==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 09-AUG-10 3OC6 . COMPND 2 MOLECULE: 6-PHOSPHOGLUCONOLACTONASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM SMEGMATIS; . AUTHOR SEATTLE STRUCTURAL GENOMICS CENTER FOR INFECTIOUS DISEASE (S . 243 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10092.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 173 71.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 33 13.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 11 4.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 19 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 35 14.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 64 26.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.2 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 2 0 0 0 1 1 0 0 1 0 0 0 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 1 0 0 2 1 1 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 1 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 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 96 0, 0.0 229,-0.2 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 106.8 18.2 -11.1 -7.9 2 3 A D E -a 230 0A 122 227,-1.0 229,-2.2 1,-0.0 2,-0.6 -0.422 360.0-131.4 -79.6 148.8 15.5 -12.0 -5.3 3 4 A T E -a 231 0A 74 227,-0.2 2,-0.5 -2,-0.1 229,-0.2 -0.945 24.0-162.3 -97.7 123.3 14.2 -9.6 -2.6 4 5 A V E -a 232 0A 47 227,-3.0 229,-3.4 -2,-0.6 2,-0.5 -0.913 3.9-165.7-107.8 129.9 14.2 -11.3 0.9 5 6 A I E -a 233 0A 49 -2,-0.5 2,-0.5 227,-0.2 229,-0.2 -0.980 7.0-179.6-117.7 119.9 12.1 -9.9 3.7 6 7 A E E -a 234 0A 61 227,-2.8 229,-2.1 -2,-0.5 2,-0.3 -0.970 12.6-159.6-123.5 115.3 12.9 -11.1 7.2 7 8 A R E -a 235 0A 131 -2,-0.5 2,-0.3 227,-0.2 229,-0.2 -0.716 8.2-172.4 -98.5 141.4 10.6 -9.6 9.8 8 9 A H E -a 236 0A 39 227,-2.1 229,-1.4 -2,-0.3 6,-0.1 -0.907 32.8-117.1-131.0 158.5 11.4 -9.4 13.5 9 10 A A S S- 0 0 75 -2,-0.3 229,-0.3 227,-0.2 228,-0.3 0.882 85.1 -11.8 -70.8 -33.1 9.1 -8.3 16.3 10 11 A D S > S- 0 0 84 226,-0.1 4,-2.4 227,-0.1 5,-0.2 -0.896 78.5 -82.3-156.8 178.2 11.1 -5.2 17.5 11 12 A T H > S+ 0 0 61 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.901 121.1 52.7 -58.1 -48.4 14.4 -3.4 17.2 12 13 A A H > S+ 0 0 73 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.908 113.2 43.6 -52.5 -50.5 16.2 -5.6 19.8 13 14 A A H > S+ 0 0 38 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.873 113.7 53.2 -64.3 -37.3 15.3 -8.8 18.0 14 15 A L H X S+ 0 0 0 -4,-2.4 4,-2.8 2,-0.2 -2,-0.2 0.937 109.2 46.6 -61.5 -49.7 16.1 -7.3 14.6 15 16 A V H X S+ 0 0 25 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.885 112.8 50.1 -64.5 -40.3 19.6 -6.1 15.6 16 17 A A H X S+ 0 0 25 -4,-1.8 4,-2.3 -5,-0.2 -1,-0.2 0.939 113.9 45.0 -62.9 -46.9 20.4 -9.6 17.2 17 18 A A H X S+ 0 0 20 -4,-2.3 4,-2.8 1,-0.2 -2,-0.2 0.903 111.8 52.1 -65.5 -41.9 19.2 -11.4 14.1 18 19 A A H X S+ 0 0 1 -4,-2.8 4,-2.1 2,-0.2 -1,-0.2 0.899 110.6 48.1 -62.5 -42.4 21.1 -9.1 11.7 19 20 A G H X S+ 0 0 0 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.929 112.6 48.3 -62.5 -47.1 24.3 -9.6 13.6 20 21 A D H X S+ 0 0 39 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.916 110.8 51.7 -54.7 -46.7 23.9 -13.3 13.6 21 22 A R H X S+ 0 0 63 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.902 109.2 50.3 -63.2 -37.6 23.1 -13.2 9.9 22 23 A L H X S+ 0 0 3 -4,-2.1 4,-2.7 2,-0.2 5,-0.2 0.911 106.7 53.4 -69.4 -41.5 26.3 -11.2 9.3 23 24 A V H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.951 112.6 45.6 -52.7 -48.6 28.5 -13.7 11.2 24 25 A D H X S+ 0 0 84 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.850 111.9 51.0 -67.1 -37.3 27.1 -16.5 9.1 25 26 A A H X S+ 0 0 22 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.885 110.0 49.7 -67.0 -40.8 27.6 -14.6 5.8 26 27 A I H X S+ 0 0 2 -4,-2.7 4,-2.4 2,-0.2 -2,-0.2 0.950 113.0 47.2 -62.1 -46.1 31.2 -13.7 6.7 27 28 A S H X S+ 0 0 45 -4,-2.3 4,-2.4 -5,-0.2 -2,-0.2 0.906 112.7 49.0 -64.6 -41.5 31.9 -17.4 7.5 28 29 A S H X S+ 0 0 71 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.902 110.9 49.4 -61.3 -46.9 30.2 -18.6 4.3 29 30 A A H X S+ 0 0 6 -4,-2.4 4,-2.6 2,-0.2 6,-0.8 0.909 112.1 47.9 -60.9 -42.0 32.1 -16.1 2.2 30 31 A I H X S+ 0 0 29 -4,-2.4 4,-2.0 4,-0.2 -2,-0.2 0.906 112.7 51.1 -65.3 -38.6 35.4 -17.2 3.8 31 32 A G H < S+ 0 0 66 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.879 118.1 36.6 -62.7 -40.5 34.4 -20.9 3.2 32 33 A E H < S+ 0 0 142 -4,-2.4 -2,-0.2 -5,-0.1 -1,-0.2 0.823 137.4 12.4 -83.1 -32.6 33.6 -20.3 -0.5 33 34 A R H < S- 0 0 69 -4,-2.6 -3,-0.2 2,-0.3 -2,-0.2 0.416 95.9-110.1-131.9 -4.3 36.3 -17.8 -1.5 34 35 A G S < S+ 0 0 41 -4,-2.0 2,-0.3 -5,-0.4 -4,-0.2 0.511 93.7 45.0 83.6 5.2 38.9 -17.6 1.3 35 36 A Q - 0 0 51 -6,-0.8 2,-0.3 -9,-0.1 -2,-0.3 -0.977 65.5-140.2-169.6 165.9 37.9 -14.1 2.3 36 37 A A E -b 65 0A 0 28,-2.2 30,-3.0 -2,-0.3 2,-0.5 -0.997 7.5-162.0-141.6 133.8 34.9 -11.8 3.0 37 38 A T E -b 66 0A 2 -2,-0.3 102,-2.6 28,-0.2 103,-1.4 -0.990 17.1-179.6-122.0 119.3 34.5 -8.1 2.1 38 39 A I E -bc 