==== 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 OXIDOREDUCTASE 05-JAN-07 2OG5 . COMPND 2 MOLECULE: PUTATIVE OXYGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOMYCES COELICOLOR; . AUTHOR L.O.ESSEN,M.STRIEKER . 315 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13815.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 198 62.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 7 2.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 55 17.5 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 . 1 0.3 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 . 15 4.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 71 22.5 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+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 0 0 1 0 0 0 1 1 1 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 3 2 4 1 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 0 ANTIPARALLEL BRIDGES PER LADDER . 2 1 0 1 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 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 10 A S > 0 0 123 0, 0.0 3,-1.6 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 133.3 -17.7 68.4 3.6 2 11 A R T 3 + 0 0 178 1,-0.3 3,-0.1 3,-0.1 55,-0.1 0.372 360.0 62.3 -75.4 6.7 -17.4 70.7 0.6 3 12 A Y T 3 S+ 0 0 40 1,-0.2 65,-1.8 64,-0.1 2,-0.3 0.236 100.5 54.4-109.7 10.3 -14.8 68.2 -0.7 4 13 A D E < S+a 68 0A 70 -3,-1.6 2,-0.5 63,-0.2 -1,-0.2 -0.831 74.0 178.5-142.6 98.6 -17.3 65.4 -1.0 5 14 A V E -a 69 0A 19 63,-2.6 65,-2.8 -2,-0.3 2,-0.6 -0.912 15.2-165.5-114.1 119.5 -20.3 66.5 -3.0 6 15 A T E -a 70 0A 97 -2,-0.5 65,-0.2 63,-0.2 2,-0.1 -0.910 26.9-126.1-100.2 123.8 -23.3 64.3 -3.8 7 16 A L - 0 0 12 63,-2.8 2,-0.1 -2,-0.6 62,-0.0 -0.447 22.6-126.7 -63.4 136.5 -25.5 65.8 -6.6 8 17 A D > - 0 0 92 -2,-0.1 4,-2.7 1,-0.1 5,-0.2 -0.375 32.2 -98.7 -76.9 168.3 -29.1 66.1 -5.6 9 18 A Q H > S+ 0 0 131 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.886 121.9 51.9 -59.6 -42.4 -31.7 64.5 -8.0 10 19 A S H > S+ 0 0 80 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.940 114.2 42.1 -59.2 -50.8 -32.5 67.7 -9.7 11 20 A D H > S+ 0 0 22 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.881 113.0 53.6 -65.4 -39.5 -28.9 68.6 -10.5 12 21 A A H X S+ 0 0 18 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.891 109.8 48.5 -62.2 -41.2 -28.1 65.0 -11.4 13 22 A E H X S+ 0 0 100 -4,-2.4 4,-2.2 -5,-0.2 -1,-0.2 0.883 111.3 49.6 -66.0 -39.3 -31.0 64.9 -13.9 14 23 A L H X S+ 0 0 57 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.939 111.7 47.0 -66.8 -46.9 -29.9 68.3 -15.5 15 24 A V H X S+ 0 0 0 -4,-2.5 4,-3.1 1,-0.2 5,-0.2 0.902 111.1 53.5 -62.7 -38.7 -26.2 67.2 -15.9 16 25 A E H X S+ 0 0 92 -4,-2.0 4,-2.5 -5,-0.2 -1,-0.2 0.927 110.0 47.3 -59.3 -46.3 -27.5 63.9 -17.4 17 26 A E H X S+ 0 0 135 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.922 114.6 46.3 -60.0 -46.4 -29.6 65.8 -20.0 18 27 A I H X S+ 0 0 17 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.916 113.3 48.6 -63.9 -45.0 -26.7 68.1 -20.8 19 28 A A H X S+ 0 0 0 -4,-3.1 4,-2.8 1,-0.2 -2,-0.2 0.906 112.0 48.3 -64.0 -43.1 -24.2 65.2 -21.1 20 29 A W H X S+ 0 0 88 -4,-2.5 4,-2.2 -5,-0.2 5,-0.3 0.899 110.6 51.3 -65.0 -41.1 -26.5 63.2 -23.4 21 30 A K H X>S+ 0 0 129 -4,-2.1 4,-2.4 -5,-0.2 5,-0.6 0.921 113.9 44.3 -61.0 -45.5 -27.2 66.2 -25.6 22 31 A L H X5S+ 0 0 11 -4,-2.3 4,-1.5 1,-0.2 -2,-0.2 0.954 114.8 48.5 -61.7 -49.6 -23.4 66.8 -26.0 23 32 A A H <5S+ 0 0 14 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.827 123.6 30.3 -61.8 -35.1 -22.6 63.1 -26.5 24 33 A T H <5S+ 0 0 97 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.736 127.8 33.2 -99.6 -26.6 -25.4 62.6 -29.2 25 34 A Q H <5S+ 0 0 132 -4,-2.4 -3,-0.2 -5,-0.3 -2,-0.1 0.719 85.8 101.4-107.4 -27.4 -25.7 65.9 -30.9 26 35 A A S < - 0 0 103 -2,-0.1 3,-2.8 63,-0.1 6,-0.4 -0.905 48.7 -86.2-139.4 161.3 -15.5 63.6 -31.7 30 39 A P T 3 S+ 0 0 1 0, 0.0 6,-0.1 0, 0.0 62,-0.1 0.685 122.0 52.0 -44.7 -37.7 -13.9 64.3 -28.3 31 40 A D T 3 S+ 0 0 46 60,-0.4 2,-0.3 4,-0.1 279,-0.2 0.612 90.5 98.3 -78.3 -8.4 -10.3 64.9 -29.6 32 41 A D S X> S- 0 0 56 -3,-2.8 4,-2.1 1,-0.1 3,-1.2 -0.571 79.1-130.4 -79.3 138.1 -11.6 67.5 -32.1 33 42 A A H 3> S+ 0 0 63 -2,-0.3 4,-2.5 1,-0.3 5,-0.1 0.863 108.1 57.9 -54.7 -35.6 -11.4 71.2 -31.2 34 43 A E H 3> S+ 0 0 98 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.806 106.7 47.9 -67.9 -27.9 -15.1 71.6 -32.2 35 44 A W H <> S+ 0 0 0 -3,-1.2 