==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 15-JAN-98 1A23 . COMPND 2 MOLECULE: DSBA; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR H.J.SCHIRRA,C.RENNER,M.CZISCH,M.HUBER-WUNDERLICH,T.A.HOLAK, . 189 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11312.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 133 70.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 5 2.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 11 5.8 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 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 . 14 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 15 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 76 40.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 3.2 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 0 0 0 2 0 1 1 0 0 1 0 2 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 0 1 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 A 0 0 100 0, 0.0 2,-0.6 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 130.1 124.4 15.5 -0.3 2 2 A Q - 0 0 123 1,-0.4 0, 0.0 5,-0.0 0, 0.0 -0.872 360.0 -13.7-123.5 89.8 127.7 14.6 -1.8 3 3 A Y - 0 0 36 -2,-0.6 -1,-0.4 1,-0.1 0, 0.0 0.846 63.4-176.8 80.5 105.4 130.1 14.3 1.1 4 4 A E - 0 0 131 -3,-0.2 -1,-0.1 0, 0.0 6,-0.0 -0.296 59.7 -80.6-125.8 50.3 128.8 15.9 4.4 5 5 A D S S+ 0 0 100 1,-0.2 5,-0.3 4,-0.1 -2,-0.0 0.950 123.9 23.9 52.9 90.9 131.8 15.5 6.7 6 6 A G S S+ 0 0 37 3,-1.6 4,-0.3 0, 0.0 -1,-0.2 0.130 105.9 81.7 112.8 -19.0 131.6 11.8 8.0 7 7 A K S S- 0 0 149 2,-0.4 3,-0.1 1,-0.0 -5,-0.0 0.968 120.0 -6.8 -79.8 -68.8 129.5 10.4 5.0 8 8 A Q S S+ 0 0 39 1,-0.3 154,-1.6 153,-0.1 2,-0.3 0.670 144.5 19.6-100.2 -22.1 132.3 9.9 2.4 9 9 A Y E -A 161 0A 22 152,-0.3 -3,-1.6 153,-0.1 -2,-0.4 -0.887 64.6-167.3-154.8 119.8 135.2 11.5 4.3 10 10 A T E -A 160 0A 44 150,-1.6 150,-2.2 -2,-0.3 2,-0.3 -0.604 28.2-109.9-101.1 163.4 135.6 12.2 8.0 11 11 A T E -A 159 0A 52 -2,-0.2 148,-0.2 148,-0.2 2,-0.2 -0.747 26.6-127.0 -97.9 143.1 138.2 14.5 9.6 12 12 A L - 0 0 28 146,-1.4 133,-0.0 -2,-0.3 -1,-0.0 -0.544 5.3-139.7 -84.7 153.8 141.1 13.1 11.7 13 13 A E S S+ 0 0 190 1,-0.2 -1,-0.1 -2,-0.2 -2,-0.0 0.695 97.7 48.1 -83.0 -20.3 141.8 14.4 15.2 14 14 A K S S- 0 0 133 131,-0.1 -1,-0.2 2,-0.0 2,-0.1 -0.883 76.3-165.3-125.6 101.0 145.6 14.2 14.4 15 15 A P - 0 0 83 0, 0.0 2,-0.6 0, 0.0 143,-0.2 -0.415 15.8-133.6 -79.5 157.9 146.7 15.7 11.1 16 16 A V > - 