==== 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 24-DEC-08 3FNI . COMPND 2 MOLECULE: PUTATIVE DIFLAVIN FLAVOPROTEIN A 3; . SOURCE 2 ORGANISM_SCIENTIFIC: NOSTOC SP.; . AUTHOR F.FOROUHAR,S.LEW,J.SEETHARAMAN,S.SAHDEV,R.XIAO,E.L.FOOTE, . 154 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8233.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 110 71.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 25 16.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 1.3 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 . 8 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 13 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 59 38.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 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 0 0 0 0 0 1 1 0 0 0 2 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 1 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 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 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 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 2 A K 0 0 257 0, 0.0 2,-0.2 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 6.6 24.2 -7.8 -1.2 2 3 A A - 0 0 61 1,-0.1 3,-0.1 3,-0.0 0, 0.0 -0.582 360.0 -82.9 -89.8 154.1 23.8 -6.1 2.1 3 4 A E - 0 0 171 -2,-0.2 2,-0.3 1,-0.1 -1,-0.1 -0.215 52.8 -96.2 -56.5 139.6 23.2 -7.9 5.4 4 5 A T + 0 0 59 52,-0.1 30,-1.8 -3,-0.1 2,-0.3 -0.425 63.1 164.9 -59.0 119.4 19.6 -8.9 6.2 5 6 A S E -ab 34 56A 4 50,-0.6 52,-2.4 -2,-0.3 53,-0.9 -0.905 37.7-137.3-140.9 165.5 18.3 -6.1 8.4 6 7 A I E -ab 35 58A 0 28,-1.3 30,-1.8 -2,-0.3 2,-0.4 -0.987 28.0-128.4-124.2 131.8 15.2 -4.6 9.8 7 8 A G E -ab 36 59A 0 51,-2.8 53,-2.8 -2,-0.4 2,-0.6 -0.703 16.5-165.0 -89.0 131.3 14.8 -0.8 9.9 8 9 A V E -ab 37 60A 0 28,-2.7 30,-2.5 -2,-0.4 2,-0.5 -0.955 11.5-178.0-114.6 113.5 13.9 1.0 13.1 9 10 A F E +ab 38 61A 0 51,-3.6 53,-2.6 -2,-0.6 2,-0.3 -0.957 20.3 123.2-119.9 123.8 12.7 4.6 12.6 10 11 A Y E -a 39 0A 25 28,-2.0 30,-2.2 -2,-0.5 2,-0.8 -0.975 61.5 -88.8-164.2 170.7 11.8 6.9 15.4 11 12 A V > - 0 0 18 52,-0.4 3,-1.5 -2,-0.3 6,-0.2 -0.810 47.5-131.5 -94.3 109.1 12.5 10.3 17.1 12 13 A S T 3 S+ 0 0 42 -2,-0.8 3,-0.1 1,-0.2 4,-0.0 -0.223 84.1 12.3 -61.0 148.4 15.2 9.8 19.7 13 14 A E T 3 S+ 0 0 165 1,-0.2 2,-0.7 2,-0.1 -1,-0.2 0.457 91.6 127.7 64.9 3.1 14.8 11.3 23.1 14 15 A Y S X S- 0 0 28 -3,-1.5 3,-1.8 2,-0.0 -1,-0.2 -0.823 84.2 -47.4 -91.4 