4,-2.4 -6,-0.4 -1,-0.2 0.885 110.1 50.9 -78.4 -41.2 -16.2 69.0 -29.7 36 45 A V H X S+ 0 0 0 -4,-2.1 4,-2.5 -7,-0.2 -2,-0.2 0.910 109.7 52.4 -60.8 -39.7 -14.1 70.5 -26.9 37 46 A E H X S+ 0 0 106 -4,-2.5 4,-2.4 -5,-0.2 -2,-0.2 0.915 108.5 49.3 -60.4 -44.1 -15.8 73.8 -27.8 38 47 A A H X S+ 0 0 28 -4,-1.7 4,-2.5 1,-0.2 -1,-0.2 0.898 111.0 51.1 -60.6 -38.8 -19.2 72.2 -27.5 39 48 A A H X S+ 0 0 0 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.906 108.4 51.2 -65.0 -42.5 -18.1 70.8 -24.2 40 49 A R H X S+ 0 0 67 -4,-2.5 4,-1.0 2,-0.2 -2,-0.2 0.941 113.1 45.0 -59.1 -47.9 -17.0 74.2 -23.0 41 50 A N H < S+ 0 0 106 -4,-2.4 3,-0.4 1,-0.2 4,-0.3 0.898 112.6 51.3 -63.1 -40.4 -20.3 75.7 -24.0 42 51 A A H >< S+ 0 0 18 -4,-2.5 3,-1.7 1,-0.2 4,-0.4 0.848 99.4 64.9 -68.6 -33.6 -22.3 72.8 -22.4 43 52 A W H >< S+ 0 0 11 -4,-2.3 3,-1.9 1,-0.3 -1,-0.2 0.904 95.6 59.0 -52.4 -41.0 -20.3 73.2 -19.1 44 53 A H T 3< S+ 0 0 114 -4,-1.0 -1,-0.3 -3,-0.4 -2,-0.2 0.609 95.8 62.5 -73.0 -7.9 -21.9 76.6 -18.7 45 54 A A T < S+ 0 0 56 -3,-1.7 -1,-0.3 -4,-0.3 -2,-0.2 0.540 81.4 110.1 -83.7 -12.2 -25.4 75.0 -18.8 46 55 A W S < S- 0 0 2 -3,-1.9 5,-0.0 -4,-0.4 -35,-0.0 -0.224 86.6 -81.8 -59.6 154.2 -24.6 73.1 -15.6 47 56 A P >> - 0 0 14 0, 0.0 4,-1.9 0, 0.0 3,-0.6 -0.297 35.1-124.4 -56.2 141.5 -26.4 74.0 -12.3 48 57 A A H 3> S+ 0 0 30 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.807 107.6 65.2 -57.5 -34.1 -24.8 77.0 -10.6 49 58 A T H 3> S+ 0 0 67 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.931 107.2 39.8 -54.0 -48.6 -24.4 75.0 -7.4 50 59 A L H <> S+ 0 0 2 -3,-0.6 4,-2.4 2,-0.2 5,-0.2 0.863 113.4 53.7 -73.4 -37.9 -21.9 72.6 -9.0 51 60 A R H X S+ 0 0 84 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.908 111.0 48.1 -62.8 -39.0 -20.1 75.4 -11.0 52 61 A R H X S+ 0 0 181 -4,-2.8 4,-2.1 2,-0.2 -2,-0.2 0.889 109.8 52.2 -65.9 -41.0 -19.7 77.2 -7.6 53 62 A D H X S+ 0 0 56 -4,-1.9 4,-2.0 -5,-0.2 -2,-0.2 0.927 112.4 44.7 -60.6 -46.8 -18.4 74.0 -5.9 54 63 A L H X S+ 0 0 2 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.902 111.8 52.6 -65.8 -42.5 -15.8 73.5 -8.7 55 64 A A H X S+ 0 0 59 -4,-2.3 4,-1.7 1,-0.2 -1,-0.2 0.869 108.8 51.1 -60.3 -37.0 -14.8 77.2 -8.6 56 65 A G H X S+ 