==== 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 OXIDOREDUCTASE 11-MAY-10 3MZ0 . COMPND 2 MOLECULE: INOSITOL 2-DEHYDROGENASE/D-CHIRO-INOSITOL 3-DEHYD . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; . AUTHOR K.E.VAN STRAATEN,D.R.J.PALMER,D.A.R.SANDERS . 337 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16426.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 245 72.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 34 10.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 37 11.0 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 . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.6 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 . 29 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 100 29.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 2.4 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 1 0 0 0 2 2 1 0 1 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 2 2 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 PARALLEL BRIDGES PER LADDER . 0 1 1 1 0 2 0 1 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 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 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 X 0 0 225 0, 0.0 2,-0.3 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 177.2 -6.2 13.8 -4.5 2 2 A S - 0 0 50 26,-0.1 2,-0.3 1,-0.0 26,-0.3 -0.685 360.0-108.8 -75.4 138.9 -3.4 16.2 -5.3 3 3 A L E -a 28 0A 10 24,-3.0 26,-2.5 -2,-0.3 2,-0.7 -0.584 34.3-132.2 -64.6 129.5 -3.5 17.4 -8.9 4 4 A R E -a 29 0A 72 -2,-0.3 64,-2.6 24,-0.2 65,-1.7 -0.805 27.9-167.4 -98.1 113.1 -0.6 15.6 -10.6 5 5 A I E -ab 30 69A 0 24,-3.0 26,-2.4 -2,-0.7 27,-1.2 -0.809 13.5-160.7-108.2 136.7 1.4 18.1 -12.6 6 6 A G E -ab 32 70A 0 63,-2.6 65,-2.4 -2,-0.4 2,-0.5 -0.884 14.2-143.6-107.8 148.2 4.1 17.6 -15.2 7 7 A V E -ab 33 71A 0 25,-2.2 27,-2.1 -2,-0.4 2,-0.7 -0.951 6.7-162.4-117.2 126.1 6.6 20.3 -16.2 8 8 A I E S+ab 34 72A 9 63,-3.0 65,-2.8 -2,-0.5 66,-0.4 -0.903 74.7 24.1-108.2 102.1 7.8 20.8 -19.7 9 9 A G - 0 0 4 25,-2.9 2,-0.2 -2,-0.7 26,-0.2 0.560 62.9-156.8 107.4 103.6 11.0 23.0 -19.5 10 10 A T + 0 0 6 4,-0.1 64,-0.1 -3,-0.1 25,-0.1 -0.338 49.8 118.1-110.2 52.5 13.0 23.1 -16.4 11 11 A G S > S- 0 0 37 62,-0.5 4,-2.7 -2,-0.2 5,-0.2 -0.073 87.5 -60.6 -90.7-159.1 14.8 26.4 -16.7 12 12 A A H > S+ 0 0 74 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.899 136.5 45.0 -55.1 -47.8 14.5 29.4 -14.3 13 13 A I H > S+ 0 0 90 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.935 114.4 47.4 -65.7 -47.1 10.8 29.9 -14.9 14 14 A G H > S+ 0 0 0 59,-0.5 4,-2.6 1,-0.2 -1,-0.2 0.903 111.2 52.9 -60.2 -41.6 9.9 26.2 -14.6 15 15 A K H X S+ 0 0 81 -4,-2.7 4,-2.7 1,-0.2 -1,-0.2 0.902 107.2 51.2 -62.2 -41.0 12.0 25.9 -11.4 16 16 A E H X S+ 0 0 96 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.891 112.0 46.5 -66.4 -38.3 10.2 28.8 -9.8 17 17 A H H X S+ 0 0 2 -4,-2.1 4,-2.6 2,-0.2 5,-0.2 0.903 111.3 52.0 -68.7 -38.6 6.8 27.3 -10.5 18 18 A I H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 5,-0.2 0.937 109.9 50.7 -59.7 -44.7 8.1 23.9 -9.3 19 19 A N H X S+ 0 0 48 -4,-2.7 4,-2.6 1,-0.2 5,-0.4 0.931 111.6 46.0 -59.8 -46.8 9.2 25.7 -6.1 20 20 A R H X>S+ 0 0 17 -4,-2.3 5,-2.4 1,-0.2 4,-2.0 0.929 115.1 46.1 -66.6 -39.8 5.8 27.4 -5.5 21 21 A I H <5S+ 0 0 5 -4,-2.6 7,-0.3 3,-0.2 -1,-0.2 0.916 120.3 39.9 -66.7 -38.0 3.8 24.2 -6.2 22 22 A T H <5S+ 0 0 55 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.819 132.6 18.7 -81.0 -33.6 6.1 22.1 -4.0 23 23 A N H <5S+ 0 0 108 -4,-2.6 -3,-0.2 -5,-0.2 -2,-0.2 0.505 130.8 27.3-121.2 -6.8 6.7 24.5 -1.1 24 24 A K T <5S+ 0 0 101 -4,-2.0 -3,-0.2 -5,-0.4 -4,-0.1 0.667 100.8 64.0-127.8 -35.0 4.1 27.2 -1.1 25 25 A L < - 0 0 36 -5,-2.4 2,-0.4 3,-0.1 3,-0.1 -0.391 67.0-118.8-102.5 175.7 0.7 26.2 -2.6 26 26 A S S S+ 0 0 81 1,-0.1 3,-0.1 -2,-0.1 263,-0.1 -0.889 75.8 18.1-117.1 139.5 -2.0 23.7 -1.9 27 27 A G S S+ 0 0 23 -2,-0.4 -24,-3.0 1,-0.2 2,-0.3 0.529 95.5 82.3 93.9 8.4 -3.4 20.7 -3.8 28 28 A A E -a 3 0A 15 -7,-0.3 2,-0.3 -26,-0.3 -24,-0.2 -0.969 47.3-164.5-143.4 158.1 -0.9 19.8 -6.4 29 29 A E E -a 4 0A 85 -26,-2.5 -24,-3.0 -2,-0.3 2,-0.7 -0.995 27.4-119.5-141.4 147.0 2.4 17.8 -6.8 30 30 A I E +a 5 0A 7 -2,-0.3 21,-0.4 -26,-0.2 -24,-0.2 -0.784 39.9 161.5 -86.0 113.4 5.1 17.6 -9.4 31 31 A V E + 0 0 23 -26,-2.4 22,-2.4 -2,-0.7 2,-0.3 0.510 60.4 24.5-110.2 -10.0 5.1 14.0 -10.7 32 32 A A E -ac 6 53A 0 -27,-1.2 -25,-2.2 20,-0.3 2,-0.3 -0.991 57.2-178.8-157.4 143.9 6.9 14.4 -14.0 33 33 A V E -ac 7 54A 0 20,-2.5 22,-3.0 -2,-0.3 2,-0.3 -0.980 1.5-176.5-140.7 156.5 9.4 16.7 -15.7 34 34 A T E +ac 8 55A 5 -27,-2.1 -25,-2.9 -2,-0.3 2,-0.3 -0.984 4.5 173.3-147.1 147.4 11.1 16.9 -19.1 35 35 A D - 0 0 35 20,-0.5 6,-0.1 -2,-0.3 7,-0.1 -0.981 43.9-117.3-145.9 154.1 13.8 19.3 -20.5 36 36 A V S S+ 0 0 153 -2,-0.3 2,-0.9 1,-0.2 3,-0.1 0.877 115.9 56.5 -55.1 -38.2 15.7 19.4 -23.8 37 37 A N S >> S- 0 0 89 1,-0.2 4,-1.6 -3,-0.1 3,-0.7 -0.835 76.0-169.2 -94.7 98.4 18.8 18.9 -21.5 38 38 A Q H 3> S+ 0 0 85 -2,-0.9 4,-2.2 1,-0.3 5,-0.2 0.849 84.5 59.3 -61.7 -34.1 17.9 15.7 -19.6 