==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER BIOSYNTHETIC PROTEIN 09-MAR-05 1WZU . COMPND 2 MOLECULE: QUINOLINATE SYNTHETASE A; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS HORIKOSHII; . AUTHOR H.SAKURABA . 271 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13729.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 191 70.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 40 14.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.7 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 . 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 . 20 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 9.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 96 35.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 1 2 1 1 2 3 1 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 4 3 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 . 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 1 A M 0 0 162 0, 0.0 2,-0.9 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 169.5 43.5 30.3 -11.5 2 2 A D > - 0 0 84 1,-0.2 4,-2.1 2,-0.1 5,-0.2 -0.830 360.0-171.0 -98.4 100.5 44.3 30.5 -7.8 3 3 A L H > S+ 0 0 47 -2,-0.9 4,-2.8 1,-0.2 5,-0.2 0.874 81.9 54.1 -57.7 -43.6 41.0 30.1 -6.0 4 4 A V H > S+ 0 0 59 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.939 112.0 43.6 -58.6 -49.4 42.3 30.9 -2.5 5 5 A E H > S+ 0 0 81 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.850 114.5 50.6 -65.7 -35.2 43.8 34.2 -3.7 6 6 A E H X S+ 0 0 52 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.904 110.8 48.3 -69.5 -41.1 40.7 35.1 -5.7 7 7 A I H X S+ 0 0 0 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.898 109.6 53.5 -65.7 -39.0 38.5 34.4 -2.7 8 8 A L H X S+ 0 0 81 -4,-2.2 4,-1.4 -5,-0.2 -1,-0.2 0.911 110.6 46.2 -62.8 -41.8 40.7 36.5 -0.5 9 9 A R H X S+ 0 0 166 -4,-1.9 4,-2.6 1,-0.2 -2,-0.2 0.931 114.0 48.0 -66.2 -44.7 40.5 39.4 -2.9 10 10 A L H X S+ 0 0 24 -4,-2.4 4,-3.1 1,-0.2 5,-0.3 0.827 103.8 60.6 -66.5 -32.5 36.7 39.1 -3.2 11 11 A K H X>S+ 0 0 32 -4,-2.4 5,-2.7 2,-0.2 4,-0.8 0.920 111.8 40.3 -59.7 -43.0 36.2 38.8 0.6 12 12 A E H <5S+ 0 0 140 -4,-1.4 3,-0.2 3,-0.2 -2,-0.2 0.932 115.5 50.6 -69.9 -48.1 37.7 42.3 0.9 13 13 A E H <5S+ 0 0 140 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.888 121.4 33.9 -57.9 -42.3 35.9 43.7 -2.2 14 14 A R H <5S- 0 0 83 -4,-3.1 -1,-0.2 -5,-0.1 -2,-0.2 0.553 104.7-127.6 -90.2 -8.8 32.5 42.4 -1.0 15 15 A N T <5 + 0 0 71 -4,-0.8 36,-2.2 -5,-0.3 37,-1.7 0.987 56.7 158.0 55.5 60.2 33.3 43.0 2.7 16 16 A A E < -a 52 0A 11 -5,-2.7 2,-0.4 35,-0.2 37,-0.2 -0.772 38.9-151.7-117.5 160.2 32.3 39.4 3.4 17 17 A I E -a 53 0A 8 35,-2.2 37,-2.8 -2,-0.3 2,-0.6 -0.956 15.9-139.0-126.5 145.3 32.9 36.8 6.1 18 18 A I E -a 54 0A 0 -2,-0.4 15,-3.4 35,-0.2 16,-1.2 -0.937 17.4-171.4-111.5 117.1 32.9 33.1 5.4 19 19 A L E -ab 55 34A 0 35,-2.2 37,-2.9 -2,-0.6 2,-0.4 -0.909 7.4-165.8-108.4 134.3 31.2 30.9 8.0 20 20 A A E -ab 56 35A 0 14,-3.0 16,-2.0 -2,-0.5 37,-0.2 -0.964 14.8-133.6-123.6 146.0 31.5 27.1 7.8 21 21 A H E > - b 0 36A 24 35,-2.6 3,-1.9 -2,-0.4 16,-0.2 -0.468 33.6-108.2 -85.6 160.0 29.7 24.2 9.4 22 22 A N T 3 S+ 0 0 0 14,-1.4 194,-0.2 1,-0.3 -1,-0.1 0.678 115.7 58.8 -58.9 -23.6 31.6 21.3 10.8 23 23 A Y T 3 S+ 0 0 52 190,-0.1 -1,-0.3 193,-0.1 189,-0.2 0.519 80.9 115.6 -88.5 -1.6 30.5 19.0 8.0 24 24 A Q S < S- 0 0 22 -3,-1.9 192,-0.1 32,-0.2 215,-0.1 -0.259 78.2 -88.4 -67.0 154.5 32.0 21.1 5.2 25 25 A L >> - 0 0 40 213,-0.5 4,-2.7 1,-0.1 3,-1.0 -0.255 36.7-112.8 -60.1 148.4 34.8 19.9 3.0 26 26 A P H 3> S+ 0 0 55 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.870 118.7 56.1 -50.3 -40.4 38.4 20.5 4.3 27 27 A E H 3> S+ 0 0 85 1,-0.2 4,-0.6 2,-0.2 212,-0.1 0.849 110.9 43.9 -63.6 -33.5 39.0 22.9 1.4 28 28 A V H X> S+ 0 0 0 -3,-1.0 4,-0.9 210,-0.2 3,-0.7 0.895 112.5 50.7 -77.8 -41.9 35.9 24.9 2.5 29 29 A Q H >< S+ 0 0 15 -4,-2.7 3,-0.6 1,-0.2 -2,-0.2 0.890 105.1 59.1 -63.1 -35.6 36.8 24.8 6.2 30 30 A D H 3< S+ 0 0 101 -4,-2.6 -1,-0.2 -5,-0.3 -2,-0.2 0.760 108.8 43.6 -64.7 -25.0 40.3 26.0 5.4 31 31 A I H << S+ 0 0 17 -3,-0.7 -1,-0.2 -4,-0.6 -2,-0.2 0.584 93.4 108.0 -96.7 -10.1 39.0 29.2 3.7 32 32 A A << - 0 0 19 -4,-0.9 -13,-0.2 -3,-0.6 3,-0.1 -0.247 62.6-146.8 -69.5 152.6 36.4 30.0 6.4 33 33 A D S S+ 0 0 74 -15,-3.4 2,-0.3 1,-0.3 -14,-0.2 0.610 90.3 11.6 -89.5 -16.2 36.7 32.8 8.9 34 34 A F E -b 19 0A 62 -16,-1.2 -14,-3.0 2,-0.0 2,-0.4 -0.938 64.8-166.4-162.8 136.7 34.9 30.6 11.5 35 35 A I E +b 20 0A 37 -2,-0.3 2,-0.3 -16,-0.2 -14,-0.2 -0.981 32.1 112.3-127.4 140.0 33.9 27.0 11.7 36 36 A G E -b 21 0A 0 -16,-2.0 -14,-1.4 -2,-0.4 2,-0.1 -0.974 58.7 -67.4-178.5-171.0 31.5 25.4 14.2 37 37 A D > - 0 0 7 -2,-0.3 4,-2.6 -16,-0.2 5,-0.2 -0.278 64.0 -82.9 -90.2-176.9 28.1 23.8 14.9 38 38 A S H > S+ 0 0 17 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.878 