==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDASE 28-JUN-05 2BVG . COMPND 2 MOLECULE: 6-HYDROXY-D-NICOTINE OXIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ARTHROBACTER NICOTINOVORANS; . AUTHOR J.W.A.KOETTER,G.E.SCHULZ . 1812 4 2 0 2 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 69813.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1259 69.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 28 1.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 320 17.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 8 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.2 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 . 4 0.2 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 . 127 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 216 11.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 436 24.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 24 1.3 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 4 8 0 0 4 0 16 0 0 8 4 4 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 0 4 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 . 12 8 8 12 8 12 0 4 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 . 4 0 4 4 0 0 4 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 5 A K 0 0 138 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -22.4 69.4 32.9 59.8 2 6 A L - 0 0 49 2,-0.1 889,-0.1 1,-0.1 0, 0.0 -0.245 360.0 -79.3 -63.1 148.0 71.0 34.9 56.9 3 7 A A S S+ 0 0 38 1,-0.3 -1,-0.1 887,-0.3 888,-0.1 0.572 133.6 18.0 -17.4 -32.6 74.8 34.6 56.4 4 8 A T S S- 0 0 91 888,-0.0 -1,-0.3 0, 0.0 3,-0.2 -0.571 98.6-143.7-148.8 76.9 75.1 37.1 59.3 5 9 A P - 0 0 75 0, 0.0 2,-0.5 0, 0.0 -2,-0.0 0.312 28.8 -84.3 -38.1 163.8 71.8 37.1 61.3 6 10 A L - 0 0 17 1,-0.0 2,-0.6 47,-0.0 6,-0.1 -0.637 43.3-162.2 -77.6 124.5 70.2 40.1 62.9 7 11 A S + 0 0 99 -2,-0.5 2,-0.3 -3,-0.2 4,-0.1 -0.923 22.2 153.9-115.5 111.1 71.7 40.7 66.4 8 12 A I - 0 0 17 -2,-0.6 4,-0.1 2,-0.4 32,-0.0 -0.915 58.7-106.9-131.8 158.3 69.7 43.0 68.7 9 13 A Q S S+ 0 0 30 -2,-0.3 987,-0.1 34,-0.1 988,-0.1 0.725 110.4 51.8 -54.0 -21.8 69.3 43.4 72.5 10 14 A G S S- 0 0 14 33,-0.1 -2,-0.4 1,-0.1 2,-0.4 -0.032 102.0 -83.4 -97.8-156.4 65.9 41.8 71.9 11 15 A E E -A 40 0A 130 29,-0.9 29,-0.6 -4,-0.1 2,-0.2 -0.894 29.7-151.1-116.8 146.7 64.9 38.6 70.1 12 16 A V E -A 39 0A 26 -2,-0.4 2,-0.3 27,-0.2 27,-0.2 -0.680 10.7-151.0-106.7 165.9 64.4 38.0 66.4 13 17 A I E -A 38 0A 27 25,-1.2 25,-1.3 -2,-0.2 -2,-0.0 -0.840 3.5-158.4-149.2 111.7 62.0 35.4 65.0 14 18 A Y - 0 0 28 -2,-0.3 6,-0.3 23,-0.2 3,-0.2 -0.415 36.0-101.2 -84.5 158.2 62.2 33.6 61.7 15 19 A P S S+ 0 0 58 0, 0.0 6,-0.3 0, 0.0 -1,-0.1 0.817 120.4 42.8 -42.7 -49.3 59.2 31.9 59.9 16 20 A D S S+ 0 0 160 4,-0.1 4,-0.0 3,-0.0 -3,-0.0 0.896 91.2 109.1 -71.3 -39.8 60.0 28.3 61.0 17 21 A D S S- 0 0 77 -3,-0.2 3,-0.4 2,-0.1 -4,-0.1 0.239 85.0 -90.9 -33.8 156.9 60.8 29.3 64.6 18 22 A S S S+ 0 0 134 1,-0.2 3,-0.3 2,-0.1 -5,-0.0 0.895 109.7 16.3 -39.1 -89.3 58.3 28.3 67.3 19 23 A G S > S+ 0 0 37 1,-0.2 4,-1.9 2,-0.1 3,-0.4 0.353 83.0 123.5 -77.5 2.0 55.7 31.0 67.9 20 24 A F H >> S+ 0 0 9 -3,-0.4 4,-3.6 -6,-0.3 3,-1.4 0.808 73.7 48.3 -24.9 -78.8 56.2 33.1 64.7 21 25 A D H 3> S+ 0 0 107 -6,-0.3 4,-3.0 -3,-0.3 -1,-0.2 0.855 109.6 52.3 -32.7 -62.3 52.5 32.9 63.4 22 26 A A H 34 S+ 0 0 81 -3,-0.4 -1,-0.3 1,-0.2 -2,-0.2 0.884 120.9 36.0 -44.2 -44.6 51.1 33.9 66.8 23 27 A I H << S+ 0 0 31 -4,-1.9 -2,-0.3 -3,-1.4 -1,-0.2 0.946 115.2 52.9 -74.8 -53.9 53.5 36.9 66.6 24 28 A A H < S+ 0 0 4 -4,-3.6 -2,-0.2 -5,-0.2 -3,-0.2 0.759 88.2 108.2 -54.2 -29.4 53.3 37.5 62.9 25 29 A N < - 0 0 81 -4,-3.0 2,-0.1 -5,-0.4 9,-0.0 -0.247 47.9-172.0 -60.5 133.7 49.5 37.7 63.0 26 30 A I - 0 0 16 2,-0.3 42,-0.1 5,-0.2 41,-0.1 -0.226 34.6 -97.1-106.1-162.0 47.8 41.0 62.7 27 31 A W S S+ 0 0 73 40,-1.9 278,-0.4 42,-0.2 41,-0.2 0.943 94.1 61.6 -88.6 -57.2 44.1 42.0 63.1 28 32 A D - 0 0 5 39,-0.5 -2,-0.3 41,-0.3 279,-0.2 -0.116 65.5-146.5 -69.3 170.7 42.5 42.0 59.7 29 33 A G S S+ 0 0 21 279,-0.1 278,-0.2 277,-0.1 -1,-0.1 0.880 80.0 73.9-103.2 -58.5 42.2 39.0 57.4 30 34 A R S S+ 0 0 74 278,-0.2 2,-1.1 1,-0.1 -1,-0.1 0.683 83.5 84.7 -30.8 -31.3 42.5 39.9 53.7 31 35 A H + 0 0 31 1,-0.2 -5,-0.2 2,-0.0 -1,-0.1 -0.691 46.9 156.5 -88.8 99.4 46.3 40.4 54.3 32 36 A L + 0 0 142 -2,-1.1 -1,-0.2 2,-0.1 