39 39 A E H 3> S+ 0 0 92 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.873 104.1 51.6 -60.3 -38.0 20.8 16.3 -17.2 40 40 A A H <> S+ 0 0 26 -3,-0.7 4,-2.1 2,-0.2 -1,-0.2 0.910 108.3 50.8 -65.6 -41.7 19.2 19.6 -16.2 41 41 A A H X S+ 0 0 0 -4,-1.6 4,-2.2 1,-0.2 -2,-0.2 0.889 109.8 50.3 -63.9 -39.6 15.9 17.9 -15.5 42 42 A Q H X S+ 0 0 65 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.914 109.0 51.4 -63.8 -43.4 17.5 15.3 -13.4 43 43 A K H X S+ 0 0 117 -4,-2.1 4,-3.2 1,-0.2 -2,-0.2 0.889 109.2 51.8 -59.6 -40.0 19.3 18.0 -11.4 44 44 A V H X S+ 0 0 8 -4,-2.1 4,-2.3 2,-0.2 6,-0.2 0.917 106.9 51.3 -64.5 -44.4 16.0 19.8 -10.8 45 45 A V H <>S+ 0 0 22 -4,-2.2 5,-2.4 1,-0.2 -1,-0.2 0.895 116.1 43.3 -58.4 -39.1 14.3 16.6 -9.5 46 46 A E H ><5S+ 0 0 140 -4,-2.0 3,-0.9 3,-0.2 -2,-0.2 0.920 111.9 51.3 -72.9 -45.6 17.2 16.3 -7.1 47 47 A Q H 3<5S+ 0 0 137 -4,-3.2 -2,-0.2 1,-0.3 -1,-0.2 0.857 118.8 36.8 -62.0 -37.9 17.5 19.9 -6.0 48 48 A Y T 3<5S- 0 0 40 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.359 106.3-126.1 -98.1 5.7 13.8 20.1 -5.2 49 49 A Q T < 5 + 0 0 178 -3,-0.9 -3,-0.2 -4,-0.2 2,-0.2 0.909 46.1 177.4 51.6 49.5 13.6 16.6 -3.8 50 50 A L < - 0 0 23 -5,-2.4 2,-1.0 -6,-0.2 -1,-0.2 -0.520 40.0-139.0 -84.3 149.4 10.7 15.7 -6.1 51 51 A N + 0 0 154 -21,-0.4 2,-0.4 -2,-0.2 -1,-0.1 -0.668 64.0 132.6 -97.1 73.1 9.1 12.3 -6.4 52 52 A A - 0 0 16 -2,-1.0 2,-0.3 -7,-0.1 -20,-0.3 -0.954 58.6-123.4-136.0 143.8 9.0 12.7 -10.2 53 53 A T E -c 32 0A 69 -22,-2.4 -20,-2.5 -2,-0.4 2,-0.6 -0.668 23.0-137.1 -82.7 135.7 9.8 10.8 -13.3 54 54 A V E -c 33 0A 37 -2,-0.3 -20,-0.2 -22,-0.2 -16,-0.0 -0.867 22.9-163.7 -92.9 119.4 12.2 12.4 -15.8 55 55 A Y E -c 34 0A 47 -22,-3.0 -20,-0.5 -2,-0.6 -14,-0.1 -0.793 23.3-133.3-103.9 147.9 10.9 11.9 -19.3 56 56 A P S S- 0 0 74 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.757 84.5 -2.5 -72.9 -22.1 13.1 12.4 -22.5 57 57 A N S > S- 0 0 70 -24,-0.1 4,-1.8 1,-0.1 5,-0.1 -0.954 75.5 -97.3-157.3 173.8 10.5 14.5 -24.2 58 58 A D H > S+ 0 0 20 -2,-0.3 4,-3.0 1,-0.2 5,-0.2 0.826 115.1 61.7 -70.8 -31.0 7.0 16.0 -24.0 59 59 A D H > S+ 0 0 88 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.945 108.6 42.0 -58.5 -46.7 5.4 13.2 -26.0 60 60 A S H > S+ 0 0 33 2,-0.2 4,-0.5 1,-0.2 -2,-0.2 0.894 115.0 50.7 -70.0 -37.5 6.4 10.6 -23.4 61 61 A L H >< S+ 0 0 0 -4,-1.8 3,-1.3 1,-0.2 -2,-0.2 0.929 110.5 49.3 -62.7 -44.9 5.5 12.8 -20.5 62 62 A L H 3< S+ 0 0 10 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.713 103.2 61.7 -69.5 -19.9 2.0 13.5 -22.0 