0 0 41 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.913 110.4 48.3 -66.5 -42.0 -14.3 77.0 -4.9 57 66 A F H < S+ 0 0 3 -4,-2.0 -2,-0.2 2,-0.2 -1,-0.2 0.879 109.0 53.1 -64.3 -39.6 -12.1 73.9 -5.3 58 67 A R H < S+ 0 0 113 -4,-2.4 3,-0.2 1,-0.2 -1,-0.2 0.883 112.3 46.0 -63.6 -37.2 -10.0 75.6 -8.0 59 68 A R H < S+ 0 0 207 -4,-1.7 2,-0.3 1,-0.3 -2,-0.2 0.864 136.1 5.0 -72.9 -38.1 -9.4 78.5 -5.6 60 69 A D < - 0 0 77 -4,-2.1 -1,-0.3 -5,-0.1 -2,-0.1 -0.858 58.2-167.4-152.0 109.2 -8.6 76.3 -2.6 61 70 A S > - 0 0 2 -2,-0.3 5,-0.8 -3,-0.2 4,-0.4 0.445 43.8-134.7 -83.1 2.3 -8.3 72.5 -2.9 62 71 A G T > 5 - 0 0 4 3,-0.2 3,-1.1 1,-0.2 -1,-0.2 0.027 39.2 -46.0 77.4 179.3 -8.3 72.2 0.9 63 72 A P T 3 5S+ 0 0 57 0, 0.0 118,-0.3 0, 0.0 -1,-0.2 0.710 139.2 40.2 -63.9 -22.2 -6.2 70.2 3.3 64 73 A D T 3 5S- 0 0 43 -3,-0.3 -2,-0.2 2,-0.2 203,-0.1 0.456 98.0-135.4-103.6 -3.2 -6.4 66.9 1.2 65 74 A G T < 5S+ 0 0 0 -3,-1.1 202,-2.8 -4,-0.4 2,-0.3 0.829 70.8 91.2 56.8 36.1 -6.0 68.6 -2.2 66 75 A A E < - B 0 266A 12 -5,-0.8 2,-0.3 200,-0.2 200,-0.2 -0.992 52.1-163.7-158.3 152.8 -8.9 66.6 -3.7 67 76 A I E - B 0 265A 2 198,-2.1 198,-2.9 -2,-0.3 2,-0.4 -0.983 7.1-155.3-137.7 147.4 -12.6 66.5 -4.2 68 77 A V E -aB 4 264A 11 -65,-1.8 -63,-2.6 -2,-0.3 2,-0.4 -0.998 4.9-163.3-123.1 130.9 -15.1 63.8 -5.1 69 78 A L E -aB 5 263A 1 194,-2.5 194,-2.8 -2,-0.4 2,-0.4 -0.945 11.3-161.1-107.4 136.6 -18.4 64.4 -6.8 70 79 A R E +a 6 0A 83 -65,-2.8 -63,-2.8 -2,-0.4 192,-0.2 -0.940 62.1 38.6-121.9 140.1 -21.0 61.6 -6.7 71 80 A G + 0 0 39 190,-0.5 191,-0.2 -2,-0.4 -1,-0.2 0.620 68.5 152.2 100.8 17.5 -24.0 61.1 -8.9 72 81 A L - 0 0 6 189,-2.6 2,-0.3 -3,-0.2 -1,-0.3 -0.433 54.1 -91.6 -75.7 154.0 -22.7 62.1 -12.3 73 82 A P + 0 0 9 0, 0.0 2,-0.3 0, 0.0 26,-0.2 -0.506 50.4 164.8 -76.1 130.0 -24.2 60.4 -15.3 74 83 A V - 0 0 28 -2,-0.3 2,-1.8 186,-0.1 3,-0.2 -0.982 42.7-120.2-138.2 146.7 -22.7 57.2 -16.6 75 84 A D > + 0 0 57 -2,-0.3 4,-1.2 1,-0.2 3,-0.4 -0.420 43.9 162.1 -87.9 64.2 -24.3 54.8 -19.1 76 85 A S T 4 S+ 0 0 72 -2,-1.8 3,-0.3 1,-0.3 -1,-0.2 0.834 76.1 46.3 -55.4 -40.4 -24.3 51.7 -16.8 77 86 A M T 4 S+ 0 0 188 -3,-0.2 -1,-0.3 1,-0.2 -2,-0.1 0.856 118.8 42.7 -68.9 -36.0 -26.9 49.9 -18.9 78 87 A G T 4 