44,-0.1 0.878 35.7 106.3 -86.3 -47.3 47.9 37.0 53.9 33 37 A Q - 0 0 73 42,-0.1 44,-0.2 1,-0.1 -2,-0.0 0.133 52.4-161.4 -35.7 149.1 51.4 38.0 53.0 34 38 A R - 0 0 60 1,-0.1 44,-2.1 41,-0.1 -1,-0.1 -0.968 16.2-112.5-138.6 153.8 54.0 37.6 55.8 35 39 A P - 0 0 10 0, 0.0 44,-0.2 0, 0.0 45,-0.2 0.115 22.3-124.8 -67.7-166.2 57.5 39.0 56.4 36 40 A S S S+ 0 0 33 43,-2.0 2,-0.2 1,-0.5 44,-0.1 -0.001 89.5 4.4-132.5 22.2 60.6 36.8 56.4 37 41 A L - 0 0 0 42,-0.3 44,-1.1 -23,-0.1 -1,-0.5 -0.634 63.5-143.6 162.7 143.9 61.8 37.8 59.9 38 42 A I E -Ab 13 81A 2 -25,-1.3 -25,-1.2 -2,-0.2 2,-1.1 -0.980 4.7-156.0-130.1 121.1 60.4 39.8 62.8 39 43 A A E -A 12 0A 0 42,-2.0 2,-2.3 -2,-0.5 -27,-0.2 -0.633 5.8-160.0 -97.5 77.2 62.7 41.9 65.1 40 44 A R E -A 11 0A 41 -2,-1.1 -29,-0.9 -29,-0.6 44,-0.2 -0.298 27.8-151.6 -57.4 83.1 60.8 42.3 68.3 41 45 A C - 0 0 0 -2,-2.3 45,-0.4 42,-0.8 46,-0.2 -0.142 26.4-168.3 -61.1 156.8 62.8 45.3 69.3 42 46 A L - 0 0 24 1,-0.4 2,-0.3 44,-0.1 -1,-0.1 0.302 67.9 -1.3-125.2 -3.8 63.6 46.3 72.8 43 47 A S S >> S- 0 0 13 1,-0.1 4,-1.9 44,-0.0 3,-0.6 -0.939 82.4 -81.5 179.5 160.4 65.0 49.8 72.2 44 48 A A H 3> S+ 0 0 9 -2,-0.3 4,-2.3 1,-0.3 5,-0.2 0.837 124.1 58.2 -35.1 -48.7 66.0 52.5 69.8 45 49 A G H 3> S+ 0 0 2 1,-0.3 4,-2.1 2,-0.2 5,-0.3 0.944 102.8 48.1 -52.5 -57.5 69.2 50.5 69.3 46 50 A D H <> S+ 0 0 0 -3,-0.6 4,-1.6 1,-0.2 -1,-0.3 0.857 110.4 57.3 -55.8 -31.0 67.6 47.3 68.2 47 51 A V H X S+ 0 0 0 -4,-1.9 4,-3.2 2,-0.2 -2,-0.2 0.958 106.4 44.8 -64.1 -53.5 65.6 49.5 65.8 48 52 A A H X S+ 0 0 6 -4,-2.3 4,-2.9 1,-0.2 5,-0.3 0.967 113.1 51.3 -54.5 -55.5 68.5 51.1 64.0 49 53 A K H X S+ 0 0 85 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.830 112.5 47.8 -51.7 -35.0 70.3 47.7 63.7 50 54 A S H X S+ 0 0 0 -4,-1.6 4,-3.3 -5,-0.3 -1,-0.2 0.947 109.9 51.1 -73.4 -46.2 67.1 46.3 62.3 51 55 A V H X S+ 0 0 2 -4,-3.2 4,-2.3 2,-0.2 -2,-0.2 0.900 112.1 46.1 -58.5 -42.3 66.7 49.2 59.8 52 56 A R H X S+ 0 0 48 -4,-2.9 4,-3.8 2,-0.2 5,-0.3 0.983 112.6 50.3 -62.7 -55.1 70.2 48.9 58.5 53 57 A Y H X S+ 0 0 21 -4,-1.9 4,-3.0 1,-0.3 -2,-0.2 0.907 109.0 53.9 -46.0 -47.6 69.9 45.1 58.2 54 58 A A H <>S+ 0 0 0 -4,-3.3 