117.0 11.0 11.9 22.5 15 16 A G T 3 S- 0 0 38 -2,-0.7 3,-0.4 1,-0.2 80,-0.2 -0.280 113.2 -33.0 58.8-143.8 9.0 10.3 25.3 16 17 A Y T 3> S+ 0 0 79 78,-2.4 4,-2.9 1,-0.2 -1,-0.2 0.093 102.3 119.6 -95.6 22.2 10.1 6.8 26.1 17 18 A S H <> + 0 0 0 -3,-1.8 4,-3.0 1,-0.2 5,-0.3 0.865 69.1 55.4 -53.1 -44.3 11.0 6.1 22.4 18 19 A D H > S+ 0 0 61 -3,-0.4 4,-2.0 1,-0.2 -1,-0.2 0.935 115.3 36.9 -57.7 -49.7 14.6 5.4 23.2 19 20 A R H > S+ 0 0 133 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.865 117.2 51.9 -73.9 -35.7 13.8 2.7 25.8 20 21 A L H X S+ 0 0 0 -4,-2.9 4,-1.8 2,-0.2 -2,-0.2 0.932 113.9 43.2 -65.8 -45.0 10.9 1.3 23.8 21 22 A A H X S+ 0 0 0 -4,-3.0 4,-3.0 -5,-0.2 -2,-0.2 0.892 111.1 55.6 -67.5 -40.1 12.9 1.0 20.6 22 23 A Q H X S+ 0 0 94 -4,-2.0 4,-2.2 -5,-0.3 -1,-0.2 0.888 107.4 49.2 -60.5 -39.4 15.9 -0.5 22.5 23 24 A A H X S+ 0 0 11 -4,-1.9 4,-1.6 2,-0.2 -1,-0.2 0.924 112.4 47.3 -65.2 -46.4 13.7 -3.2 23.9 24 25 A I H X S+ 0 0 0 -4,-1.8 4,-1.9 1,-0.2 3,-0.3 0.932 111.4 51.4 -60.8 -46.1 12.3 -4.1 20.5 25 26 A I H X S+ 0 0 14 -4,-3.0 4,-2.9 1,-0.2 -1,-0.2 0.906 105.9 54.9 -58.8 -41.6 15.7 -4.1 19.0 26 27 A N H X S+ 0 0 76 -4,-2.2 4,-1.3 1,-0.2 -1,-0.2 0.837 107.7 50.1 -59.6 -35.8 17.0 -6.5 21.8 27 28 A G H X S+ 0 0 0 -4,-1.6 4,-0.6 -3,-0.3 -1,-0.2 0.857 111.2 48.9 -70.6 -35.2 14.2 -8.9 20.8 28 29 A I H ><>S+ 0 0 0 -4,-1.9 3,-1.4 1,-0.2 5,-1.1 0.926 105.9 57.5 -67.4 -46.1 15.3 -8.6 17.2 29 30 A T H ><5S+ 0 0 81 -4,-2.9 3,-2.1 1,-0.3 -1,-0.2 0.820 94.4 66.2 -53.0 -38.6 18.9 -9.2 18.1 30 31 A K H 3<5S+ 0 0 137 -4,-1.3 -1,-0.3 1,-0.3 -2,-0.2 0.821 98.6 53.2 -55.8 -32.8 18.0 -12.5 19.7 31 32 A T T <<5S- 0 0 36 -3,-1.4 -1,-0.3 -4,-0.6 -2,-0.2 0.427 114.5-116.8 -84.3 0.3 17.1 -13.9 16.2 32 33 A G T < 5 + 0 0 68 -3,-2.1 2,-0.3 1,-0.3 -3,-0.2 0.586 69.0 140.4 75.5 8.9 20.4 -12.9 14.8 33 34 A V < - 0 0 13 -5,-1.1 -1,-0.3 1,-0.1 -28,-0.2 -0.691 49.9-122.5 -87.6 137.3 18.7 -10.4 12.4 34 35 A G E -a 5 0A 26 -30,-1.8 -28,-1.3 -2,-0.3 2,-0.3 -0.122 23.2-152.4 -71.9 172.9 20.5 -7.1 11.8 35 36 A V E -a 6 0A 45 -30,-0.3 2,-0.5 21,-0.0 -28,-0.2 -0.998 11.7-157.8-151.5 143.9 19.1 -3.6 12.4 36 37 A D E -a 7 0A 46 -30,-1.8 -28,-2.7 -2,-0.3 2,-0.5 -0.986 16.6-153.2-123.8 121.7 19.5 -0.1 11.1 37 38 A V E -a 8 0A 80 -2,-0.5 2,-0.4 -30,-0.2 -28,-0.2 -0.812 11.6-175.5-100.8 132.5 18.4 2.8 13.3 38 39 A V E -a 9 0A 16 -30,-2.5 -28,-2.0 -2,-0.5 2,-0.7 -0.989 20.7-138.5-128.6 128.5 