==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-MAR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE/OXIDOREDUCTASE INHIBITOR 25-APR-11 3ROA . COMPND 2 MOLECULE: STRAIN CBS138 CHROMOSOME J COMPLETE SEQUENCE; . SOURCE 2 ORGANISM_SCIENTIFIC: CANDIDA GLABRATA; . AUTHOR J.L.PAULSEN,A.C.ANDERSON . 450 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 23834.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 290 64.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 63 14.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 78 17.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 1.8 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 . 41 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 72 16.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 4 0 2 4 2 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 2 2 3 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 PARALLEL BRIDGES PER LADDER . 4 2 4 0 4 0 0 0 2 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 0 0 0 0 0 0 0 0 0 2 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 3 A K 0 0 225 0, 0.0 104,-0.0 0, 0.0 103,-0.0 0.000 360.0 360.0 360.0 -26.4 12.7 -17.5 18.5 2 4 A V - 0 0 19 102,-0.0 113,-0.1 1,-0.0 112,-0.1 -0.822 360.0-108.6 -88.4 130.2 11.5 -16.8 14.9 3 5 A P - 0 0 44 0, 0.0 113,-2.4 0, 0.0 2,-0.6 -0.352 24.5-144.8 -64.4 137.6 14.5 -16.9 12.5 4 6 A V E -a 116 0A 8 127,-0.2 129,-3.1 111,-0.2 130,-1.5 -0.926 21.7-173.5-102.9 120.5 15.7 -13.5 11.2 5 7 A V E -ab 117 134A 0 111,-3.2 113,-2.6 -2,-0.6 2,-0.3 -0.957 18.5-148.0-126.5 117.8 16.9 -13.9 7.6 6 8 A G E -ab 118 135A 0 128,-2.5 130,-3.4 -2,-0.5 2,-0.4 -0.646 19.5-167.0 -75.0 135.8 18.5 -11.2 5.5 7 9 A I E + b 0 136A 5 111,-2.7 2,-0.3 -2,-0.3 130,-0.2 -0.995 18.6 148.5-132.8 130.6 17.6 -11.7 1.8 8 10 A V E - b 0 137A 5 128,-2.5 130,-2.7 -2,-0.4 2,-0.5 -0.989 41.2-135.5-158.0 148.2 19.5 -9.9 -1.0 9 11 A A E - b 0 138A 15 -2,-0.3 2,-0.4 128,-0.2 130,-0.2 -0.987 34.7-179.7-110.9 122.7 20.6 -10.1 -4.6 10 12 A A E - b 0 139A 0 128,-3.1 130,-3.0 -2,-0.5 2,-0.6 -0.973 25.8-129.4-131.9 136.6 24.2 -8.9 -5.0 11 13 A