5,-2.9 2,-0.2 -1,-0.3 0.943 114.4 40.1 -54.1 -49.8 66.7 45.8 56.4 55 59 A a H ><5S+ 0 0 17 -4,-2.3 3,-2.5 3,-0.2 -2,-0.2 0.966 113.5 53.7 -64.0 -53.8 68.5 48.0 54.0 56 60 A D H 3<5S+ 0 0 15 -4,-3.8 -2,-0.2 1,-0.3 -1,-0.2 0.858 116.0 38.6 -51.3 -42.1 71.6 45.8 53.7 57 61 A N T 3<5S- 0 0 20 -4,-3.0 -1,-0.3 -5,-0.3 -2,-0.2 0.245 115.9-115.1 -95.7 17.3 69.6 42.8 52.8 58 62 A G T < 5 + 0 0 45 -3,-2.5 2,-0.4 1,-0.2 -3,-0.2 0.969 57.0 165.1 49.5 68.8 67.3 44.9 50.6 59 63 A L < - 0 0 36 -5,-2.9 -1,-0.2 -6,-0.1 2,-0.1 -0.964 42.3-117.5-124.6 130.7 64.1 44.3 52.7 60 64 A E - 0 0 82 -2,-0.4 20,-2.2 17,-0.1 2,-0.4 -0.386 37.2-134.4 -60.2 131.0 60.8 46.1 52.7 61 65 A I E +c 80 0A 10 382,-0.7 385,-0.4 18,-0.2 384,-0.4 -0.751 27.8 173.4 -96.4 138.3 60.3 47.7 56.2 62 66 A S E -c 81 0A 2 18,-0.7 20,-3.4 -2,-0.4 2,-0.4 -0.987 17.7-150.2-142.6 128.7 57.1 47.6 58.2 63 67 A V E -c 82 0A 49 -2,-0.4 2,-0.4 383,-0.3 20,-0.2 -0.781 16.3-166.3 -98.4 143.7 56.6 48.8 61.7 64 68 A R E +c 83 0A 19 18,-2.1 20,-2.9 -2,-0.4 21,-0.3 -0.996 28.4 137.4-137.5 136.6 54.1 47.1 63.9 65 69 A S S S+ 0 0 12 -2,-0.4 20,-0.1 18,-0.2 39,-0.1 0.346 86.7 2.3-130.9 -86.9 52.4 47.9 67.2 66 70 A G S S- 0 0 17 39,-0.1 -2,-0.1 64,-0.1 40,-0.0 0.894 76.9-149.0 -77.7 -41.1 48.7 47.3 67.6 67 71 A G + 0 0 8 -41,-0.1 -40,-1.9 -40,-0.1 -39,-0.5 0.616 55.6 128.1 80.7 12.7 48.3 45.8 64.2 68 72 A H + 0 0 36 -41,-0.2 61,-0.1 -42,-0.1 -42,-0.0 0.658 33.0 109.0 -77.0 -14.6 44.7 47.1 63.9 69 73 A N > - 0 0 36 1,-0.1 3,-1.3 2,-0.1 5,-0.3 -0.461 60.6-150.1 -69.7 128.2 45.1 48.8 60.6 70 74 A P T 3 S+ 0 0 3 0, 0.0 -1,-0.1 0, 0.0 240,-0.1 0.007 89.8 75.7 -84.5 28.4 43.2 46.9 57.9 71 75 A N T 3 S- 0 0 22 342,-0.1 -2,-0.1 375,-0.0 341,-0.0 0.265 101.1-129.9-114.3 2.4 45.6 48.0 55.3 72 76 A G X + 0 0 3 -3,-1.3 3,-2.7 1,-0.2 -4,-0.0 0.725 58.5 148.3 56.0 21.6 48.1 45.5 56.6 73 77 A Y T 3 + 0 0 40 1,-0.3 -10,-0.3 -4,-0.0 -1,-0.2 0.716 66.9 71.3 -57.3 -12.4 50.7 48.2 56.8 74 78 A A T 3 S+ 0 0 9 -5,-0.3 -1,-0.3 -12,-0.1 2,-0.3 0.338 104.0 33.2 -85.9 6.0 51.7 46.0 59.7 75 79 A T < - 0 0 4 -3,-2.7 2,-0.3 -14,-0.1 -41,-0.1 -0.970 66.1-165.4-153.3 160.8 52.9 43.2 57.5 76 80 A N - 0 