0 0 37 141,-2.3 3,-2.6 140,-0.3 2,-0.1 -0.892 12.1-139.8-119.9 104.9 150.2 14.9 9.6 17 17 A A T 3 S+ 0 0 109 -2,-0.6 140,-0.1 1,-0.3 139,-0.0 -0.387 96.1 20.0 -60.2 127.4 152.2 17.9 8.3 18 18 A G T 3 S+ 0 0 84 1,-0.2 -1,-0.3 138,-0.1 139,-0.1 0.229 93.6 151.3 93.6 -14.7 153.9 16.7 5.1 19 19 A A < - 0 0 9 -3,-2.6 2,-0.2 137,-0.3 -1,-0.2 0.008 54.8 -91.7 -45.4 158.6 151.4 13.8 4.8 20 20 A P > - 0 0 28 0, 0.0 136,-1.7 0, 0.0 137,-0.8 -0.542 26.6-121.6 -78.9 140.1 150.6 12.6 1.3 21 21 A Q T 3 S+ 0 0 47 134,-0.3 35,-0.2 1,-0.3 2,-0.1 0.702 110.6 20.3 -53.0 -20.0 147.6 14.2 -0.6 22 22 A V E 3 S-b 56 0A 2 33,-1.9 35,-1.5 133,-0.2 2,-0.7 -0.556 75.4-171.0-153.2 80.4 146.2 10.6 -0.8 23 23 A L E < -bC 57 154A 6 131,-4.2 131,-2.4 -3,-0.7 2,-0.5 -0.652 15.4-159.3 -76.4 112.8 147.7 8.2 1.7 24 24 A E E -bC 58 153A 11 33,-3.7 35,-4.1 -2,-0.7 2,-0.5 -0.829 6.9-164.9-100.1 132.2 146.3 4.8 0.6 25 25 A F E +bC 59 152A 1 127,-3.0 127,-1.8 -2,-0.5 2,-0.3 -0.958 24.7 142.5-118.3 119.2 146.2 1.9 3.1 26 26 A F - 0 0 9 33,-2.2 35,-0.3 -2,-0.5 2,-0.3 -0.984 26.4-159.0-155.8 143.6 145.7 -1.7 1.9 27 27 A S > - 0 0 1 -2,-0.3 2,-1.2 33,-0.2 3,-0.8 -0.776 34.5-111.5-118.5 167.1 147.1 -5.2 2.8 28 28 A F T 3 S+ 0 0 4 -2,-0.3 32,-0.0 1,-0.2 -2,-0.0 -0.375 107.4 70.2 -91.7 53.1 147.3 -8.5 0.8 29 29 A F T 3 S+ 0 0 43 -2,-1.2 -1,-0.2 68,-0.1 3,-0.0 0.273 76.0 89.6-151.0 7.2 144.6 -9.9 3.2 30 30 A C S <> S- 0 0 20 -3,-0.8 4,-0.8 1,-0.1 5,-0.1 -0.738 71.0-129.1-112.4 164.7 141.3 -8.1 2.4 31 31 A P H > S+ 0 0 81 0, 0.0 4,-1.3 0, 0.0 -1,-0.1 0.848 115.7 45.2 -77.2 -34.3 138.5 -9.0 -0.1 32 32 A H H > S+ 0 0 59 2,-0.2 4,-3.4 1,-0.2 5,-0.4 0.905 96.1 79.0 -73.7 -39.8 138.6 -5.4 -1.5 33 33 A C H > S+ 0 0 5 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.850 106.5 29.5 -29.6 -63.6 142.5 -5.6 -1.6 34 34 A Y H X>S+ 0 0 71 -4,-0.8 4,-1.9 1,-0.2 5,-0.9 0.966 121.3 50.9 -66.3 -55.7 142.3 -7.7 -4.8 35 35 A Q H <>S+ 0 0 83 -4,-1.3 5,-1.8 1,-0.2 7,-0.4 0.718 113.1 50.4 -58.1 -19.0 139.1 -6.2 -6.1 36 36 A F H <5S+ 0 0 6 -4,-3.4 7,-1.4 4,-0.2 -1,-0.2 0.847 124.7 23.8 -87.2 -40.5 140.7 -2.7 -5.5 37 37 A E H <5S+ 0 0 34 -4,-1.8 -2,-0.2 -5,-0.4 -3,-0.1 0.286 134.7 31.6-109.1 8.3 144.0 -3.3 -7.3 38 38 A E T <5S+ 0 0 70 -4,-1.9 -3,-0.2 -5,-0.1 -4,-0.1 0.639 127.5 13.0-132.6 -40.8 143.0 -6.1 -9.8 39 39 A V T + 0 0 101 -6,-0.3 4,-3.7 1,-0.1 5,-0.3 0.734 44.4 148.8 59.1 18.8 140.9 -0.8 -11.0 42 42 A I H > S+ 