L E >> -Cb 16 140A 2 5,-3.0 4,-1.5 -2,-0.4 5,-1.5 -0.731 45.3 -94.7 -88.5 121.9 26.6 -8.6 -8.0 12 14 A L T 45S+ 0 0 3 128,-2.9 179,-0.1 -2,-0.6 -1,-0.0 -0.413 91.8 18.5 -73.8 151.3 30.1 -10.1 -7.5 13 15 A P T 45S+ 0 0 42 0, 0.0 -1,-0.2 0, 0.0 128,-0.0 -0.996 134.5 28.8 -92.0 -12.8 32.8 -9.3 -6.7 14 16 A E T 45S- 0 0 39 -3,-0.3 143,-0.2 435,-0.1 -2,-0.2 0.520 97.2-125.9 -85.3 -6.5 31.9 -6.0 -4.8 15 17 A M T <5 - 0 0 2 -4,-1.5 140,-3.3 1,-0.2 2,-0.2 0.913 39.3-177.9 58.0 47.4 28.4 -7.2 -3.8 16 18 A G E < +CD 11 154A 0 -5,-1.5 -5,-3.0 138,-0.3 138,-0.3 -0.554 14.6 172.2 -73.1 141.5 26.6 -4.2 -5.4 17 19 A I E + 0 0 20 136,-2.8 2,-0.3 1,-0.3 137,-0.2 0.445 54.2 19.0-129.5 -11.6 22.8 -4.2 -4.9 18 20 A G E - D 0 153A 9 135,-1.2 134,-2.8 5,-0.2 135,-1.4 -0.994 43.5-163.9-161.5 162.3 21.6 -0.9 -6.1 19 21 A F B > S-L 22 0B 42 3,-3.1 3,-2.0 -2,-0.3 132,-0.1 -0.918 77.4 -11.7-155.6 126.6 22.0 2.3 -8.1 20 22 A Q T 3 S- 0 0 144 -2,-0.3 3,-0.1 1,-0.3 131,-0.0 0.843 127.7 -49.6 53.8 43.5 20.1 5.6 -8.0 21 23 A G T 3 S+ 0 0 60 1,-0.2 -1,-0.3 0, 0.0 2,-0.3 0.423 125.5 78.3 79.7 -0.3 17.3 4.3 -5.8 22 24 A N B < S-L 19 0B 96 -3,-2.0 -3,-3.1 1,-0.0 -1,-0.2 -0.812 88.0 -83.8-132.5 171.8 16.7 1.2 -7.9 23 25 A L - 0 0 114 -2,-0.3 -5,-0.2 -5,-0.2 -6,-0.0 -0.482 30.5-135.5 -70.7 146.0 18.0 -2.2 -8.7 24 26 A P S S+ 0 0 26 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.405 85.7 29.3 -82.1 -0.9 20.9 -2.4 -11.3 25 27 A W - 0 0 23 124,-0.1 2,-0.4 2,-0.0 -2,-0.1 -0.915 67.6-136.0-146.8 170.1 19.3 -5.4 -13.1 26 28 A R + 0 0 206 -2,-0.3 2,-0.6 4,-0.0 0, 0.0 -0.873 28.5 170.3-133.9 100.9 15.8 -6.9 -13.9 27 29 A L > - 0 0 5 -2,-0.4 4,-2.7 1,-0.1 3,-0.5 -0.907 18.3-168.0-121.3 104.9 15.8 -10.6 -13.4 28 30 A A H > S+ 0 0 66 -2,-0.6 4,-1.8 1,-0.3 -1,-0.1 0.813 91.8 50.1 -59.4 -37.1 12.4 -12.3 -13.5 29 31 A K H > S+ 0 0 77 2,-0.2 4,-1.7 1,-0.2 -1,-0.3 0.768 110.7 50.0 -72.8 -29.0 13.7 -15.6 -12.1 30 32 A E H > S+ 0 0 21 -3,-0.5 4,-2.4 2,-0.2 -2,-0.2 0.925 111.8 48.0 -72.0 -46.4 15.5 -13.8 -9.3 31 33 A M H X S+ 0 0 95 -4,-2.7 4,-2.7 2,-0.2 -2,-0.2 0.827 109.2 54.5 -57.1 -39.7 12.2 -11.9 -8.5 