0 2 -2,-0.3 2,-1.1 3,-0.2 -14,-0.1 -0.885 34.7 -95.1-143.4 174.8 54.6 42.9 54.2 77 81 A D S S- 0 0 127 -2,-0.3 2,-0.5 -44,-0.2 -17,-0.1 -0.712 98.5 -29.8 -98.5 87.9 55.4 40.2 51.6 78 82 A G S S+ 0 0 25 -44,-2.1 -42,-0.4 -2,-1.1 -1,-0.1 -0.442 111.3 98.4 109.1 -61.9 58.9 39.0 52.3 79 83 A G S S- 0 0 6 -2,-0.5 -43,-2.0 -44,-0.2 -42,-0.3 0.516 78.3 -71.0 -45.3-161.6 60.6 42.0 53.9 80 84 A I E - c 0 61A 0 -20,-2.2 -18,-0.7 -45,-0.2 2,-0.4 -0.601 31.8-151.1-102.6 163.0 61.1 42.8 57.6 81 85 A V E -bc 38 62A 5 -44,-1.1 -42,-2.0 -2,-0.2 2,-1.1 -0.996 7.0-149.6-135.3 126.6 58.7 43.8 60.4 82 86 A L E - c 0 63A 0 -20,-3.4 -18,-2.1 -2,-0.4 2,-0.8 -0.739 13.6-162.4 -99.7 87.2 59.7 45.8 63.4 83 87 A D E - c 0 64A 0 -2,-1.1 -42,-0.8 -20,-0.2 3,-0.4 -0.581 9.7-178.5 -70.9 108.4 57.4 44.6 66.2 84 88 A L > + 0 0 4 -20,-2.9 3,-2.1 -2,-0.8 20,-0.7 0.355 45.1 114.6 -91.6 6.7 57.7 47.4 68.7 85 89 A R T 3 S+ 0 0 57 -21,-0.3 -1,-0.2 1,-0.3 21,-0.1 0.777 70.6 54.3 -49.3 -36.2 55.4 45.7 71.2 86 90 A L T 3 S+ 0 0 56 -45,-0.4 2,-1.7 -3,-0.4 -1,-0.3 0.647 86.1 82.7 -78.5 -11.0 58.0 45.2 73.9 87 91 A M < + 0 0 20 -3,-2.1 17,-1.2 -46,-0.2 18,-0.8 -0.502 55.7 136.2 -88.1 65.4 59.0 48.8 74.0 88 92 A N + 0 0 81 -2,-1.7 -1,-0.2 16,-0.2 2,-0.1 -0.056 17.3 152.5-106.3 30.8 56.0 49.5 76.3 89 93 A S - 0 0 63 12,-0.1 13,-1.4 16,-0.1 2,-0.5 -0.406 22.2-170.6 -62.4 130.9 57.7 51.8 78.8 90 94 A I E +D 101 0B 40 11,-0.2 2,-0.5 -2,-0.1 11,-0.2 -0.985 8.1 179.9-127.9 122.3 55.1 54.1 80.3 91 95 A H E -D 100 0B 26 9,-2.2 9,-2.0 -2,-0.5 2,-0.4 -0.869 11.6-158.9-127.3 101.6 56.1 57.0 82.6 92 96 A I E -D 99 0B 11 -2,-0.5 2,-0.7 7,-0.2 7,-0.2 -0.625 3.8-157.1 -79.1 130.0 53.4 59.3 84.0 93 97 A D E >> +D 98 0B 34 5,-2.6 4,-2.3 -2,-0.4 5,-0.5 -0.562 15.1 176.2-107.7 67.1 54.7 62.7 85.0 94 98 A T T 45S+ 0 0 76 -2,-0.7 -1,-0.2 1271,-0.2 104,-0.0 0.820 75.9 57.9 -35.1 -48.2 52.1 63.9 87.6 95 99 A A T 45S+ 0 0 93 1,-0.2 -1,-0.2 -3,-0.2 -2,-0.1 0.966 120.1 21.3 -49.6 -77.1 54.2 67.0 88.2 96 100 A G T 45S- 0 0 54 2,-0.0 -1,-0.2 1,-0.0 -2,-0.2 0.505 107.8-123.1 -74.5 -4.8 54.5 68.6 84.8 97 101 A S T <5S+ 0 0 41 -4,-2.3 101,-1.2 1,-0.2 2,-0.3 0.981 70.9 101.6 