==== 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 ISOMERASE 26-JAN-09 3FZW . COMPND 2 MOLECULE: STEROID DELTA-ISOMERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS PUTIDA; . AUTHOR J.M.M.CAAVEIRO,D.RINGE,G.A.PETSKO . 255 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12577.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 185 72.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 4.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 71 27.8 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 . 4 1.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.8 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 . 4 1.6 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 . 11 4.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 21 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 60 23.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.8 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 0 0 0 2 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 5 1 2 0 2 0 0 0 0 0 2 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 0 0 2 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 M 0 0 117 0, 0.0 2,-0.1 0, 0.0 111,-0.1 0.000 360.0 360.0 360.0 148.3 13.7 -17.6 -18.3 2 2 A N - 0 0 131 1,-0.3 108,-0.1 108,-0.1 3,-0.0 -0.091 360.0 -26.9 -98.7-152.0 10.2 -17.3 -16.8 3 3 A L S S- 0 0 80 106,-0.3 -1,-0.3 107,-0.1 106,-0.2 -0.482 85.6-110.0 -62.0 126.5 9.7 -15.1 -13.6 4 4 A P - 0 0 2 0, 0.0 76,-0.5 0, 0.0 103,-0.1 -0.310 23.9-130.0 -67.7 140.8 13.0 -15.2 -12.0 5 5 A T > - 0 0 75 74,-0.1 4,-2.8 75,-0.1 5,-0.2 -0.186 38.5 -93.7 -68.3 170.1 13.4 -17.0 -8.7 6 6 A A H > S+ 0 0 7 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.946 129.7 48.3 -54.3 -42.6 15.1 -15.2 -5.8 7 7 A Q H > S+ 0 0 142 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.907 110.9 50.5 -65.5 -41.4 18.4 -16.7 -6.7 8 8 A E H > S+ 0 0 74 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.898 107.7 53.5 -64.2 -36.7 17.9 -15.7 -10.4 9 9 A V H X S+ 0 0 0 -4,-2.8 4,-2.8 1,-0.2 5,-0.3 0.921 107.3 51.9 -60.7 -46.1 17.0 -12.1 -9.3 10 10 A Q H X S+ 0 0 48 -4,-2.3 4,-2.2 -5,-0.2 -1,-0.2 0.918 111.6 46.9 -57.3 -42.8 20.3 -11.9 -7.4 11 11 A G H X S+ 0 0 45 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.907 113.0 47.5 -66.2 -41.9 22.2 -13.1 -10.5 12 12 A L H X S+ 0 0 25 -4,-2.7 4,-2.3 2,-0.2 -1,-0.2 0.899 112.3 48.6 -66.7 -42.0 20.5 -10.7 -12.9 13 13 A M H X S+ 0 0 0 -4,-2.8 4,-1.7 1,-0.2 -1,-0.2 0.898 112.0 49.4 -66.0 -38.9 20.9 -7.7 -10.6 14 14 A A H X S+ 0 0 28 -4,-2.2 4,-2.0 -5,-0.3 -1,-0.2 0.874 109.7 52.3 -62.6 -40.1 24.6 -8.5 -10.1 15 15 A R H X S+ 0 0 109 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.897 103.9 57.4 -59.4 -44.3 25.0 -8.9 -13.9 16 16 A Y H X S+ 0 0 8 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.928 106.9 48.2 -54.1 -46.0 23.4 -5.5 -14.4 17 17 A I H X S+ 0 0 6 -4,-1.7 4,-2.7 1,-0.2 -1,-0.2 0.911 108.7 54.2 -66.0 -36.2 26.1 -3.9 -12.2 18 18 A E H X S+ 0 0 125 -4,-2.0 4,-1.4 1,-0.2 -1,-0.2 0.882 110.0 47.4 -58.9 -42.2 28.9 -5.7 -14.1 19 19 A L H X>S+ 0 0 11 -4,-2.3 5,-2.1 2,-0.2 4,-0.8 0.893 110.7 50.4 -72.5 -35.4 27.6 -4.3 -17.3 20 20 A V H ><5S+ 0 0 9 -4,-2.5 3,-1.2 1,-0.2 -2,-0.2 0.949 107.5 56.4 -60.0 -44.7 27.3 -0.8 -15.9 21 21 A D H 3<5S+ 0 0 35 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.816 114.0 37.4 -59.1 -36.6 30.9 -1.1 -14.7 22 22 A V H 3<5S- 0 0 103 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.441 110.4-120.3 -97.0 1.2 32.3 -1.9 -18.1 23 23 A G T <<5 + 0 