32 34 A K H X S+ 0 0 93 -4,-1.8 4,-2.9 2,-0.2 5,-0.2 0.933 109.2 47.1 -62.4 -49.1 10.3 -15.2 -8.6 33 35 A Y H X S+ 0 0 7 -4,-1.7 4,-2.9 2,-0.2 5,-0.3 0.926 113.4 48.6 -55.5 -50.4 12.7 -16.8 -6.0 34 36 A F H X S+ 0 0 30 -4,-2.4 4,-2.3 2,-0.2 5,-0.3 0.929 113.5 46.8 -56.7 -49.4 12.5 -13.7 -3.8 35 37 A R H X S+ 0 0 114 -4,-2.7 4,-2.3 1,-0.2 5,-0.3 0.943 116.5 43.5 -59.3 -51.3 8.6 -13.7 -4.0 36 38 A E H X S+ 0 0 39 -4,-2.9 4,-2.6 2,-0.2 -2,-0.2 0.881 114.5 48.2 -64.9 -43.0 8.3 -17.4 -3.3 37 39 A V H < S+ 0 0 0 -4,-2.9 -2,-0.2 -5,-0.2 -1,-0.2 0.960 118.7 39.3 -62.5 -51.2 10.9 -17.6 -0.5 38 40 A T H < S+ 0 0 0 -4,-2.3 10,-0.3 -5,-0.3 -2,-0.2 0.797 123.1 41.8 -72.3 -29.9 9.5 -14.6 1.4 39 41 A T H < S+ 0 0 35 -4,-2.3 9,-0.3 -5,-0.3 -3,-0.2 0.940 99.9 78.2 -79.2 -52.8 5.8 -15.6 0.7 40 42 A L < - 0 0 55 -4,-2.6 2,-0.3 -5,-0.3 3,-0.1 -0.220 54.9-177.2 -70.8 148.1 5.8 -19.3 1.2 41 43 A T - 0 0 27 5,-0.1 137,-0.2 1,-0.1 3,-0.0 -0.947 33.6-133.3-135.4 156.1 5.8 -21.1 4.6 42 44 A N S S+ 0 0 87 -2,-0.3 2,-0.7 1,-0.2 -1,-0.1 0.810 100.6 61.7 -75.3 -33.8 6.0 -24.7 5.8 43 45 A D S > S- 0 0 53 1,-0.1 3,-1.9 -3,-0.1 -1,-0.2 -0.877 77.9-152.1 -99.4 115.0 3.1 -24.0 8.2 44 46 A N T 3 S+ 0 0 155 -2,-0.7 -1,-0.1 1,-0.3 -2,-0.0 0.567 91.9 56.9 -62.9 -14.4 -0.0 -23.0 6.1 45 47 A S T 3 S+ 0 0 66 2,-0.0 -1,-0.3 68,-0.0 2,-0.2 0.463 97.8 74.6 -97.6 -8.1 -1.5 -20.9 9.0 46 48 A K < - 0 0 54 -3,-1.9 2,-0.3 67,-0.0 67,-0.2 -0.663 61.0-157.6-102.0 159.9 1.6 -18.6 9.4 47 49 A Q E -e 113 0A 73 65,-1.9 67,-2.2 -2,-0.2 68,-0.3 -0.855 18.8-119.7-122.2 166.6 2.9 -15.8 7.3 48 50 A N E - 0 0 1 21,-0.5 23,-2.5 -9,-0.3 2,-0.4 -0.699 21.5-127.4 -98.3 159.1 6.3 -14.3 7.0 49 51 A V E -ef 116 71A 0 66,-2.8 68,-3.0 -2,-0.3 2,-0.5 -0.823 12.8-157.5 -98.4 145.3 7.3 -10.7 7.7 50 52 A V E -ef 117 72A 0 21,-3.5 23,-2.8 -2,-0.4 2,-0.4 -0.979 9.9-168.8-120.3 117.6 9.2 -8.5 5.3 51 53 A I E +ef 118 73A 0 66,-2.9 68,-2.4 -2,-0.5 69,-0.6 -0.883 14.5 167.3-103.5 136.3 11.1 -5.6 6.9 52 54 A M E -ef 120 74A 0 21,-2.4 23,-2.5 -2,-0.4 69,-0.2 -0.989 36.6-101.0-148.0 152.3 12.5 -2.8 4.7 53 55 A G E > - f 0 75A 8 67,-2.5 