39.9 117.0 86.3 12.5 -4.6 21 26 A P - 0 0 83 0, 0.0 2,-0.8 0, 0.0 -1,-0.1 -0.547 3.2-130.1 -82.1 141.9 83.5 10.3 -6.0 22 27 A L + 0 0 51 -2,-0.2 23,-0.1 1,-0.1 19,-0.0 -0.811 29.3 172.1 -92.2 111.0 80.2 11.6 -7.5 23 28 A A + 0 0 49 -2,-0.8 2,-0.4 2,-0.1 -1,-0.1 -0.154 45.5 93.2-112.5 38.9 77.3 9.7 -5.9 24 29 A L - 0 0 5 17,-0.1 2,-0.2 4,-0.0 20,-0.0 -0.996 60.5-142.7-135.4 135.5 74.4 11.6 -7.2 25 30 A T > - 0 0 71 -2,-0.4 4,-2.2 1,-0.1 5,-0.2 -0.572 28.5-113.5 -92.9 158.8 72.2 11.0 -10.3 26 31 A E H > S+ 0 0 89 1,-0.2 4,-1.5 2,-0.2 -1,-0.1 0.836 120.0 53.4 -57.9 -32.3 70.8 13.7 -12.6 27 32 A E H > S+ 0 0 165 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.894 107.8 47.4 -70.4 -41.5 67.4 12.6 -11.4 28 33 A E H 4 S+ 0 0 71 1,-0.2 4,-0.4 2,-0.2 -2,-0.2 0.829 107.7 58.8 -68.2 -31.7 68.3 13.0 -7.7 29 34 A L H >X S+ 0 0 0 -4,-2.2 3,-1.4 1,-0.2 4,-1.4 0.900 99.5 56.9 -63.3 -42.9 69.7 16.4 -8.5 30 35 A V H 3< S+ 0 0 83 -4,-1.5 3,-0.3 1,-0.3 -1,-0.2 0.884 100.6 56.9 -56.6 -42.6 66.4 17.6 -9.9 31 36 A G T 3< S+ 0 0 63 -4,-1.1 -1,-0.3 1,-0.2 -2,-0.2 0.651 111.7 43.4 -66.4 -13.0 64.6 16.9 -6.6 32 37 A L T <4 S+ 0 0 33 -3,-1.4 -1,-0.2 -4,-0.4 -2,-0.2 0.630 91.8 103.4-103.0 -19.6 67.1 19.2 -4.9 33 38 A R < - 0 0 85 -4,-1.4 2,-0.2 -3,-0.3 3,-0.1 -0.445 62.6-143.5 -70.1 129.6 67.0 21.9 -7.5 34 39 A G > - 0 0 20 -2,-0.2 3,-2.3 1,-0.1 2,-0.2 -0.508 38.0 -74.4 -90.0 162.2 65.0 25.0 -6.6 35 40 A L T 3 S+ 0 0 88 1,-0.3 -1,-0.1 -2,-0.2 3,-0.1 -0.343 120.7 15.2 -58.2 121.6 62.9 27.1 -9.0 36 41 A G T 3 S+ 0 0 37 1,-0.3 2,-0.4 -2,-0.2 -1,-0.3 0.259 94.2 126.8 99.4 -11.9 65.2 29.1 -11.2 37 42 A E < - 0 0 16 -3,-2.3 -1,-0.3 1,-0.1 260,-0.1 -0.666 41.5-165.7 -87.6 133.7 68.4 27.2 -10.4 38 43 A Q + 0 0 119 -2,-0.4 -1,-0.1 258,-0.1 260,-0.1 0.633 31.6 147.1 -89.5 -17.5 70.6 25.9 -13.2 39 44 A I - 0 0 3 258,-0.1 2,-0.2 1,-0.1 -6,-0.1 0.193 23.0-177.6 -28.5 123.8 72.8 23.5 -11.3 40 45 A D > - 0 0 70 1,-0.0 4,-1.7 -10,-0.0 5,-0.2 -0.729 44.2 -94.4-119.9 172.0 73.8 20.4 -13.4 41 46 A L H > S+ 0 0 35 -2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.827 121.9 61.5 -58.1 -31.7 75.9 17.3 -12.6 42 47 A L H >> S+ 0 0 81 1,-0.2 4,-2.5 2,-0.2 3,-1.0 0.983 104.4 45.9 -57.9 -58.0 78.9 19.0 -14.0 43 48 A E H 3>>S+ 0 0 8 1,-0.3 4,-2.0 2,-0.2 5,-1.4 0.828 108.2 57.5 -54.2 -36.0 78.8 21.9 -11.5 44 49 A V H 3<>S+ 0 0 0 -4,-1.7 