59.9 65.8 51.4 66.7 83.7 98 102 A R E < -DE 93 197B 90 -5,-0.5 -5,-2.6 99,-0.2 2,-0.3 -0.864 55.9-131.4-155.8-176.1 52.6 64.8 80.6 99 103 A A E -DE 92 196B 3 97,-1.9 97,-2.2 -2,-0.3 2,-0.6 -0.998 4.5-138.5-153.5 148.8 53.7 61.2 79.9 100 104 A R E -DE 91 195B 47 -9,-2.0 -9,-2.2 -2,-0.3 2,-0.3 -0.931 28.4-176.2-112.0 119.0 56.5 59.3 78.2 101 105 A I E -DE 90 194B 2 93,-3.0 93,-3.0 -2,-0.6 2,-0.3 -0.879 21.5-126.2-119.3 146.5 55.4 56.3 76.0 102 106 A G E > - E 0 193B 5 -13,-1.4 3,-3.6 -2,-0.3 91,-0.3 -0.704 33.8-106.3 -93.2 140.4 57.3 53.7 74.1 103 107 A G T 3 S+ 0 0 0 89,-1.6 29,-0.3 -2,-0.3 30,-0.2 0.680 118.1 44.4 -26.9 -44.5 56.6 53.0 70.4 104 108 A G T 3 S+ 0 0 1 -17,-1.2 -1,-0.3 -20,-0.7 -16,-0.2 0.583 79.1 129.6 -86.4 -10.2 54.7 49.8 71.1 105 109 A V < - 0 0 0 -3,-3.6 26,-1.2 -18,-0.8 27,-0.4 -0.081 54.1-132.8 -45.5 143.2 52.6 50.9 74.0 106 110 A I B > -H 130 0C 35 24,-0.2 4,-2.1 1,-0.1 3,-0.3 -0.849 13.5-119.1-105.1 140.1 49.0 50.0 73.5 107 111 A S H >> S+ 0 0 0 22,-2.1 4,-2.6 -2,-0.4 3,-0.8 0.900 111.8 54.8 -35.9 -68.3 46.1 52.5 74.0 108 112 A G H 3> S+ 0 0 8 19,-2.0 4,-2.9 1,-0.3 -1,-0.2 0.854 109.1 46.8 -33.5 -61.9 44.5 50.4 76.7 109 113 A D H 3> S+ 0 0 72 18,-0.3 4,-2.4 -3,-0.3 -1,-0.3 0.857 110.9 51.9 -54.4 -41.9 47.7 50.3 78.8 110 114 A L H X S+ 0 0 49 -4,-2.4 3,-1.7 2,-0.2 4,-0.8 0.995 111.6 48.9 -63.9 -68.5 48.1 53.6 83.8 114 118 A A H 3<>S+ 0 0 0 -4,-1.9 5,-3.5 1,-0.3 -1,-0.2 0.727 105.1 66.0 -47.1 -21.0 47.5 57.3 83.5 115 119 A A H ><5S+ 0 0 15 -4,-1.3 3,-3.1 -5,-0.2 -1,-0.3 0.950 91.2 61.0 -65.4 -49.0 44.3 56.5 85.2 116 120 A K H <<5S+ 0 0 62 -3,-1.7 -2,-0.2 -4,-1.1 -1,-0.2 0.879 106.1 45.0 -42.8 -51.3 46.2 55.5 88.4 117 121 A F T 3<5S- 0 0 32 -4,-0.8 -1,-0.3 2,-0.1 -2,-0.2 0.308 124.8-106.5 -81.1 11.3 47.6 59.0 88.8 118 122 A G T < 5S+ 0 0 13 -3,-3.1 83,-1.8 1,-0.3 2,-0.3 0.815 81.1 120.1 70.5 32.1 44.2 60.4 88.0 119 123 A L E < -I 200 0D 11 -5,-3.5 2,-0.4 81,-0.2 -1,-0.3 -0.833 48.9-144.2-126.1 164.6 45.0 61.6 84.5 120 124 A A E -I 199 0D 3 79,-2.1 79,-2.1 -2,-0.3 2,-0.3 -0.990 3.5-151.1-134.4 138.9 43.7 60.8 81.1 121 125 A A - 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