4,-2.0 -2,-0.3 3,-0.2 -0.318 39.7-112.6 -64.6 156.3 14.0 0.7 4.7 54 56 A R H > S+ 0 0 96 21,-1.2 4,-2.1 1,-0.2 5,-0.1 0.860 117.5 53.1 -59.7 -40.5 11.8 3.6 3.8 55 57 A K H > S+ 0 0 143 1,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.821 108.4 50.8 -68.3 -31.7 13.7 4.3 0.6 56 58 A T H > S+ 0 0 32 -3,-0.2 4,-1.1 64,-0.2 3,-0.3 0.879 108.2 52.3 -71.8 -39.3 13.3 0.6 -0.5 57 59 A W H >< S+ 0 0 34 -4,-2.0 3,-0.6 1,-0.2 -2,-0.2 0.909 108.5 50.9 -56.8 -45.5 9.5 0.9 0.2 58 60 A E H 3< S+ 0 0 111 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.709 105.4 57.9 -69.3 -20.6 9.4 4.0 -2.1 59 61 A S H 3< S+ 0 0 37 -4,-0.8 -1,-0.2 -3,-0.3 -2,-0.2 0.752 84.2 93.4 -81.0 -28.1 11.3 2.0 -4.8 60 62 A I S << S- 0 0 25 -4,-1.1 5,-0.1 -3,-0.6 -38,-0.0 -0.514 92.9-100.9 -67.9 128.0 8.7 -0.8 -5.1 61 63 A P > - 0 0 78 0, 0.0 3,-1.8 0, 0.0 4,-0.4 -0.241 29.9-121.6 -48.6 135.7 6.1 -0.0 -7.8 62 64 A Q G > S+ 0 0 155 1,-0.3 3,-0.5 2,-0.2 -2,-0.1 0.738 110.4 57.2 -56.5 -28.2 2.9 1.3 -6.2 63 65 A K G 3 S+ 0 0 195 1,-0.2 -1,-0.3 0, 0.0 -3,-0.0 0.748 108.7 45.9 -73.0 -24.8 0.8 -1.6 -7.7 64 66 A F G < S+ 0 0 136 -3,-1.8 -1,-0.2 3,-0.1 -2,-0.2 0.332 92.4 125.7-103.3 4.7 3.0 -4.2 -6.0 65 67 A R < + 0 0 51 -3,-0.5 2,-0.2 -4,-0.4 -8,-0.0 -0.957 56.6 38.4-120.1 137.9 3.2 -2.7 -2.5 66 68 A P S S- 0 0 42 0, 0.0 24,-0.1 0, 0.0 3,-0.1 0.541 102.6-115.0 -69.8 153.3 2.5 -3.8 0.1 67 69 A L > - 0 0 16 -2,-0.2 3,-1.2 1,-0.1 -2,-0.1 -0.438 40.0-111.5 -60.5 120.5 4.0 -7.2 -0.9 68 70 A P T 3 S+ 0 0 80 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.180 90.4 11.6 -58.5 145.1 1.0 -9.6 -0.9 69 71 A K T 3 S+ 0 0 157 1,-0.2 -21,-0.5 -3,-0.1 2,-0.3 0.566 109.4 92.8 67.4 13.4 0.6 -12.4 1.6 70 72 A R S < S- 0 0 15 -3,-1.2 2,-0.5 -23,-0.1 -21,-0.2 -0.981 82.5-113.7-129.3 144.9 3.5 -11.0 3.8 71 73 A I E -f 49 0A 33 -23,-2.5 -21,-3.5 -2,-0.3 2,-0.5 -0.710 37.9-148.0 -73.3 123.1 3.4 -8.7 6.7 72 74 A N E -fg 50 90A 0 17,-1.4 19,-3.0 -2,-0.5 2,-0.5 -0.861 17.2-175.7 -99.3 129.2 5.1 -5.5 5.5 73 75 A V E -fg 51 91A 0 -23,-2.8 -21,-2.4 -2,-0.5 2,-0.5 -0.994 4.9-166.5-123.9 125.2 7.1 -3.4 7.9 74 76 A V E -fg 52 