S+ 0 0 45 -3,-0.4 -2,-0.2 -4,-0.0 -1,-0.2 0.480 86.0 119.4 -89.3 -4.6 -25.1 50.8 -22.1 79 88 A L < - 0 0 31 -4,-1.2 3,-0.1 -3,-0.3 -3,-0.0 -0.460 54.2-143.8 -69.5 126.2 -21.6 50.1 -20.9 80 89 A P - 0 0 70 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 -0.162 42.7 -64.0 -74.3 177.1 -19.7 47.4 -22.8 81 90 A P S S- 0 0 93 0, 0.0 204,-0.2 0, 0.0 203,-0.1 -0.274 70.1 -86.0 -58.0 149.6 -17.3 44.9 -21.2 82 91 A T - 0 0 8 202,-2.2 204,-0.1 -3,-0.1 202,-0.1 -0.392 51.4-108.7 -60.9 128.6 -14.2 46.6 -19.7 83 92 A P - 0 0 33 0, 0.0 -1,-0.1 0, 0.0 201,-0.1 -0.231 27.2-164.7 -58.0 152.0 -11.5 47.0 -22.4 84 93 A R + 0 0 108 2,-0.1 2,-0.3 -3,-0.1 -2,-0.1 0.039 51.9 97.6-132.1 22.9 -8.5 44.8 -22.0 85 94 A V S > S- 0 0 91 43,-0.1 3,-0.9 1,-0.0 2,-0.2 -0.849 74.2-110.8-113.9 149.0 -5.9 46.3 -24.3 86 95 A N T 3 S+ 0 0 91 -2,-0.3 -2,-0.1 1,-0.2 -1,-0.0 -0.517 102.0 28.6 -74.2 146.2 -3.0 48.7 -23.3 87 96 A G T 3 S+ 0 0 34 1,-0.2 -1,-0.2 -2,-0.2 2,-0.1 0.632 81.0 170.3 79.1 13.5 -3.4 52.2 -24.5 88 97 A S < + 0 0 16 -3,-0.9 36,-2.2 38,-0.1 2,-0.3 -0.371 6.5 170.1 -59.5 128.1 -7.2 52.1 -24.5 89 98 A V B -C 123 0A 32 34,-0.2 2,-1.0 -2,-0.1 34,-0.2 -0.933 40.3-110.0-139.1 165.2 -8.7 55.6 -25.1 90 99 A Q + 0 0 38 32,-2.8 32,-0.3 -2,-0.3 31,-0.1 -0.773 44.6 154.9-101.7 91.1 -12.1 57.1 -25.7 91 100 A R + 0 0 78 -2,-1.0 -60,-0.4 -61,-0.1 2,-0.2 0.754 55.8 72.5 -85.7 -30.3 -12.0 58.4 -29.3 92 101 A E S S- 0 0 113 -3,-0.2 5,-0.2 -63,-0.1 -63,-0.1 -0.576 96.7 -93.3 -86.4 152.8 -15.8 58.2 -29.9 93 102 A A + 0 0 34 -2,-0.2 2,-0.3 -65,-0.2 -1,-0.1 -0.348 60.2 153.6 -58.3 140.1 -18.4 60.5 -28.4 94 103 A S > - 0 0 27 1,-0.1 4,-2.1 -4,-0.1 5,-0.1 -0.975 58.2-101.1-162.5 166.5 -19.8 59.2 -25.2 95 104 A L H > S+ 0 0 9 -2,-0.3 4,-2.7 2,-0.2 5,-0.2 0.894 120.9 51.5 -62.5 -41.6 -21.4 60.1 -21.8 96 105 A G H > S+ 0 0 5 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.919 110.4 47.5 -63.4 -44.4 -18.0 59.7 -20.0 97 106 A A H > S+ 0 0 0 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.886 111.3 53.1 -61.0 -39.9 -16.2 61.9 -22.5 98 107 A A H X S+ 0 0 0 -4,-2.1 4,-2.2 2,-0.2 5,-0.3 0.958 110.8 45.0 -61.4 -52.2 -18.9 64.5 -22.2 99 108 A V H X S+ 0 0 0 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.938 