17.3 6.1 11.9 39 40 A D E -a 10 0A 49 -2,-0.4 -28,-0.2 -30,-0.2 3,-0.2 -0.781 7.8-161.4 -87.7 117.8 16.4 9.2 13.9 40 41 A L S S+ 0 0 11 -30,-2.2 -29,-0.2 -2,-0.7 35,-0.2 0.640 90.1 57.6 -71.1 -17.7 13.3 10.9 12.4 41 42 A G S S+ 0 0 52 -31,-0.4 2,-0.4 2,-0.1 -1,-0.2 0.810 94.0 73.8 -82.9 -32.8 14.2 14.1 14.2 42 43 A A S S- 0 0 50 -3,-0.2 -3,-0.0 1,-0.1 -30,-0.0 -0.679 97.8-100.6 -85.5 135.0 17.6 14.5 12.7 43 44 A A - 0 0 108 -2,-0.4 2,-0.3 1,-0.1 -1,-0.1 -0.192 44.7-164.4 -53.2 139.3 17.8 15.5 9.0 44 45 A V - 0 0 45 -4,-0.1 2,-0.7 -6,-0.0 -1,-0.1 -0.952 28.4-104.3-133.0 151.8 18.4 12.7 6.6 45 46 A D > - 0 0 89 -2,-0.3 4,-2.3 1,-0.2 3,-0.4 -0.624 30.0-148.7 -73.4 110.8 19.4 12.3 3.0 46 47 A L H > S+ 0 0 82 -2,-0.7 4,-1.4 1,-0.2 -1,-0.2 0.801 93.6 50.3 -51.8 -36.5 16.2 11.4 1.2 47 48 A Q H > S+ 0 0 115 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.869 113.0 43.6 -74.4 -36.4 17.9 9.2 -1.4 48 49 A E H > S+ 0 0 112 -3,-0.4 4,-1.9 2,-0.2 -2,-0.2 0.780 111.0 57.4 -77.6 -25.8 19.9 7.2 1.1 49 50 A L H X S+ 0 0 4 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.851 106.2 48.8 -70.1 -35.5 16.8 6.9 3.2 50 51 A R H X S+ 0 0 101 -4,-1.4 4,-2.0 -5,-0.2 -2,-0.2 0.867 111.4 50.7 -69.6 -38.0 14.9 5.4 0.2 51 52 A E H X S+ 0 0 135 -4,-1.4 4,-1.3 2,-0.2 -2,-0.2 0.848 109.2 50.5 -67.0 -38.2 17.8 3.0 -0.2 52 53 A L H >< S+ 0 0 23 -4,-1.9 3,-0.7 2,-0.2 4,-0.3 0.957 112.1 45.1 -66.1 -51.4 17.8 1.9 3.4 53 54 A V H >< S+ 0 0 0 -4,-2.0 3,-1.5 1,-0.3 -2,-0.2 0.901 109.5 60.2 -57.8 -39.9 14.1 1.2 3.5 54 55 A G H 3< S+ 0 0 46 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.805 107.4 42.4 -58.4 -34.2 14.6 -0.6 0.2 55 56 A R T << S+ 0 0 105 -4,-1.3 -50,-0.6 -3,-0.7 2,-0.4 0.299 93.1 101.1 -99.1 11.7 17.1 -3.1 1.7 56 57 A C E < -b 5 0A 4 -3,-1.5 -50,-0.2 -4,-0.3 -52,-0.1 -0.811 48.9-169.2 -97.2 134.3 15.1 -3.7 4.9 57 58 A T E S+ 0 0 20 -52,-2.4 31,-1.2 -2,-0.4 2,-0.3 0.756 78.8 33.6 -88.2 -29.2 13.0 -6.9 5.1 58 59 A G E -bc 6 88A 0 -53,-0.9 -51,-2.8 29,-0.2 2,-0.3 -0.881 69.7-157.1-126.5 158.5 11.3 -5.6 8.3 59 60 A L E -bc 7 89A 0 29,-1.8 31,-2.4 -2,-0.3 2,-0.4 -0.993 8.2-172.6-140.0 143.8 10.3 -2.2 9.7 60 61 A V E -bc 8 90A 0 -53,-2.8 -51,-3.6 -2,-0.3 2,-0.4 -0.991 12.6-167.9-136.0 124.4 9.6 -0.6 13.1 61 62 A I E -bc 9 91A 3 29,-2.7 31,-2.5 -2,-0.4 2,-0.4 -0.936 8.4-157.9-119.4 137.2 8.2 2.9 13.4 62 63 A G E - c 0 92A 1 -53,-2.6 31,-0.2 -2,-0.4 -22,-0.1 -0.895 