0 0 2 -7,-0.4 4,-0.9 1,-0.2 -5,-0.1 0.773 72.2 48.9 -55.9 -23.0 139.9 1.9 -8.4 43 43 A S H > S+ 0 0 3 -7,-1.4 4,-1.1 2,-0.2 -1,-0.2 0.918 118.6 34.7 -82.8 -48.0 143.7 2.3 -7.8 44 44 A D H > S+ 0 0 98 1,-0.2 4,-1.1 2,-0.2 -2,-0.2 0.792 115.7 58.8 -76.3 -28.6 144.8 2.7 -11.5 45 45 A N H X S+ 0 0 64 -4,-3.7 4,-0.7 2,-0.2 3,-0.2 0.897 104.7 48.0 -69.5 -40.3 141.5 4.5 -12.4 46 46 A V H >< S+ 0 0 8 -4,-0.9 3,-1.0 -5,-0.3 -1,-0.2 0.894 104.0 62.4 -68.7 -35.4 142.1 7.4 -9.9 47 47 A K H >< S+ 0 0 112 -4,-1.1 3,-2.1 1,-0.3 -1,-0.2 0.882 94.3 62.3 -55.6 -38.4 145.7 7.7 -11.2 48 48 A K H 3< S+ 0 0 179 -4,-1.1 -1,-0.3 1,-0.3 -2,-0.2 0.875 109.9 40.7 -54.9 -37.1 144.2 8.6 -14.6 49 49 A K T << S+ 0 0 110 -3,-1.0 -1,-0.3 -4,-0.7 -2,-0.2 -0.068 87.1 113.0-103.2 33.3 142.7 11.7 -12.9 50 50 A L < - 0 0 38 -3,-2.1 2,-0.1 6,-0.0 3,-0.1 -0.802 50.2-165.7-108.3 92.7 145.8 12.5 -10.7 51 51 A P > - 0 0 79 0, 0.0 3,-1.8 0, 0.0 -2,-0.1 -0.436 43.4 -73.5 -75.3 149.0 147.1 15.9 -12.0 52 52 A E T 3 S+ 0 0 210 1,-0.2 3,-0.1 -2,-0.1 0, 0.0 -0.143 123.6 45.4 -44.3 120.2 150.7 17.0 -10.9 53 53 A G T 3 S+ 0 0 56 1,-0.1 2,-1.0 -3,-0.1 -1,-0.2 0.088 83.0 101.9 127.2 -19.8 150.3 18.0 -7.2 54 54 A V < - 0 0 17 -3,-1.8 2,-1.1 -34,-0.1 -1,-0.1 -0.789 58.5-158.2 -98.5 97.2 148.2 15.1 -5.9 55 55 A K - 0 0 144 -2,-1.0 -33,-1.9 -3,-0.1 2,-1.0 -0.615 7.7-168.7 -77.4 99.3 150.7 12.7 -4.1 56 56 A M E -b 22 0A 24 -2,-1.1 2,-0.4 -35,-0.2 -33,-0.2 -0.773 9.4-177.5 -93.2 102.1 148.9 9.3 -4.2 57 57 A T E -b 23 0A 34 -35,-1.5 -33,-3.7 -2,-1.0 2,-0.5 -0.796 13.8-157.1-101.4 142.1 150.9 7.1 -1.8 58 58 A K E +b 24 0A 39 -2,-0.4 2,-0.3 -35,-0.2 -33,-0.2 -0.961 19.0 178.0-120.2 113.6 150.0 3.4 -1.2 59 59 A Y E -b 25 0A 22 -35,-4.1 -33,-2.2 -2,-0.5 2,-0.3 -0.793 25.4-119.2-118.1 161.3 151.2 1.9 2.1 60 60 A H - 0 0 1 -2,-0.3 2,-0.2 -35,-0.2 82,-0.2 -0.713 24.0-133.8 -98.5 146.3 150.9 -1.5 3.8 61 61 A V - 0 0 0 -2,-0.3 3,-0.1 -35,-0.3 78,-0.1 -0.636 6.5-156.4 -96.3 156.6 149.2 -2.0 7.2 62 62 A N S S+ 0 0 40 -2,-0.2 8,-0.1 1,-0.1 3,-0.1 -0.272 72.8 87.1-127.5 48.2 150.5 -4.1 10.1 63 63 A F + 0 0 93 6,-0.1 -1,-0.1 1,-0.1 -2,-0.0 -0.419 61.6 89.7-140.7 57.2 147.2 -4.9 11.9 64 64 A M S S- 0 0 71 -3,-0.1 -1,-0.1 0, 0.0 4,-0.1 -0.261 110.4 -16.0-151.5 54.6 146.1 -8.1 10.1 65 65 A G S S- 0 0 70 -3,-0.1 2,-0.2 3,-0.1 -3,-0.0 -0.221 74.6-132.8 141.5 -46.3 147.6 -11.1 11.9 66 66 A G S S+ 0 0 48 1,-0.2 -1,-0.1 0, 0.0 5,-0.0 -0.149 93.6 56.8 92.3 -39.9 150.3 -9.7 14.1 67 67 A D S > S+ 0 0 135 -2,-0.2 4,-1.0 3,-0.1 3,-0.2 0.922 126.1 5.1 -87.5 -80.2 152.9 -12.3 13.1 68 68 A L H > S+ 0 0 6 35,-0.3 4,-3.2 1,-0.2 5,-0.2 0.759 121.9 71.2 -79.4 -21.9 153.4 -12.4 9.2 69 69 A G H > S+ 0 0 1 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.902 101.2 46.7 -59.2 -37.7 151.1 -9.3 8.8 70 70 A K H > S+ 0 0 82 -3,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.926 115.7 43.6 -69.9 -43.8 153.9 -7.3 10.4 71 71 A D H X S+ 0 0 37 -4,-1.0 4,-0.9 1,-0.2 -2,-0.2 0.820 108.2 59.8 -71.8 -27.8 156.5 -8.9 8.1 72 72 A L H X S+ 0 0 0 -4,-3.2 4,-1.6 2,-0.2 -1,-0.2 0.864 100.5 55.2 -69.4 -29.3 154.1 -8.6 5.2 73 73 A T H X S+ 0 0 8 -4,-1.3 4,-1.4 1,-0.3 3,-0.4 0.958 104.7 52.3 -64.9 -43.1 154.3 -4.8 5.8 74 74 A Q H X S+ 0 0 23 -4,-1.5 4,-3.5 1,-0.2 5,-0.3 0.806 101.0 65.0 -60.6 -23.3 158.1 -5.3 5.5 75 75 A A H X S+ 0 0 1 -4,-0.9 4,-2.9 2,-0.2 5,-0.4 0.957 96.6 52.5 -64.0 -48.7 157.1 -7.0 2.2 76 76 A W H X S+ 0 0 1 -4,-1.6 4,-1.6 -3,-0.4 -1,-0.2 0.865 117.0 40.8 -55.8 -34.8 155.7 -3.6 0.8 77 77 A A H X S+ 0 0 0 -4,-1.4 4,-1.6 2,-0.2 -2,-0.2 0.941 116.8 45.3 -79.4 -50.4 159.2 -2.1 1.7 78 78 A V H X S+ 0 0 0 -4,-3.5 4,-1.1 2,-0.2 6,-0.2 0.795 119.6 44.2 -64.8 -26.8 161.4 -5.0 0.6 79 79 A A H X>S+ 0 0 2 -4,-2.9 4,-1.5 -5,-0.3 5,-1.4 0.946 111.1 49.6 -82.9 -52.7 159.3 -5.3 -2.7 80 80 A M H <5S+ 0 0 88 -4,-1.6 -2,-0.2 -5,-0.4 -3,-0.1 0.809 108.9 59.3 -54.6 -26.0 159.1 -1.5 -3.5 81 81 A A H <5S+ 0 0 31 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.935 119.3 24.5 -68.8 -47.1 162.9 -1.7 -2.9 82 82 A L H <5S- 0 0 65 -4,-1.1 -2,-0.2 -3,-0.5 -1,-0.2 0.321 104.1-122.2 -99.9 6.5 163.5 -4.2 -5.7 83 83 A G T <5S+ 0 0 56 -4,-1.5 3,-0.2 1,-0.1 4,-0.2 0.761 76.5 129.0 59.2 21.2 160.4 -3.3 -7.7 84 84 A V >< + 0 0 10 -5,-1.4 4,-3.1 -6,-0.2 5,-0.4 0.382 34.2 102.7 -88.1 6.0 159.5 -7.0 -7.2 85 85 A E H > S+ 0 0 32 -6,-0.5 4,-3.3 1,-0.2 5,-0.3 0.973 79.4 48.8 -49.8 -66.6 156.0 -6.0 -5.9 86 86 A D H > S+ 0 0 131 -3,-0.2 4,-0.8 1,-0.2 -1,-0.2 0.800 117.0 45.8 -43.7 -35.3 154.2 -6.9 -9.2 87 87 A K H 4 S+ 0 0 124 -3,-0.3 -1,-0.2 -4,-0.2 -2,-0.2 0.950 121.8 31.6 -78.6 -53.1 156.0 -10.2 -9.2 88 88 A V H X S+ 0 0 1 -4,-3.1 4,-1.1 1,-0.2 -2,-0.2 0.635 110.8 69.0 -82.2 -11.4 155.5 -11.3 -5.5 89 89 A T H X S+ 0 0 7 -4,-3.3 4,-5.1 -5,-0.4 5,-0.4 0.926 95.8 52.9 -71.8 -44.4 152.1 -9.6 -5.3 90 90 A V H X S+ 0 0 71 -4,-0.8 