117.2 44.7 -57.5 -48.7 -18.7 64.6 -18.4 100 109 A L H X S+ 0 0 0 -4,-2.4 4,-2.3 -5,-0.2 -2,-0.2 0.917 115.3 44.7 -65.9 -45.0 -14.9 64.7 -18.3 101 110 A L H X S+ 0 0 0 -4,-2.7 4,-2.0 2,-0.2 -1,-0.2 0.867 112.2 52.3 -75.3 -32.0 -14.4 67.3 -21.1 102 111 A M H X S+ 0 0 0 -4,-2.2 4,-1.2 -5,-0.3 -1,-0.2 0.967 112.8 45.4 -61.4 -48.8 -17.1 69.6 -19.7 103 112 A T H X S+ 0 0 0 -4,-2.1 4,-1.9 -5,-0.3 3,-0.4 0.894 109.7 54.9 -64.0 -39.6 -15.6 69.6 -16.3 104 113 A A H X S+ 0 0 0 -4,-2.3 4,-1.7 1,-0.2 -1,-0.2 0.910 107.2 50.5 -58.7 -42.2 -12.1 70.1 -17.7 105 114 A C H < S+ 0 0 13 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.724 108.9 53.0 -69.6 -23.7 -13.3 73.2 -19.5 106 115 A G H < S+ 0 0 29 -4,-1.2 -1,-0.2 -3,-0.4 -2,-0.2 0.836 115.8 37.8 -74.0 -37.5 -14.8 74.5 -16.2 107 116 A L H < S- 0 0 2 -4,-1.9 2,-0.2 -49,-0.0 -2,-0.2 0.663 137.5 -65.5 -86.9 -20.5 -11.6 74.1 -14.3 108 117 A G S < S- 0 0 14 -4,-1.7 188,-0.2 -5,-0.2 186,-0.0 -0.679 83.0 -47.2 171.4-114.8 -9.3 75.2 -17.1 109 118 A D E -D 295 0A 33 186,-1.6 186,-2.9 -2,-0.2 -4,-0.1 -0.981 52.6-106.3-143.4 153.1 -8.8 73.3 -20.3 110 119 A P E +D 294 0A 0 0, 0.0 2,-0.3 0, 0.0 184,-0.2 -0.432 42.0 174.8 -72.6 158.1 -8.3 69.6 -21.1 111 120 A G E -D 293 0A 1 182,-1.6 182,-0.7 10,-0.2 2,-0.3 -0.986 13.2-175.3-156.8 159.8 -4.8 68.5 -22.2 112 121 A A E -h 311 0B 0 198,-1.8 200,-3.2 -2,-0.3 2,-0.4 -0.948 25.9-114.4-152.3 170.7 -2.8 65.4 -23.1 113 122 A F E > -h 312 0B 2 3,-0.4 3,-2.1 -2,-0.3 6,-1.1 -0.941 17.9-135.6-118.0 128.6 0.7 64.4 -24.1 114 123 A L T 3 S+ 0 0 102 198,-2.6 4,-0.3 -2,-0.4 199,-0.1 0.860 103.6 51.1 -53.6 -43.1 1.5 62.9 -27.5 115 124 A P T 3 S+ 0 0 47 0, 0.0 2,-0.5 0, 0.0 -1,-0.3 0.516 102.7 68.7 -74.5 -1.4 3.8 60.2 -26.1 116 125 A E S X S- 0 0 33 -3,-2.1 3,-1.7 1,-0.1 -3,-0.4 -0.969 124.4 -19.6-123.6 117.3 1.3 59.0 -23.5 117 126 A K G > S- 0 0 30 -2,-0.5 3,-2.1 1,-0.3 -1,-0.1 0.838 115.1 -73.2 55.5 33.3 -2.0 57.2 -24.6 118 127 A N G 3 S- 0 0 123 -4,-0.3 -1,-0.3 1,-0.3 -4,-0.2 0.752 83.2 -68.0 53.7 29.9 -1.4 58.8 -28.1 119 128 A G G < S+ 0 0 1 -3,-1.7 -1,-0.3 -6,-1.1 -5,-0.2 0.611 84.0 163.8 71.3 13.8 -2.4 62.2 -26.8 120 129 A A < - 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