5,-1.2 3,-0.2 -1,-0.3 0.885 112.4 43.0 -62.5 -35.8 78.3 19.3 -8.7 45 50 A E H <<5S+ 0 0 62 -4,-1.7 -2,-0.2 -3,-1.0 -1,-0.2 0.916 120.2 37.1 -75.9 -47.6 81.6 17.7 -9.9 46 51 A E H <5S+ 0 0 29 -4,-2.5 -2,-0.2 -5,-0.1 -3,-0.2 0.645 135.7 16.6 -81.9 -16.6 83.7 20.8 -10.4 47 52 A V T X5S+ 0 0 1 -4,-2.0 4,-1.3 -5,-0.3 -3,-0.2 0.717 125.3 42.9-122.8 -51.2 82.4 22.8 -7.5 48 53 A Y H > S+ 0 0 4 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.947 113.8 51.7 -57.1 -44.3 86.0 19.8 -3.9 51 56 A L H X S+ 0 0 0 -4,-1.3 4,-2.7 1,-0.2 -2,-0.2 0.927 107.8 49.7 -56.5 -49.7 83.9 21.5 -1.2 52 57 A A H X S+ 0 0 4 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.875 111.4 50.9 -59.2 -37.4 82.7 18.2 0.2 53 58 A R H X S+ 0 0 87 -4,-2.3 4,-2.3 2,-0.2 3,-0.3 0.976 109.8 48.0 -63.5 -56.3 86.3 17.0 0.4 54 59 A L H X S+ 0 0 35 -4,-2.9 4,-1.8 1,-0.3 -2,-0.2 0.905 112.1 50.6 -49.7 -46.7 87.5 20.1 2.2 55 60 A I H X S+ 0 0 0 -4,-2.7 4,-2.2 1,-0.2 -1,-0.3 0.882 108.5 52.1 -61.4 -38.4 84.6 19.8 4.6 56 61 A H H X S+ 0 0 32 -4,-2.0 4,-1.1 -3,-0.3 -1,-0.2 0.878 108.3 50.7 -66.8 -36.0 85.5 16.1 5.2 57 62 A L H X S+ 0 0 103 -4,-2.3 4,-1.4 1,-0.2 -1,-0.2 0.848 112.9 47.9 -68.3 -33.1 89.1 17.1 6.0 58 63 A Q H X S+ 0 0 66 -4,-1.8 4,-3.6 -5,-0.2 5,-0.3 0.823 99.5 63.7 -78.4 -34.8 87.9 19.7 8.5 59 64 A V H X S+ 0 0 29 -4,-2.2 4,-1.4 2,-0.2 -1,-0.2 0.948 109.1 42.0 -55.1 -48.8 85.4 17.6 10.4 60 65 A A H X S+ 0 0 59 -4,-1.1 4,-1.2 1,-0.2 3,-0.4 0.948 116.7 47.9 -61.3 -50.6 88.2 15.3 11.6 61 66 A A H X S+ 0 0 52 -4,-1.4 4,-1.0 1,-0.2 3,-0.3 0.862 108.3 55.0 -59.0 -39.2 90.5 18.3 12.3 62 67 A R H X S+ 0 0 91 -4,-3.6 4,-1.5 1,-0.2 -1,-0.2 0.825 101.9 58.4 -66.5 -30.6 87.7 20.1 14.1 63 68 A Q H X S+ 0 0 82 -4,-1.4 4,-2.3 -3,-0.4 -1,-0.2 0.859 96.0 62.6 -67.2 -33.8 87.3 17.1 16.4 64 69 A R H X S+ 0 0 203 -4,-1.2 4,-2.6 -3,-0.3 -1,-0.2 0.914 103.8 51.1 -55.2 -43.7 90.9 17.4 17.5 65 70 A L H X S+ 0 0 99 -4,-1.0 4,-1.9 2,-0.2 -2,-0.2 0.938 110.9 42.8 -61.4 -53.2 90.0 20.8 18.9 66 71 A F H X S+ 0 0 70 -4,-1.5 4,-2.1 1,-0.2 -1,-0.2 0.851 114.9 54.4 -64.0 -30.5 87.0 19.8 21.0 67 72 A A H X S+ 0 0 54 -4,-2.3 4,-2.8 2,-0.2 -2,-0.2 0.935 103.8 53.8 -65.9 -47.7 89.0 16.8 22.1 68 73 A A H X S+ 0 0 52 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.915 111.9 44.8 -53.2 -46.8 91.9 19.0 23.3 69 74 A T H X S+ 0 0 84 -4,-1.9 4,-2.2 1,-0.2 -1,-0.2 0.890 111.5 53.6 -65.8 -38.6 89.5 21.0 25.4 70 75 A A H <>S+ 0 0 16 -4,-2.1 5,-0.8 1,-0.2 -2,-0.2 0.872 110.3 47.4 -63.5 -36.7 87.9 17.7 26.6 71 76 A E H ><5S+ 0 0 156 -4,-2.8 3,-1.6 2,-0.2 -2,-0.2 0.918 108.7 53.8 -70.2 -43.6 91.3 16.4 27.7 72 77 A F H 3<5S+ 0 0 174 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.899 108.4 50.0 -56.1 -43.1 92.2 19.7 29.4 73 78 A L T 3<5S- 0 0 99 -4,-2.2 -1,-0.3 -5,-0.1 -2,-0.2 0.498 111.5-124.4 -75.5 -3.0 89.0 19.4 31.5 74 79 A G T < 5 + 0 0 62 -3,-1.6 -3,-0.2 1,-0.2 3,-0.1 0.358 57.5 156.1 75.7 -8.5 90.0 15.9 32.3 75 80 A E < - 0 0 111 -5,-0.8 -1,-0.2 -6,-0.2 3,-0.1 -0.054 54.9 -86.0 -47.8 150.2 86.6 14.8 30.9 76 81 A P - 0 0 111 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.377 54.2 -90.9 -63.4 136.2 86.4 11.2 29.7 77 82 A Q - 0 0 202 -3,-0.1 2,-0.1 1,-0.1 -10,-0.0 -0.272 63.6-106.0 -47.6 125.1 87.5 10.7 26.1 78 83 A Q - 0 0 74 1,-0.1 -1,-0.1 -3,-0.1 3,-0.1 -0.261 38.5 -71.1 -73.0 149.3 84.2 11.2 24.2 79 84 A N > - 0 0 95 1,-0.2 2,-2.2 3,-0.2 3,-0.6 0.163 41.7-119.4 -31.5 122.6 81.9 8.8 22.5 80 85 A P T 3 S+ 0 0 126 0, 0.0 -1,-0.2 0, 0.0 -3,-0.0 -0.490 103.6 5.1 -73.0 83.1 83.0 7.2 19.2 81 86 A D T 3 S+ 0 0 115 -2,-2.2 -2,-0.1 -3,-0.1 110,-0.0 0.864 109.2 79.0 94.8 75.0 80.1 8.7 17.2 82 87 A R S < S+ 0 0 89 -3,-0.6 -3,-0.2 109,-0.1 107,-0.0 -0.243 75.6 154.7 171.7 38.9 78.0 11.0 19.3 83 88 A P - 0 0 26 0, 0.0 -4,-0.1 0, 0.0 80,-0.1 -0.078 58.9 -63.4 -74.4-178.1 80.9 13.4 18.6 84 89 A V - 0 0 52 1,-0.1 77,-0.1 -21,-0.1 78,-0.1 -0.590 64.2-113.6 -72.4 114.3 80.5 17.2 18.6 85 90 A P - 0 0 2 0, 0.0 2,-0.7 0, 0.0 107,-0.2 -0.200 24.7-127.2 -50.1 133.3 78.1 17.9 15.8 86 91 A F E -b 192 0A 4 105,-2.9 107,-2.1 128,-0.0 2,-0.5 -0.794 25.0-150.3 -89.6 113.9 79.8 19.8 13.0 87 92 A I E -b 193 0A 0 -2,-0.7 127,-2.6 125,-0.4 128,-1.4 -0.747 12.8-171.3 -94.2 127.8 77.8 23.0 12.3 88 93 A I E -bc 194 215A 0 105,-3.0 107,-3.6 -2,-0.5 2,-0.4 -0.963 7.1-155.6-118.9 130.0 77.7 24.5 8.8 89 94 A G E -bc 195 216A 0 126,-2.1 128,-3.2 -2,-0.4 2,-0.5 -0.826 3.8-164.9-105.6 143.1 76.1 27.8 8.0 90 95 A V E +bc 196 217A 0 105,-2.4 107,-2.6 -2,-0.4 2,-0.2 -0.923 18.4 173.5-130.3 107.0 74.8 28.9 4.6 91 96 A A E + c 0 218A 0 126,-3.1 128,-2.3 -2,-0.5 2,-0.2 -0.646 13.0 110.5-111.3 167.9 74.1 32.6 4.1 92 97 A G - 0 0 0 106,-0.9 128,-0.1 105,-0.3 108,-0.1 -0.782 