67 140A 2 28,-2.8 30,-2.5 -2,-0.5 2,-0.6 -0.948 21.3-146.0-124.8 138.8 31.8 -6.2 4.0 39 40 A V E -bc 68 141A 0 101,-2.9 103,-3.0 -2,-0.4 30,-0.3 -0.929 21.5-150.0-106.6 124.1 30.7 -2.6 3.8 40 41 A L E -b 69 0A 3 28,-3.3 30,-2.5 -2,-0.6 31,-0.4 -0.459 8.1-157.6 -89.5 157.4 29.6 -1.1 7.1 41 42 A T - 0 0 7 5,-0.2 2,-0.1 28,-0.2 102,-0.1 -0.811 10.9-124.9-127.0 165.9 27.0 1.6 7.8 42 43 A G + 0 0 9 -2,-0.3 4,-0.4 4,-0.1 110,-0.1 -0.288 57.3 76.4 -94.9-171.7 26.3 4.1 10.5 43 44 A G S > S- 0 0 38 3,-0.2 4,-2.3 1,-0.1 5,-0.3 -0.035 89.4 -62.4 92.2 166.7 23.2 4.8 12.5 44 45 A G H > S+ 0 0 69 1,-0.2 4,-2.8 2,-0.2 5,-0.1 0.899 130.6 34.8 -53.7 -58.0 21.5 3.0 15.5 45 46 A T H > S+ 0 0 25 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.858 115.1 58.5 -72.4 -32.1 20.7 -0.4 14.1 46 47 A G H > S+ 0 0 2 -4,-0.4 4,-0.6 2,-0.2 -2,-0.2 0.888 115.4 34.8 -63.3 -39.6 23.8 -0.5 11.9 47 48 A I H >X S+ 0 0 15 -4,-2.3 4,-1.1 2,-0.2 3,-0.7 0.899 114.0 59.3 -80.4 -44.3 26.1 -0.1 14.9 48 49 A G H >X S+ 0 0 16 -4,-2.8 4,-1.0 -5,-0.3 3,-0.8 0.901 101.4 54.3 -51.8 -43.7 23.9 -2.2 17.2 49 50 A L H 3X S+ 0 0 0 -4,-2.6 4,-1.8 1,-0.2 3,-0.3 0.856 101.4 60.2 -63.3 -30.3 24.2 -5.2 14.9 50 51 A L H < S+ 0 0 0 -4,-1.8 3,-1.2 1,-0.2 -2,-0.2 0.910 103.7 58.5 -55.9 -39.5 28.9 -9.7 15.8 54 55 A R H >< S+ 0 0 115 -4,-2.1 3,-1.6 1,-0.3 4,-0.2 0.889 99.3 57.3 -60.2 -41.0 31.4 -8.9 18.6 55 56 A E H 3< S+ 0 0 142 -4,-1.2 -1,-0.3 1,-0.3 -2,-0.2 0.723 116.9 34.4 -61.9 -26.9 29.8 -11.5 20.8 56 57 A R T X< S+ 0 0 59 -3,-1.2 3,-2.1 -4,-0.9 -1,-0.3 0.160 82.2 117.6-110.9 18.6 30.4 -14.2 18.2 57 58 A S G X + 0 0 28 -3,-1.6 3,-1.5 1,-0.3 5,-0.1 0.721 61.9 71.1 -65.4 -21.8 33.7 -12.8 16.9 58 59 A G G 3 S+ 0 0 79 1,-0.3 -1,-0.3 -4,-0.2 -2,-0.1 0.584 86.9 67.1 -71.1 -11.3 35.7 -15.9 17.9 59 60 A E G < S+ 0 0 107 -3,-2.1 2,-0.4 2,-0.0 -1,-0.3 0.575 95.9 67.3 -80.7 -10.9 34.0 -17.9 15.1 60 61 A I S < S- 0 0 13 -3,-1.5 2,-0.9 -4,-0.2 3,-0.1 -0.890 73.4-136.7-120.6 142.3 35.8 -15.8 12.4 61 62 A D > - 0 0 76 -2,-0.4 3,-1.8 1,-0.1 -3,-0.1 -0.823 22.3-166.1 -92.9 103.1 39.4 -15.5 11.3 62 63 A W G > S+ 0 0 13 -2,-0.9 3,-1.6 1,-0.3 -1,-0.1 0.591 77.5 75.9 -74.8 -11.8 39.5 -11.7 10.8 63 64 A S G 3 S+ 0 0 57 1,-0.3 -1,-0.3 34,-0.2 34,-0.1 0.739 97.5 51.7 -67.9 -19.1 42.7 -11.7 8.9 64 65 A K G < S+ 0 0 79 -3,-1.8 -28,-2.2 -29,-0.1 2,-0.5 0.228 94.4 92.2 -98.2 14.3 40.5 -12.9 6.0 65 66 A V E < -b 36 0A 0 -3,-1.6 2,-0.4 -30,-0.2 -28,-0.2 -0.926 55.8-163.5-115.7 131.8 37.9 -10.0 6.4 66 67 A H E -b 37 