92A 1 17,-2.4 19,-2.1 -2,-0.5 2,-0.5 -0.941 10.8-150.1-109.8 131.1 8.6 -0.1 6.7 75 77 A V E +fg 53 93A 12 -23,-2.5 -21,-1.2 -2,-0.5 2,-0.3 -0.887 24.2 158.7-108.0 133.1 11.2 1.6 9.0 76 78 A S > - 0 0 19 17,-2.4 3,-1.5 -2,-0.5 -2,-0.0 -0.982 43.7-134.4-149.4 139.2 11.8 5.3 9.1 77 79 A R T 3 S+ 0 0 56 -2,-0.3 17,-0.1 1,-0.3 -1,-0.1 0.734 109.2 56.9 -62.6 -24.3 13.3 7.6 11.8 78 80 A S T 3 S+ 0 0 106 15,-0.1 -1,-0.3 -3,-0.0 16,-0.1 0.430 85.4 105.6 -88.8 -4.5 10.3 9.9 11.3 79 81 A F S < S- 0 0 45 -3,-1.5 -4,-0.0 14,-0.2 3,-0.0 -0.263 76.9-113.8 -76.3 174.5 7.7 7.3 12.1 80 82 A D S S- 0 0 93 4,-0.0 2,-0.2 -2,-0.0 -1,-0.1 0.854 71.1 -21.2 -85.7 -45.4 5.8 7.2 15.4 81 83 A G S S- 0 0 24 11,-0.2 13,-2.8 3,-0.0 14,-0.3 -0.742 77.9 -66.5-153.5-163.1 6.8 4.1 17.4 82 84 A E S S- 0 0 103 1,-0.2 13,-0.2 11,-0.2 20,-0.1 0.739 113.7 -5.4 -77.0 -26.1 8.2 0.6 17.5 83 85 A L S S+ 0 0 51 10,-0.1 2,-0.4 19,-0.1 -1,-0.2 -0.507 73.1 167.9-174.0 95.2 5.5 -1.2 15.5 84 86 A R E -H 92 0A 129 8,-3.0 8,-3.5 -3,-0.3 2,-0.5 -0.950 33.6-129.3-123.9 129.0 2.3 0.5 14.4 85 87 A K E +H 91 0A 108 -2,-0.4 6,-0.2 6,-0.3 3,-0.1 -0.650 33.2 165.1 -69.8 122.6 -0.4 -0.7 12.0 86 88 A V E - 0 0 56 4,-2.3 2,-0.3 -2,-0.5 -1,-0.2 0.618 65.8 -7.6-111.8 -24.0 -1.0 2.2 9.5 87 89 A E E > S-H 90 0A 117 3,-1.6 3,-2.3 0, 0.0 -1,-0.4 -0.955 96.7 -58.5-158.9 171.9 -2.9 0.3 6.8 88 90 A D T 3 S+ 0 0 119 -2,-0.3 3,-0.1 1,-0.3 -3,-0.0 -0.424 126.0 1.2 -61.1 118.5 -3.9 -3.2 5.9 89 91 A G T 3 S+ 0 0 35 -2,-0.3 -17,-1.4 1,-0.2 2,-0.4 0.534 114.6 103.8 81.7 6.4 -0.8 -5.3 5.5 90 92 A I E < +gH 72 87A 20 -3,-2.3 -4,-2.3 -19,-0.1 -3,-1.6 -0.975 43.1 179.3-127.7 119.2 1.4 -2.3 6.5 91 93 A Y E -gH 73 85A 74 -19,-3.0 -17,-2.4 -2,-0.4 2,-0.4 -0.910 15.3-148.9-108.7 145.5 3.2 -1.6 9.8 92 94 A H E +gH 74 84A 37 -8,-3.5 -8,-3.0 -2,-0.4 2,-0.3 -0.916 16.5 179.2-111.2 141.8 5.4 1.4 10.4 93 95 A S E -g 75 0A 0 -19,-2.1 -17,-2.4 -2,-0.4 -11,-0.2 -0.997 28.5-156.8-143.4 138.3 8.3 1.5 12.8 94 96 A N S S+ 0 0 12 -13,-2.8 2,-0.3 -2,-0.3 -12,-0.2 0.233 86.6 46.7 -93.3 14.5 10.9 4.1 13.8 95 97 A S > - 0 0 3 -14,-0.3 4,-2.6 -13,-0.2 5,-0.2 -0.828 