128.4 46.5 -58.2 -41.6 24.7 25.4 14.5 39 39 A L H > S+ 0 0 11 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.945 114.0 47.9 -65.5 -48.0 24.7 27.2 17.8 40 40 A E H > S+ 0 0 39 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.884 113.6 49.0 -60.3 -37.7 28.3 28.4 17.4 41 41 A L H X S+ 0 0 0 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.860 108.3 52.2 -71.2 -35.9 27.4 29.7 13.9 42 42 A A H X S+ 0 0 1 -4,-2.1 4,-0.9 -5,-0.2 -2,-0.2 0.899 111.6 48.3 -66.4 -38.7 24.2 31.5 15.1 43 43 A R H < S+ 0 0 142 -4,-2.2 3,-0.5 1,-0.2 -2,-0.2 0.909 111.4 48.2 -66.9 -43.0 26.3 33.2 17.8 44 44 A R H < S+ 0 0 73 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.846 111.3 51.9 -66.4 -33.1 29.0 34.2 15.3 45 45 A A H >< S+ 0 0 0 -4,-2.0 3,-1.6 -5,-0.1 -1,-0.2 0.659 83.4 110.0 -78.2 -17.5 26.4 35.5 12.9 46 46 A T T 3< S- 0 0 28 -4,-0.9 3,-0.1 -3,-0.5 23,-0.1 -0.378 99.5 -6.6 -61.6 134.4 24.7 37.7 15.5 47 47 A R T 3 S- 0 0 218 21,-0.4 -1,-0.3 1,-0.1 22,-0.1 0.881 101.4-145.4 44.4 44.7 25.3 41.4 14.8 48 48 A V < - 0 0 10 -3,-1.6 2,-0.7 1,-0.1 -1,-0.1 0.044 11.4-134.6 -44.4 142.0 27.6 40.2 12.1 49 49 A D S S+ 0 0 105 -3,-0.1 2,-0.3 3,-0.0 -1,-0.1 -0.425 78.7 61.2 -97.2 53.9 30.8 42.2 11.4 50 50 A A S S- 0 0 6 -2,-0.7 -34,-0.2 1,-0.1 3,-0.1 -0.964 77.0-124.8-166.0 163.9 30.5 42.2 7.6 51 51 A D S S+ 0 0 82 -36,-2.2 22,-2.3 -2,-0.3 2,-0.4 0.737 99.1 37.3 -87.2 -25.3 28.1 43.4 4.8 52 52 A V E -ac 16 73A 5 -37,-1.7 -35,-2.2 20,-0.2 2,-0.5 -0.986 64.1-159.6-132.8 137.0 28.0 39.9 3.4 53 53 A I E -ac 17 74A 0 20,-2.9 22,-3.3 -2,-0.4 2,-0.8 -0.962 5.2-159.9-114.7 119.3 27.9 36.4 4.9 54 54 A V E -ac 18 75A 0 -37,-2.8 -35,-2.2 -2,-0.5 2,-0.9 -0.896 18.5-158.2 -95.4 111.4 28.9 33.5 2.7 55 55 A F E -a 19 0A 1 20,-3.4 2,-1.5 -2,-0.8 -35,-0.2 -0.795 12.0-167.7-100.9 101.0 27.3 30.6 4.6 56 56 A A E +a 20 0A 0 -37,-2.9 -35,-2.6 -2,-0.9 2,-0.3 -0.685 59.0 71.7 -87.0 89.0 28.8 27.2 3.9 57 57 A G S S- 0 0 7 -2,-1.5 2,-0.1 -37,-0.2 -2,-0.1 -0.920 91.0 -38.4-173.1-168.3 26.2 25.0 5.5 58 58 A V >> - 0 0 71 -2,-0.3 4,-1.6 1,-0.1 3,-1.2 -0.380 56.8-110.8 -74.4 152.6 22.7 23.7 5.1 59 59 A D H 3> S+ 0 0 100 1,-0.3 4,-1.9 2,-0.2 5,-0.2 0.839 113.4 56.6 -50.1 -44.2 19.9 26.0 3.8 60 60 A F H 3> S+ 0 0 29 1,-0.2 4,-1.1 2,-0.2 -1,-0.3 0.790 108.5 47.1 -65.4 -26.4 18.0 26.2 7.0 61 61 A M H <> S+ 0 0 6 -3,-1.2 4,-1.9 2,-0.2 -1,-0.2 0.794 107.7 54.5 -84.2 -28.4 21.0 