60.2 -55.6 149.0 167.4 73.1 34.9 1.2 93 98 A S > - 0 0 2 126,-0.5 3,-1.3 -2,-0.2 5,-0.4 -0.140 64.4 -89.2 -64.9 161.8 70.4 37.1 -0.3 94 99 A V T 3 S+ 0 0 28 1,-0.2 -1,-0.1 178,-0.2 136,-0.1 -0.411 115.5 24.7 -67.8 155.9 66.9 35.8 -1.0 95 100 A A T 3 S+ 0 0 8 1,-0.1 -1,-0.2 -3,-0.1 -2,-0.1 0.602 90.6 110.0 65.0 13.3 66.7 34.4 -4.5 96 101 A V S < S- 0 0 0 -3,-1.3 -2,-0.1 123,-0.1 -1,-0.1 0.627 92.9-105.0 -93.8 -11.6 70.4 33.6 -4.6 97 102 A G >> + 0 0 8 -4,-0.2 4,-2.2 -5,-0.1 3,-0.6 0.591 69.8 143.7 102.2 12.0 70.0 29.8 -4.4 98 103 A K H 3> S+ 0 0 16 -5,-0.4 4,-2.6 1,-0.2 5,-0.2 0.857 73.3 60.8 -50.5 -36.5 71.0 29.1 -0.8 99 104 A S H 3> S+ 0 0 51 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.918 107.6 41.2 -56.1 -51.2 68.2 26.4 -0.9 100 105 A T H <> S+ 0 0 2 -3,-0.6 4,-3.1 2,-0.2 5,-0.3 0.954 114.4 51.9 -63.3 -53.0 69.8 24.4 -3.7 101 106 A T H X S+ 0 0 0 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.884 113.4 44.0 -52.4 -45.1 73.3 24.8 -2.4 102 107 A A H X S+ 0 0 0 -4,-2.6 4,-2.5 -5,-0.2 -1,-0.2 0.878 114.9 47.9 -71.5 -39.0 72.4 23.5 1.1 103 108 A R H X S+ 0 0 69 -4,-2.0 4,-2.0 -5,-0.2 -2,-0.2 0.881 113.9 47.4 -68.8 -38.4 70.2 20.6 -0.2 104 109 A V H X S+ 0 0 0 -4,-3.1 4,-2.6 2,-0.2 -2,-0.2 0.947 113.3 48.1 -67.1 -46.5 72.9 19.6 -2.6 105 110 A L H X S+ 0 0 0 -4,-2.3 4,-2.7 -5,-0.3 5,-0.2 0.919 110.0 52.3 -59.4 -44.5 75.6 19.8 0.1 106 111 A Q H X S+ 0 0 54 -4,-2.5 4,-1.7 1,-0.2 -1,-0.2 0.915 110.6 48.9 -57.4 -43.9 73.4 17.8 2.5 107 112 A A H X S+ 0 0 12 -4,-2.0 4,-1.5 2,-0.2 -2,-0.2 0.925 111.4 47.9 -62.6 -47.8 73.0 15.1 -0.1 108 113 A L H < S+ 0 0 14 -4,-2.6 3,-0.3 1,-0.2 -2,-0.2 0.930 113.6 47.0 -60.7 -45.5 76.7 14.9 -0.9 109 114 A L H >< S+ 0 0 0 -4,-2.7 3,-0.7 1,-0.2 -1,-0.2 0.795 107.6 56.8 -68.0 -28.4 77.7 14.7 2.8 110 115 A A H 3< S+ 0 0 34 -4,-1.7 2,-0.5 1,-0.3 -1,-0.2 0.836 101.0 59.1 -70.9 -32.3 75.0 12.1 3.5 111 116 A R T 3< S+ 0 0 96 -4,-1.5 2,-0.3 -3,-0.3 -1,-0.3 -0.227 85.1 115.0 -90.7 43.0 76.5 9.8 0.8 112 117 A W S X S- 0 0 89 -3,-0.7 3,-2.3 -2,-0.5 -3,-0.0 -0.737 80.7 -65.3-109.6 161.6 79.9 9.7 2.6 113 118 A D T 3 S+ 0 0 96 -2,-0.3 -1,-0.1 1,-0.3 -2,-0.0 -0.104 123.1 11.4 -45.9 133.7 81.6 6.7 4.1 114 119 A H T 3 S- 0 0 183 1,-0.2 -1,-0.3 -3,-0.1 -3,-0.1 0.534 113.7-101.2 72.7 7.3 79.7 5.2 7.1 115 120 A H < - 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