63 63 A A H 3< S+ 0 0 80 -4,-1.1 2,-0.6 -5,-0.2 -1,-0.3 0.617 76.7 109.2 -79.1 -12.7 1.5 9.8 -22.5 64 64 A D X< - 0 0 25 -3,-1.3 3,-2.0 -4,-0.5 -3,-0.0 -0.533 61.5-154.3 -68.8 111.7 1.8 9.2 -18.7 65 65 A E T 3 S+ 0 0 167 -2,-0.6 -1,-0.2 1,-0.3 -4,-0.0 0.716 90.7 61.1 -61.7 -20.9 -1.8 8.4 -17.7 66 66 A N T 3 S+ 0 0 92 -35,-0.1 2,-0.5 2,-0.0 -1,-0.3 0.280 81.2 94.3 -97.1 11.9 -1.0 9.7 -14.2 67 67 A V < + 0 0 1 -3,-2.0 -62,-0.2 -6,-0.1 3,-0.1 -0.922 46.5 176.6 -98.4 124.0 -0.3 13.2 -15.3 68 68 A D + 0 0 45 -64,-2.6 24,-1.5 -2,-0.5 2,-0.3 0.770 64.3 6.1 -95.0 -32.5 -3.4 15.4 -15.1 69 69 A A E -bd 5 92A 0 -65,-1.7 -63,-2.6 22,-0.2 2,-0.3 -0.981 64.0-146.5-153.7 153.2 -2.0 18.8 -16.1 70 70 A V E -bd 6 93A 0 22,-2.6 24,-2.8 -2,-0.3 2,-0.5 -0.937 9.2-141.0-129.3 152.2 1.2 20.3 -17.4 71 71 A L E -bd 7 94A 0 -65,-2.4 -63,-3.0 -2,-0.3 2,-0.8 -0.940 15.2-151.0-102.5 132.3 3.1 23.6 -17.2 72 72 A V E +bd 8 95A 0 22,-3.2 24,-2.4 -2,-0.5 -63,-0.2 -0.898 38.0 145.3-105.3 105.5 4.7 24.7 -20.4 73 73 A T + 0 0 10 -65,-2.8 -62,-0.5 -2,-0.8 -59,-0.5 -0.068 30.4 119.6-133.8 26.6 7.8 26.7 -19.4 74 74 A S S S- 0 0 28 -66,-0.4 5,-0.1 1,-0.2 -65,-0.1 -0.075 79.8 -45.8 -80.1-173.8 10.2 25.8 -22.2 75 75 A W >> - 0 0 196 1,-0.1 3,-2.4 3,-0.1 4,-0.5 -0.335 65.2-114.3 -53.0 136.3 11.9 28.2 -24.6 76 76 A G G >4 S+ 0 0 19 1,-0.3 3,-1.8 2,-0.2 4,-0.4 0.860 113.8 51.9 -49.5 -50.4 9.3 30.6 -25.9 77 77 A P G 34 S+ 0 0 67 0, 0.0 -1,-0.3 0, 0.0 4,-0.3 0.657 107.0 57.6 -63.6 -12.0 9.2 29.5 -29.5 78 78 A A G <> S+ 0 0 36 -3,-2.4 4,-1.3 1,-0.1 -2,-0.2 0.507 83.3 85.9 -91.1 -7.4 8.8 25.9 -28.3 79 79 A H H S+ 0 0 29 -4,-0.4 4,-2.5 1,-0.2 5,-0.2 0.883 103.2 53.4 -52.5 -45.9 3.1 26.2 -29.2 81 81 A S H > S+ 0 0 62 -4,-0.3 4,-2.3 1,-0.2 -1,-0.2 0.925 112.0 43.9 -57.7 -46.5 4.2 22.6 -30.0 82 82 A S H X S+ 0 0 5 -4,-1.3 4,-2.4 -3,-0.3 -1,-0.2 0.866 111.2 54.1 -69.6 -36.2 3.7 21.4 -26.4 83 83 A V H X S+ 0 0 0 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.931 110.0 47.4 -63.0 -45.7 0.4 23.2 -25.9 84 84 A L H X S+ 0 0 24 -4,-2.5 4,-2.2 -5,-0.2 -2,-0.2 0.931 112.7 49.1 -60.7 -45.7 -1.0 21.5 -29.1 85 85 A K H X S+ 0 0 56 -4,-2.3 4,-1.8 -5,-0.2 -1,-0.2 0.895 111.0 50.3 -61.3 -38.9 0.3 18.1 -27.9 86 86 A A H <>S+ 0 0 0 -4,-2.4 5,-2.7 2,-0.2 4,-0.3 0.881 108.8 51.1 -68.0 -39.0 -1.2 18.6 -24.4 87 87 A I H ><5S+ 0 0 5 -4,-2.2 3,-1.3 3,-0.2 -1,-0.2 0.937 111.2 48.4 -62.2 -45.7 -4.6 19.6 -25.9 88 88 A K H 3<5S+ 0 0 144 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.839 111.0 50.4 -63.1 -33.0 -4.6 16.4 -28.0 89 