27.5 8.9 62 62 A A H X S+ 0 0 0 -4,-1.6 4,-1.8 1,-0.2 -2,-0.2 0.879 108.1 52.4 -67.9 -34.5 21.9 30.1 6.3 63 63 A E H X S+ 0 0 43 -4,-1.9 4,-3.2 2,-0.2 -2,-0.2 0.882 104.6 55.0 -64.8 -39.9 18.3 31.3 6.8 64 64 A T H X S+ 0 0 0 -4,-1.1 4,-2.0 1,-0.2 -1,-0.2 0.916 107.9 48.7 -59.2 -43.7 18.9 31.5 10.5 65 65 A A H X S+ 0 0 1 -4,-1.9 4,-0.9 1,-0.2 -1,-0.2 0.873 113.1 48.3 -64.3 -36.4 21.9 33.8 9.8 66 66 A K H >< S+ 0 0 21 -4,-1.8 3,-0.6 2,-0.2 6,-0.2 0.917 108.1 52.9 -69.5 -44.7 19.6 35.9 7.4 67 67 A I H 3< S+ 0 0 1 -4,-3.2 -2,-0.2 1,-0.2 -1,-0.2 0.899 111.1 48.8 -56.9 -39.5 16.8 36.1 10.0 68 68 A L H 3< S+ 0 0 15 -4,-2.0 -21,-0.4 1,-0.3 -1,-0.2 0.701 120.9 35.5 -74.8 -20.7 19.4 37.4 12.5 69 69 A N X< + 0 0 9 -4,-0.9 3,-2.1 -3,-0.6 -1,-0.3 -0.538 65.3 165.3-133.2 69.0 20.8 40.0 10.0 70 70 A P T 3 S+ 0 0 62 0, 0.0 -1,-0.1 0, 0.0 186,-0.1 0.784 79.4 50.8 -55.1 -30.1 17.8 41.3 7.9 71 71 A D T 3 S+ 0 0 160 -3,-0.1 2,-0.3 2,-0.1 -5,-0.0 0.269 100.7 80.3 -93.9 12.4 19.8 44.2 6.6 72 72 A K S < S- 0 0 58 -3,-2.1 2,-0.5 -6,-0.2 -20,-0.2 -0.832 83.1-111.9-117.2 156.5 22.8 42.1 5.5 73 73 A V E -c 52 0A 44 -22,-2.3 -20,-2.9 -2,-0.3 2,-0.5 -0.758 30.3-167.1 -88.9 125.0 23.4 40.0 2.4 74 74 A V E -c 53 0A 0 -2,-0.5 180,-3.0 180,-0.4 2,-0.4 -0.962 4.1-167.8-116.3 121.4 23.5 36.2 3.1 75 75 A L E -cD 54 253A 0 -22,-3.3 -20,-3.4 -2,-0.5 178,-0.2 -0.897 12.0-159.8-111.9 135.9 24.8 33.9 0.4 76 76 A I - 0 0 20 176,-2.3 -20,-0.1 -2,-0.4 -22,-0.1 -0.967 17.3-142.6-111.0 123.9 24.5 30.1 0.3 77 77 A P 0 0 4 0, 0.0 -1,-0.1 0, 0.0 162,-0.1 0.755 360.0 360.0 -57.0 -27.7 27.1 28.6 -2.1 78 78 A S 0 0 96 174,-0.1 160,-0.1 160,-0.1 -19,-0.0 -0.936 360.0 360.0-140.6 360.0 24.7 25.9 -3.3 79 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 80 91 A V >> 0 0 67 0, 0.0 4,-1.5 0, 0.0 3,-0.7 0.000 360.0 360.0 360.0 -47.1 3.1 23.5 9.1 81 92 A E H 3> + 0 0 113 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.859 360.0 60.9 -64.7 -35.4 -0.4 22.3 9.6 82 93 A H H 3> S+ 0 0 149 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.773 102.5 52.6 -63.0 -26.6 0.8 19.5 11.8 83 94 A I H <> S+ 0 0 13 -3,-0.7 4,-2.0 2,-0.2 -1,-0.2 0.938 109.4 46.1 -74.9 -48.4 2.2 22.1 14.2 84 95 A L H X S+ 0 0 55 -4,-1.5 4,-2.1 1,-0.2 -2,-0.2 0.898 112.9 51.6 -60.7 -40.4 -1.0 24.1 14.6 85 96 A E H X S+ 0 0 79 -4,-2.4 4,-1.6 1,-0.2 -1,-0.2 0.915 109.6 48.3 -63.5 -43.1 -2.9 20.8 15.0 86 97 A A H X S+ 0 0 8 -4,-1.6 4,-1.0 1,-0.2 -1,-0.2 0.850 111.5 52.5 -64.7 -32.8 -0.5 19.7 17.8 87 98 A K H < S+ 0 0 71 -4,-2.0 -2,-0.2 2,-0.2 -1,-0.2 0.853 106.2 52.1 -71.2 -36.4 -0.9 23.1 19.3 88 99 A R H < S+ 0 0 135 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.816 111.7 46.7 -69.8 -30.5 -4.7 22.8 19.3 89 100 A K H < S+ 0 0 136 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.706 126.7 30.8 -82.1 -21.2 -4.5 19.5 21.1 90 101 A Y S >< S+ 0 0 69 -4,-1.0 3,-0.8 -5,-0.2 -1,-0.3 -0.622 70.4 169.6-137.4 73.4 -2.0 21.0 23.5 91 102 A P T 3 S+ 0 0 87 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.762 80.5 42.8 -56.1 -31.4 -2.9 24.7 23.9 92 103 A N T 3 S+ 0 0 153 2,-0.1 35,-0.2 -4,-0.1 37,-0.1 0.595 88.8 103.9 -95.2 -12.2 -0.5 25.3 26.8 93 104 A A S < S- 0 0 5 -3,-0.8 37,-0.2 -6,-0.2 2,-0.1 -0.528 72.2-124.9 -74.8 130.6 2.5 23.3 25.5 94 105 A P - 0 0 21 0, 0.0 37,-2.4 0, 0.0 2,-0.6 -0.465 22.3-123.9 -73.1 146.9 5.3 25.5 24.2 95 106 A V E -e 131 0B 0 35,-0.2 15,-2.4 -2,-0.1 16,-1.5 -0.839 25.8-169.7 -97.4 120.2 6.5 24.7 20.7 96 107 A V E -ef 132 111B 0 35,-3.7 37,-1.8 -2,-0.6 2,-0.5 -0.939 3.2-167.4-111.9 118.8 10.2 23.9 20.3 97 108 A L E -ef 133 112B 4 14,-1.8 16,-1.9 -2,-0.5 4,-0.1 -0.915 19.6-129.6-112.8 130.9 11.6 23.7 16.8 98 109 A Y E - f 0 113B 7 35,-2.9 16,-0.2 -2,-0.5 8,-0.0 -0.423 28.7-118.2 -67.0 144.2 15.0 22.2 15.9 99 110 A V S S+ 0 0 2 14,-2.4 2,-2.7 1,-0.2 -1,-0.1 0.755 103.2 88.2 -59.3 -21.7 17.0 24.7 13.7 100 111 A N S S+ 0 0 44 13,-0.3 2,-0.3 -39,-0.0 -1,-0.2 -0.473 79.0 84.8 -75.4 71.2 16.9 21.9 11.1 101 112 A S S S- 0 0 16 -2,-2.7 -4,-0.0 -4,-0.1 5,-0.0 -0.973 85.9 -77.2-163.1 165.9 13.5 23.3 9.8 102 113 A T > - 0 0 75 -2,-0.3 4,-1.9 1,-0.1 5,-0.1 -0.261 35.2-119.9 -70.8 159.2 12.1 26.0 7.5 103 114 A A H > S+ 0 0 5 1,-0.2 4,-1.2 2,-0.2 -1,-0.1 0.880 116.6 57.1 -64.3 -36.5 11.9 29.7 8.4 104 115 A E H 4 S+ 0 0 94 1,-0.2 4,-0.4 2,-0.2 3,-0.3 0.902 106.1 48.4 -61.2 -41.1 8.1 29.4 8.1 105 116 A A H >4 S+ 0 0 12 1,-0.2 3,-1.7 2,-0.2 4,-0.2 0.889 106.0 57.2 -66.7 -39.0 8.0 26.6 10.7 106 117 A K H >< S+ 0 0 0 -4,-1.9 3,-1.5 1,-0.3 -1,-0.2 0.784 94.2 68.4 -62.4 -26.3 10.2 28.7 13.0 107 118 A A T 3< S+ 0 0 19 -4,-1.2 -1,-0.3 -3,-0.3 -2,-0.2 0.729 100.4 48.8 -65.1 -20.7 7.5 31.4 12.8 108 119 A Y T < S+ 0 0 89 -3,-1.7 -1,-0.3 -4,-0.4 2,-0.2 0.405 96.1 98.2 -97.3 -0.5 5.2 29.0 14.7 109 120 A A < - 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