4,-2.4 -5,-0.3 5,-0.3 0.968 117.0 36.5 -56.1 -55.9 150.4 -12.1 -7.8 91 91 A P H 4 S+ 0 0 46 0, 0.0 4,-0.5 0, 0.0 -1,-0.2 0.734 123.4 47.1 -70.1 -19.3 151.5 -15.1 -5.8 92 92 A L H X S+ 0 0 0 -4,-1.1 4,-1.6 2,-0.2 -2,-0.2 0.899 112.9 46.0 -85.5 -45.1 150.9 -13.1 -2.5 93 93 A F H X S+ 0 0 1 -4,-5.1 4,-1.0 1,-0.2 3,-0.3 0.953 120.8 39.4 -62.3 -48.0 147.5 -11.7 -3.5 94 94 A E H X S+ 0 0 108 -4,-2.4 4,-0.9 -5,-0.4 -1,-0.2 0.764 112.5 59.0 -72.5 -25.0 146.3 -15.1 -4.7 95 95 A G H 4>S+ 0 0 9 -4,-0.5 5,-1.0 -5,-0.3 7,-0.7 0.795 111.4 38.9 -75.8 -27.9 148.1 -16.8 -1.7 96 96 A V H <5S+ 0 0 15 -4,-1.6 -1,-0.2 -3,-0.3 -2,-0.2 0.610 122.3 41.8 -96.0 -15.1 146.1 -14.9 0.9 97 97 A Q H <5S+ 0 0 61 -4,-1.0 -2,-0.2 -5,-0.2 -3,-0.1 0.427 123.5 30.0-112.6 1.8 142.7 -15.0 -0.9 98 98 A K T <5S+ 0 0 172 -4,-0.9 -1,-0.1 -5,-0.1 -2,-0.1 -0.138 131.9 17.1-152.5 47.4 142.6 -18.6 -2.2 99 99 A T T 5S- 0 0 82 -3,-0.1 -3,-0.2 -4,-0.1 -4,-0.1 0.095 72.8-142.0-179.3 -48.6 144.6 -20.8 0.2 100 100 A Q < + 0 0 140 -5,-1.0 -4,-0.1 1,-0.1 -5,-0.1 0.663 65.7 123.8 70.9 18.0 145.1 -19.0 3.6 101 101 A T + 0 0 81 -6,-0.7 2,-1.4 1,-0.2 3,-0.2 0.548 48.0 90.7 -82.8 -6.7 148.6 -20.6 3.7 102 102 A I + 0 0 6 -7,-0.7 -1,-0.2 1,-0.2 3,-0.1 -0.619 49.3 107.5 -90.1 79.1 149.9 -17.0 4.0 103 103 A R + 0 0 175 -2,-1.4 2,-0.3 1,-0.1 -35,-0.3 0.056 63.9 67.0-142.0 25.8 150.0 -16.7 7.9 104 104 A S S >> S- 0 0 39 -3,-0.2 4,-1.8 -37,-0.1 3,-1.7 -0.976 74.8-131.2-150.2 133.8 153.8 -16.9 8.6 105 105 A A H 3> S+ 0 0 36 -2,-0.3 4,-1.3 1,-0.3 5,-0.1 0.875 114.4 60.8 -51.8 -33.5 156.6 -14.4 7.8 106 106 A S H 3> S+ 0 0 76 1,-0.2 4,-1.5 2,-0.2 -1,-0.3 0.869 101.7 51.8 -62.9 -33.6 158.4 -17.6 6.6 107 107 A D H X> S+ 0 0 8 -3,-1.7 4,-1.8 2,-0.2 3,-0.6 0.967 102.8 56.6 -67.4 -49.8 155.5 -17.9 4.0 108 108 A I H 3X S+ 0 0 0 -4,-1.8 4,-1.7 1,-0.3 -1,-0.2 0.830 107.5 52.3 -49.5 -30.2 156.0 -14.3 2.8 109 109 A R H 3X S+ 0 0 119 -4,-1.3 4,-3.3 -5,-0.3 5,-0.3 0.887 101.0 58.9 -74.2 -39.6 159.6 -15.4 2.1 110 110 A D H <>S+ 0 0 0 -4,-1.7 5,-1.4 -5,-0.3 3,-1.0 0.946 112.2 44.3 -61.4 -47.8 159.5 -13.5 -2.3 113 113 A I H ><5S+ 0 0 74 -4,-3.3 3,-1.8 1,-0.2 -1,-0.2 0.783 102.4 68.7 -68.0 -25.7 162.0 -16.2 -3.2 114 114 A N H 3<5S+ 0 0 132 -4,-1.2 -1,-0.2 -5,-0.3 -2,-0.2 0.794 95.5 55.2 -64.4 -25.8 159.6 -17.5 -5.9 115 115 A A T <<5S- 0 0 21 -3,-1.0 -1,-0.3 -4,-0.8 -2,-0.2 0.347 129.1 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