32.0-107.1-109.3 140.2 7.9 5.1 16.4 63 64 A X - 0 0 8 29,-2.0 -52,-0.4 -2,-0.4 -46,-0.1 -0.334 31.8-138.7 -67.7 146.6 5.3 7.9 16.5 64 65 A S - 0 0 10 1,-0.1 36,-1.3 -54,-0.1 2,-0.1 -0.640 29.0 -85.4-103.0 162.0 6.5 11.5 16.2 65 66 A P B > -F 99 0B 13 0, 0.0 3,-1.6 0, 0.0 34,-0.2 -0.404 25.6-134.7 -67.3 138.9 5.4 14.6 18.1 66 67 A A T 3 S+ 0 0 46 32,-3.1 3,-0.3 1,-0.3 33,-0.1 0.495 106.6 65.3 -69.5 -1.0 2.3 16.4 16.6 67 68 A A T 3 S+ 0 0 79 31,-0.2 -1,-0.3 1,-0.2 3,-0.2 0.630 99.3 47.2 -94.7 -18.5 4.5 19.5 17.2 68 69 A S S <> S+ 0 0 49 -3,-1.6 4,-2.6 1,-0.1 5,-0.3 0.045 74.7 123.4-109.9 24.0 7.2 18.5 14.7 69 70 A A H > S+ 0 0 25 -3,-0.3 4,-2.9 1,-0.2 3,-0.2 0.939 70.8 49.1 -47.8 -63.1 4.8 17.6 11.9 70 71 A A H 4 S+ 0 0 90 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.886 118.7 38.6 -45.8 -51.9 6.1 20.0 9.2 71 72 A S H 4 S+ 0 0 97 1,-0.2 4,-0.4 2,-0.1 3,-0.2 0.796 119.5 46.1 -73.9 -30.3 9.7 19.0 9.7 72 73 A I H >X S+ 0 0 8 -4,-2.6 4,-2.0 -3,-0.2 3,-0.8 0.836 93.8 74.0 -83.1 -36.3 9.1 15.2 10.2 73 74 A Q H 3X S+ 0 0 93 -4,-2.9 4,-3.0 -5,-0.3 5,-0.3 0.727 86.1 67.3 -51.8 -26.2 6.7 14.6 7.3 74 75 A G H 3> S+ 0 0 40 -4,-0.4 4,-1.5 -3,-0.2 -1,-0.2 0.965 108.6 35.3 -60.5 -52.0 9.5 14.8 4.8 75 76 A A H <> S+ 0 0 11 -3,-0.8 4,-1.9 -4,-0.4 -2,-0.2 0.905 118.4 53.0 -67.5 -42.4 11.1 11.6 6.1 76 77 A L H X S+ 0 0 37 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.921 109.4 47.3 -59.5 -48.7 7.8 10.0 6.9 77 78 A S H X S+ 0 0 74 -4,-3.0 4,-1.3 1,-0.2 -1,-0.2 0.851 110.1 55.0 -60.8 -37.2 6.4 10.5 3.4 78 79 A T H X S+ 0 0 13 -4,-1.5 4,-0.6 -5,-0.3 -1,-0.2 0.882 107.5 48.4 -65.5 -38.9 9.7 9.2 2.0 79 80 A I H >X S+ 0 0 1 -4,-1.9 4,-1.1 1,-0.2 3,-0.7 0.904 108.5 54.2 -68.2 -40.9 9.4 6.0 3.9 80 81 A L H 3< S+ 0 0 37 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.765 114.6 41.2 -63.8 -27.4 5.7 5.6 2.8 81 82 A G H 3< S+ 0 0 67 -4,-1.3 -1,-0.3 -5,-0.2 -2,-0.2 0.504 114.6 51.6 -98.5 -4.2 6.9 5.9 -0.8 82 83 A S H << S+ 0 0 20 -3,-0.7 -2,-0.2 -4,-0.6 -3,-0.1 0.495 90.7 93.4-107.7 -7.4 10.0 3.7 -0.4 83 84 A V < - 0 0 20 -4,-1.1 2,-0.3 -5,-0.1 -29,-0.1 -0.384 60.4-148.7 -83.3 161.0 8.4 0.7 1.2 84 85 A N > - 0 0 66 -31,-0.2 3,-1.6 -2,-0.1 28,-0.1 -0.941 25.3-113.6-133.1 155.1 7.2 -2.4 -0.6 85 86 A E T 3 S+ 0 0 135 -2,-0.3 30,-0.1 1,-0.3 -2,-0.0 0.625 106.1 71.1 -59.7 -18.1 4.3 -4.8 -0.0 86 87 A K T 3 S+ 0 0 122 28,-0.1 -1,-0.3 2,-0.1 2,-0.2 0.490 88.2 79.5 -80.9 -4.7 6.7 -7.7 0.6 87 88 A Q S < S- 0 0 2 -3,-1.6 28,-1.8 -29,-0.0 2,-0.3 -0.530 71.5-129.4-103.9 172.0 7.8 -6.4 4.0 88 89 A A E -cd 58 115A 0 -31,-1.2 -29,-1.8 26,-0.2 2,-0.4 -0.894 20.7-165.0-116.7 148.0 6.4 -6.3 7.5 89 90 A V E -cd 59 116A 11 26,-2.7 28,-2.1 -2,-0.3 29,-0.4 -0.997 8.4-170.8-141.4 137.4 5.9 -3.3 9.7 90 91 A G E -c 60 0A 2 -31,-2.4 -29,-2.7 -2,-0.4 2,-0.4 -0.938 10.6-157.5-122.9 148.6 5.3 -2.7 13.4 91 92 A I E -c 61 0A 1 27,-0.4 30,-1.4 -2,-0.3 2,-0.3 -0.980 5.0-167.3-132.9 139.0 4.5 0.6 15.1 92 93 A F E -ce 62 121A 0 -31,-2.5 -29,-2.0 -2,-0.4 30,-0.2 -0.925 18.4-130.0-126.8 150.5 4.7 1.9 18.7 93 94 A E - 0 0 38 28,-2.1 31,-0.1 -2,-0.3 28,-0.0 -0.515 15.9-143.6 -85.4 161.4 3.5 4.9 20.7 94 95 A T - 0 0 0 -2,-0.2 -78,-2.4 29,-0.1 -74,-0.1 0.704 20.0-131.4-103.3 -22.8 6.0 6.8 22.7 95 96 A G S S+ 0 0 30 28,-0.2 -80,-0.1 -80,-0.2 29,-0.0 0.714 70.7 125.2 76.5 19.1 4.1 7.9 25.8 96 97 A G S S- 0 0 36 -82,-0.1 -81,-0.2 -81,-0.1 -1,-0.0 0.657 75.3-121.5 -85.1 -18.2 5.5 11.4 25.2 97 98 A G S S+ 0 0 80 -32,-0.0 -1,-0.0 0, 0.0 -82,-0.0 0.369 99.1 68.6 95.4 -4.4 2.0 13.1 25.2 98 99 A D + 0 0 64 2,-0.1 -32,-3.1 -32,-0.0 -31,-0.2 0.168 65.9 153.8-129.7 14.8 2.2 14.6 21.7 99 100 A D B -F 65 0B 38 -34,-0.2 3,-0.1 -33,-0.1 -6,-0.1 -0.088 46.1-120.0 -49.7 142.0 2.0 11.4 19.6 100 101 A E - 0 0 66 -36,-1.3 2,-0.2 1,-0.1 -1,-0.1 -0.496 52.4 -75.6 -78.0 152.2 0.6 11.7 16.1 101 102 A P > - 0 0 77 0, 0.0 4,-0.8 0, 0.0 -1,-0.1 -0.341 45.7-161.6 -54.9 118.1 -2.4 9.5 15.6 102 103 A I H >> S+ 0 0 5 -2,-0.2 4,-2.2 1,-0.2 3,-0.7 0.928 81.0 61.5 -69.3 -45.6 -1.0 6.0 15.3 103 104 A D H 3> S+ 0 0 82 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.873 98.2 55.9 -49.4 -48.5 -4.1 4.4 13.7 104 105 A P H 3> S+ 0 0 70 0, 0.0 4,-1.1 0, 0.0 -1,-0.2 0.884 112.5 43.5 -54.1 -39.2 -4.0 6.6 10.6 105 106 A L H S+ 0 0 3 -4,-1.6 5,-1.2 2,-0.2 4,-0.3 0.903 113.0 51.5 -74.9 -39.4 0.8 0.6 5.6 110 111 A R H ><5S+ 0 0 167 -4,-1.8 3,-1.2 1,-0.2 -2,-0.2 0.872 107.0 54.3 -63.7 -36.0 -1.9 -2.0 5.5 111 112 A N H 3<5S+ 0 0 144 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.804 103.5 57.4 -67.4 -28.4 -3.4 -0.3 2.5 112 113 A L T 3<5S- 0 0 79 -4,-0.9 -1,-0.3 -3,-0.3 -2,-0.2 0.503 121.7-106.3 -81.2 -3.5 -0.0 -0.6 0.8 113 114 A G T < 5S+ 0 0 40 -3,-1.2 -3,-0.2 -4,-0.3 -2,-0.1 0.194 71.3 140.0 101.6 -17.8 -0.0 -4.4 1.3 114 115 A L < - 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