58.6-159.0-162.0 113.7 13.5 1.5 14.8 96 98 A L H > S+ 0 0 10 -2,-0.3 4,-1.7 2,-0.2 5,-0.1 0.918 100.6 45.4 -52.9 -50.6 14.7 -1.7 13.1 97 99 A R H > S+ 0 0 64 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.885 114.7 46.9 -65.7 -42.1 15.9 -3.2 16.3 98 100 A N H > S+ 0 0 33 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.887 108.8 54.1 -70.9 -36.8 12.8 -2.4 18.3 99 101 A C H X S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.2 -1,-0.2 0.898 108.2 50.9 -64.2 -37.1 10.4 -3.6 15.6 100 102 A L H X S+ 0 0 14 -4,-1.7 4,-1.6 2,-0.2 -1,-0.2 0.904 110.1 48.1 -64.4 -44.8 12.3 -7.0 15.7 101 103 A T H < S+ 0 0 97 -4,-1.8 4,-0.4 2,-0.2 3,-0.3 0.941 113.8 49.3 -57.8 -46.3 12.0 -7.2 19.4 102 104 A A H >< S+ 0 0 15 -4,-2.7 3,-1.1 1,-0.2 -2,-0.2 0.899 110.5 48.9 -58.6 -45.5 8.3 -6.3 19.0 103 105 A L H 3< S+ 0 0 14 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.765 104.2 61.2 -68.5 -25.9 7.7 -9.0 16.3 104 106 A Q T 3< S+ 0 0 55 -4,-1.6 2,-0.6 -3,-0.3 -1,-0.2 0.511 75.2 110.1 -80.4 -7.7 9.4 -11.7 18.4 105 107 A S <> - 0 0 46 -3,-1.1 4,-3.0 -4,-0.4 5,-0.2 -0.622 57.9-156.6 -72.3 114.5 6.8 -11.4 21.2 106 108 A S H > S+ 0 0 64 -2,-0.6 4,-1.5 1,-0.2 5,-0.2 0.745 93.5 57.1 -64.5 -25.5 4.8 -14.6 21.1 107 109 A L H 4 S+ 0 0 155 2,-0.2 -1,-0.2 1,-0.1 -2,-0.0 0.934 114.6 37.2 -68.3 -47.5 1.9 -12.7 22.9 108 110 A A H 4 S+ 0 0 75 -6,-0.2 -2,-0.2 1,-0.2 -1,-0.1 0.887 125.7 38.6 -68.4 -41.7 1.8 -10.1 20.1 109 111 A N H >< S- 0 0 20 -4,-3.0 3,-2.1 -7,-0.1 -3,-0.2 0.585 89.4-142.5 -91.7 -13.2 2.5 -12.6 17.2 110 112 A E T 3< - 0 0 154 -4,-1.5 -3,-0.1 1,-0.3 -4,-0.1 0.744 61.3 -77.4 56.5 29.1 0.5 -15.6 18.4 111 113 A N T 3 S+ 0 0 98 -5,-0.2 -1,-0.3 -6,-0.2 -5,-0.1 0.806 108.3 121.6 45.8 36.1 3.3 -17.8 17.1 112 114 A K < + 0 0 79 -3,-2.1 -65,-1.9 -6,-0.1 2,-0.5 0.240 44.3 86.6-110.3 10.7 1.8 -17.1 13.6 113 115 A I E - e 0 47A 11 -67,-0.2 -65,-0.2 1,-0.2 3,-0.1 -0.956 51.8-176.0-102.4 127.9 4.9 -15.6 12.0 114 116 A E E + 0 0 31 -67,-2.2 2,-0.3 -2,-0.5 -66,-0.2 0.919 65.8 4.1 -87.9 -49.3 7.2 -18.3 10.6 115 117 A R E - 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