89 A A T 3<5S- 0 0 37 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.451 114.9-122.2 -82.6 -1.0 -3.6 14.4 -25.0 90 90 A Q T < 5 + 0 0 155 -3,-1.3 2,-0.4 -4,-0.3 -3,-0.2 0.887 62.0 143.2 59.9 43.7 -6.5 16.0 -23.1 91 91 A K < - 0 0 22 -5,-2.7 -1,-0.2 -6,-0.1 -22,-0.2 -0.869 56.1-111.6-106.3 147.5 -4.4 17.5 -20.3 92 92 A Y E -d 69 0A 36 -24,-1.5 -22,-2.6 -2,-0.4 2,-0.4 -0.491 39.8-155.2 -67.2 146.5 -5.0 20.9 -18.7 93 93 A V E -de 70 121A 0 27,-3.1 29,-2.8 -24,-0.2 2,-0.6 -0.986 22.4-164.0-138.2 130.2 -2.2 23.2 -19.6 94 94 A F E -de 71 122A 0 -24,-2.8 -22,-3.2 -2,-0.4 2,-0.5 -0.962 23.2-167.0-104.7 117.5 -0.7 26.3 -18.0 95 95 A C E -de 72 123A 0 27,-3.1 29,-2.8 -2,-0.6 -22,-0.1 -0.928 14.0-139.8-114.6 120.4 1.4 28.0 -20.6 96 96 A E - 0 0 17 -24,-2.4 29,-0.1 -2,-0.5 -22,-0.1 -0.332 57.0 -44.4 -65.5 155.7 3.9 30.8 -19.9 97 97 A K S S+ 0 0 42 27,-0.3 -1,-0.1 2,-0.1 2,-0.1 -0.393 115.8 47.7 -65.9 144.2 3.9 33.6 -22.4 98 98 A P - 0 0 34 0, 0.0 3,-0.1 0, 0.0 -19,-0.1 0.611 56.9-165.4 -89.6 160.1 3.9 33.5 -25.3 99 99 A L S S- 0 0 4 1,-0.3 2,-0.3 206,-0.2 -16,-0.2 0.904 84.3 -18.9 -63.7 -40.6 1.1 31.0 -26.2 100 100 A A - 0 0 4 205,-0.2 -1,-0.3 -21,-0.1 6,-0.1 -0.958 65.3-114.6-159.9 163.1 2.7 31.0 -29.6 101 101 A T S S+ 0 0 75 -2,-0.3 2,-0.3 -24,-0.2 3,-0.1 0.588 95.2 34.9 -83.8 -10.3 5.0 33.3 -31.6 102 102 A T S > S- 0 0 43 1,-0.1 4,-2.0 211,-0.0 5,-0.2 -0.940 80.9-114.4-138.3 160.6 2.5 34.3 -34.2 103 103 A A H > S+ 0 0 19 -2,-0.3 4,-2.4 206,-0.2 5,-0.2 0.901 118.4 56.0 -57.8 -41.5 -1.2 35.0 -34.6 104 104 A E H > S+ 0 0 124 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.887 105.6 49.8 -59.9 -42.4 -1.4 31.9 -36.8 105 105 A G H > S+ 0 0 0 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.885 110.7 49.7 -64.8 -39.9 0.1 29.6 -34.1 106 106 A C H X S+ 0 0 0 -4,-2.0 4,-2.7 1,-0.2 -2,-0.2 0.898 108.5 53.6 -64.1 -39.9 -2.3 30.9 -31.5 107 107 A X H X S+ 0 0 36 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.850 103.9 55.8 -64.4 -34.3 -5.2 30.3 -34.0 108 108 A R H X S+ 0 0 122 -4,-1.8 4,-1.7 2,-0.2 -1,-0.2 0.915 110.6 45.1 -61.1 -41.9 -4.0 26.7 -34.4 109 109 A I H X S+ 0 0 0 -4,-1.5 4,-2.4 2,-0.2 -2,-0.2 0.932 111.8 52.2 -67.1 -44.7 -4.3 26.3 -30.6 110 110 A V H X S+ 0 0 2 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.921 107.8 51.7 -56.1 -46.9 -7.7 28.0 -30.5 111 111 A E H X S+ 0 0 115 -4,-2.7 4,-1.0 1,-0.2 -1,-0.2 0.906 112.8 44.7 -59.8 -43.4 -9.1 25.7 -33.2 112 112 A E H X S+ 0 0 57 -4,-1.7 4,-0.7 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