0A 42 -30,-3.0 -28,-2.8 -2,-0.5 2,-0.4 -0.944 10.5-155.6-115.3 133.2 38.1 -6.7 4.5 67 68 A I E +bd 38 102A 5 34,-2.9 36,-2.5 -2,-0.4 2,-0.3 -0.924 18.1 164.2-123.2 129.4 36.1 -3.7 5.7 68 69 A Y E -b 39 0A 16 -30,-2.5 -28,-3.3 -2,-0.4 2,-0.4 -0.783 28.1-125.6-126.4 171.0 34.8 -0.7 3.9 69 70 A W E -b 40 0A 0 34,-0.5 -28,-0.2 -2,-0.3 3,-0.1 -0.962 3.1-147.6-117.7 148.3 32.2 2.0 4.7 70 71 A G S S- 0 0 0 -30,-2.5 114,-2.8 -2,-0.4 83,-0.3 0.738 83.1 -11.9 -79.1 -31.3 29.1 3.0 2.7 71 72 A D E -G 183 0B 10 -31,-0.4 2,-0.3 112,-0.2 -1,-0.2 -0.953 62.1-164.6-160.8 167.8 29.3 6.7 3.9 72 73 A E E -G 182 0B 0 110,-2.2 110,-2.4 -2,-0.3 2,-0.5 -0.975 28.7-108.7-158.6 151.7 31.0 8.8 6.5 73 74 A R E -G 181 0B 50 -2,-0.3 2,-1.7 108,-0.2 108,-0.3 -0.788 29.1-133.7 -87.7 125.7 30.7 12.2 8.0 74 75 A F + 0 0 4 106,-2.5 106,-0.2 -2,-0.5 33,-0.1 -0.628 66.2 111.4 -85.6 82.3 33.5 14.5 6.9 75 76 A V S S- 0 0 14 -2,-1.7 33,-1.5 31,-0.2 34,-0.4 -0.795 78.0 -49.4-141.9 174.5 34.3 15.8 10.3 76 77 A P > - 0 0 61 0, 0.0 3,-1.5 0, 0.0 6,-0.1 -0.215 54.2-117.2 -59.2 149.9 37.3 15.5 12.7 77 78 A Q T 3 S+ 0 0 91 1,-0.3 8,-0.2 -3,-0.1 5,-0.1 0.803 112.3 47.8 -55.4 -36.2 38.5 12.0 13.3 78 79 A D T 3 S+ 0 0 125 3,-0.0 -1,-0.3 7,-0.0 2,-0.1 0.454 83.0 122.1 -91.8 -0.7 37.7 12.0 17.0 79 80 A D X - 0 0 52 -3,-1.5 3,-1.7 1,-0.1 6,-0.2 -0.360 67.6-131.5 -65.9 137.9 34.2 13.4 16.6 80 81 A D T 3 S+ 0 0 121 1,-0.3 -1,-0.1 5,-0.1 6,-0.1 0.672 103.1 69.2 -67.3 -16.3 31.4 11.3 18.1 81 82 A E T 3 S+ 0 0 76 4,-0.1 2,-0.3 5,-0.0 -1,-0.3 0.453 74.5 115.6 -77.4 -4.3 29.4 11.7 14.8 82 83 A R <> - 0 0 0 -3,-1.7 4,-1.6 1,-0.2 5,-0.1 -0.522 57.8-153.9 -70.7 128.1 32.0 9.5 12.9 83 84 A N H > S+ 0 0 1 -2,-0.3 4,-2.1 2,-0.2 5,-0.2 0.890 95.4 52.7 -62.8 -44.8 30.7 6.2 11.6 84 85 A D H > S+ 0 0 2 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.934 107.0 52.3 -61.8 -41.7 34.2 4.6 11.7 85 86 A K H > S+ 0 0 36 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.916 109.9 48.0 -61.0 -46.2 34.7 5.5 15.4 86 87 A Q H X S+ 0 0 54 -4,-1.6 4,-2.3 1,-0.2 -1,-0.2 0.885 112.6 48.8 -61.4 -38.9 31.3 4.0 16.4 87 88 A A H X>S+ 0 0 0 -4,-2.1 4,-2.0 2,-0.2 5,-1.9 0.867 110.3 52.3 -70.4 -33.6 32.1 0.8 14.5 88 89 A R H <>S+ 0 0 79 -4,-2.6 5,-2.5 3,-0.2 6,-0.3 0.948 112.4 43.8 -66.3 -45.7 35.5 0.6 16.1 89 90 A E H <5S+ 0 0 107 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.896 117.6 46.3 -68.2 -36.5 34.1 0.9 19.6 90 91 A A H <5S- 0 0 6 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.838 140.8 -29.6 -69.2 -39.0 31.3 -1.6 18.8 91 92 A L T ><5S+ 0 0 5 -4,-2.0 3,-2.0 -5,-0.2 -3,-0.2 0.523 117.7 70.2-145.9 -58.0 33.4 -4.2 17.2 92 93 A L G > - 0 0 43 0, 0.0 3,-1.9 0, 0.0 4,-0.3 -0.388 19.8-127.9 -58.0 136.2 45.0 -6.2 10.4 99 100 A P G > S+ 0 0 115 0, 0.0 3,-1.8 0, 0.0 -2,-0.0 0.830 108.3 66.0 -55.7 -29.9 44.7 -2.5 10.0 100 101 A V G 3 S+ 0 0 117 1,-0.3 -34,-0.0 3,-0.1 -3,-0.0 0.714 97.0 56.5 -62.2 -19.7 45.6 -2.9 6.3 101 102 A N G < S+ 0 0 13 -3,-1.9 -34,-2.9 -35,-0.1 2,-0.5 0.520 95.4 78.5 -83.2 -11.4 42.2 -4.8 5.9 102 103 A V B < -d 67 0A 14 -3,-1.8 2,-0.6 -4,-0.3 -34,-0.2 -0.908 59.8-170.7-110.0 122.0 40.2 -1.9 7.3 103 104 A H - 0 0 37 -36,-2.5 -34,-0.5 -2,-0.5 2,-0.2 -0.770 6.3-175.6-122.1 83.0 39.5 1.1 5.0 104 105 A A - 0 0 33 -2,-0.6 2,-0.1 -36,-0.1 3,-0.1 -0.472 30.3-114.3 -69.8 146.3 38.0 4.0 6.7 105 106 A M - 0 0 2 -2,-0.2 -21,-0.1 1,-0.1 -32,-0.1 -0.505 48.3 -85.8 -76.8 159.6 36.9 7.0 4.7 106 107 A A - 0 0 19 13,-0.3 2,-0.3 -2,-0.1 -31,-0.2 -0.136 34.9-137.4 -71.4 155.7 38.9 10.1 5.4 107 108 A A > - 0 0 1 -33,-0.1 3,-1.6 -3,-0.1 5,-0.4 -0.717 28.5-108.4-102.5 162.8 38.2 12.7 8.2 108 109 A S T 3 S+ 0 0 20 -33,-1.5 -34,-0.1 1,-0.3 7,-0.1 0.589 121.9 45.2 -72.5 -13.7 38.4 16.4 7.7 109 110 A D T 3 S+ 0 0 102 -34,-0.4 -1,-0.3 5,-0.1 5,-0.1 -0.060 107.0 92.4-108.5 26.2 41.7 16.6 9.8 110 111 A G S X S- 0 0 28 -3,-1.6 3,-2.1 3,-0.5 -4,-0.1 0.027 96.1 -43.0-105.1-153.3 43.1 13.6 8.0 111 112 A E T 3 S+ 0 0 171 1,-0.3 3,-0.1 3,-0.0 -3,-0.1 0.676 134.1 36.2 -47.4 -36.2 45.2 12.7 4.9 112 113 A F T > S- 0 0 65 1,-0.4 3,-1.4 -5,-0.4 -1,-0.3 0.200 99.7-137.1-107.5 10.0 43.6 15.2 2.5 113 114 A G T < - 0 0 33 -3,-2.1 -3,-0.5 1,-0.2 -1,-0.4 -0.358 67.8 -28.9 58.5-143.0 43.0 18.1 5.0 114 115 A D T 3 S+ 0 0 101 -5,-0.1 2,-1.1 -3,-0.1 -1,-0.2 0.146 100.8 122.5 -92.9 19.6 39.7 19.7 4.6 115 116 A D <> - 0 0 85 -3,-1.4 4,-2.1 1,-0.2 5,-0.1 -0.718 36.2-178.9 -90.1 98.8 39.4 18.9 0.8 116 117 A L H > S+ 0 0 16 -2,-1.1 4,-2.6 2,-0.2 5,-0.2 0.918 80.8 51.5 -62.8 -47.6 36.1 16.9 0.6 117 118 A E H > S+ 0 0 71 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.895 112.2 47.4 -58.8 -44.0 36.4 16.3 -3.2 118 119 A A H > S+ 0 0 31 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.895 110.8 51.6 -64.8 -41.9 40.0 15.0 -2.8 119 120 A A H X S+ 0 0 2 -4,-2.1 4,-1.7 1,-0.2 -13,-0.3 0.922 112.1 45.5 -64.0 -41.6 38.9 12.7 0.1 120 121 A A H X S+ 0 0 3 -4,-2.6 4,-2.3 2,-0.2 -1,-0.2 0.890 111.5 52.6 -66.2 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