0 32 -3,-1.2 2,-2.0 -4,-0.8 3,-0.2 0.771 50.5 162.7 74.4 29.8 29.9 0.5 -19.9 24 24 A D >< + 0 0 62 -5,-2.1 4,-2.0 1,-0.2 -1,-0.2 -0.540 6.2 170.9 -86.5 79.1 28.2 -2.2 -22.1 25 25 A I H > S+ 0 0 30 -2,-2.0 4,-2.7 1,-0.2 5,-0.2 0.898 70.5 54.3 -60.2 -39.8 25.3 -0.0 -23.0 26 26 A E H > S+ 0 0 159 1,-0.2 4,-1.9 -3,-0.2 -1,-0.2 0.925 110.2 46.9 -67.3 -36.7 23.9 -2.4 -25.6 27 27 A A H > S+ 0 0 10 2,-0.2 4,-0.9 1,-0.2 -1,-0.2 0.840 110.9 53.0 -70.6 -36.5 23.8 -5.3 -23.1 28 28 A I H >X S+ 0 0 0 -4,-2.0 3,-1.2 2,-0.2 4,-0.7 0.951 108.0 50.0 -61.2 -50.2 22.2 -3.2 -20.4 29 29 A V H >< S+ 0 0 20 -4,-2.7 3,-1.5 1,-0.3 -2,-0.2 0.908 106.4 56.0 -55.6 -41.1 19.4 -2.1 -22.8 30 30 A Q H 3< S+ 0 0 141 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.738 97.4 64.0 -67.4 -16.9 18.8 -5.8 -23.7 31 31 A M H << S+ 0 0 15 -3,-1.2 82,-2.9 -4,-0.9 -1,-0.3 0.743 93.3 80.2 -74.9 -23.2 18.3 -6.5 -20.0 32 32 A Y E << S-a 113 0A 0 -3,-1.5 82,-0.2 -4,-0.7 2,-0.1 -0.588 89.0-108.7 -87.8 150.3 15.2 -4.2 -19.9 33 33 A A E > - 0 0 2 80,-2.9 3,-2.1 -2,-0.2 16,-0.1 -0.343 38.8-106.3 -62.9 155.0 11.7 -5.1 -21.2 34 34 A D E 3 S+ 0 0 111 1,-0.3 16,-2.2 15,-0.1 17,-0.2 0.816 120.6 31.5 -63.4 -28.0 10.8 -3.3 -24.4 35 35 A D E 3 S+ 0 0 91 14,-0.2 -1,-0.3 15,-0.1 -2,-0.0 -0.096 90.2 143.9-115.0 25.6 8.5 -1.0 -22.5 36 36 A A E < - 0 0 0 -3,-2.1 13,-2.7 77,-0.2 2,-0.4 -0.134 40.5-133.3 -56.9 162.6 10.3 -0.8 -19.1 37 37 A T E -aB 115 48A 30 77,-1.9 79,-2.0 11,-0.2 2,-0.4 -0.943 12.6-162.1-116.3 151.0 10.4 2.3 -17.0 38 38 A V E -aB 116 47A 2 9,-1.8 9,-2.4 -2,-0.4 2,-0.5 -0.994 6.7-173.3-128.4 130.6 13.4 3.9 -15.3 39 39 A E E -a 117 0A 37 77,-2.4 79,-2.9 -2,-0.4 3,-0.4 -0.979 16.9-171.0-119.9 112.4 13.2 6.4 -12.4 40 40 A N S S+ 0 0 44 1,-0.6 2,-0.1 -2,-0.5 79,-0.1 -0.819 79.7 19.7-154.4 101.9 16.8 7.6 -11.8 41 41 A P S > S- 0 0 34 0, 0.0 3,-2.5 0, 0.0 -1,-0.6 0.521 104.0-120.4 -77.4 152.2 16.9 9.3 -9.3 42 42 A F T 3 S+ 0 0 28 76,-2.7 162,-0.4 -3,-0.4 78,-0.3 -0.336 102.9 50.5 -53.3 137.6 13.7 8.1 -7.8 43 43 A G T 3 S+ 0 0 32 1,-0.6 -1,-0.3 160,-0.1 76,-0.0 0.044 92.2 95.3 109.3 -23.2 11.6 11.2 -7.4 44 44 A Q S < S- 0 0 114 -3,-2.5 -1,-0.6 1,-0.1 161,-0.0 -0.647 91.0 -83.8 -94.1 158.6 12.1 12.3 -11.0 45 45 A P - 0 0 97 0, 0.0 -5,-0.4 0, 0.0 -1,-0.1 -0.245 51.4-106.9 -61.1 144.9 9.7 11.4 -13.8 46 46 A P - 0 0 52 0, 0.0 2,-0.3 0, 0.0 -7,-0.2 -0.389 22.2-141.3 -66.8 146.7 10.0 8.0 -15.3 47 47 A I E -B 38 0A 43 -9,-2.4 -9,-1.8 -2,-0.1 2,-0.4 -0.816 21.6-144.4 -98.6 159.4 11.4 7.5 -18.8 48 48 A H E +B 37 0A 102 -2,-0.3 4,-0.5 -11,-0.2 -11,-0.2 -0.980 43.3 10.6-133.5 136.0 9.8 4.8 -20.9 49 49 A G S > S- 0 0 16 -13,-2.7 4,-2.4 -2,-0.4 -14,-0.2 0.200 82.7 -75.2 89.0 158.7 10.9 2.2 -23.5 50 50 A R H > S+ 0 0 78 -16,-2.2 4,-2.7 1,-0.2 -1,-0.1 0.798 123.6 52.2 -65.5 -34.9 14.2 0.9 -24.7 51 51 A E H > S+ 0 0 129 -17,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.952 111.8 45.0 -68.7 -44.8 15.2 3.9 -26.8 52 52 A Q H > S+ 0 0 102 -4,-0.5 4,-2.3 1,-0.2 -2,-0.2 0.878 115.3 50.0 -61.6 -38.7 14.7 6.4 -24.0 53 53 A I H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.921 110.0 49.4 -66.5 -44.2 16.5 4.0 -21.7 54 54 A A H X S+ 0 0 2 -4,-2.7 4,-2.5 -5,-0.2 -2,-0.2 0.924 110.8 50.5 -55.1 -46.6 19.4 3.6 -24.2 55 55 A A H X S+ 0 0 31 -4,-2.7 4,-2.5 1,-0.2 5,-0.2 0.920 109.5 52.3 -59.0 -42.2 19.7 7.4 -24.6 56 56 A F H X S+ 0 0 53 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.931 112.3 43.7 -63.3 -44.8 19.8 7.7 -20.8 57 57 A Y H X S+ 0 0 8 -4,-2.6 4,-2.7 2,-0.2 5,-0.4 0.859 110.1 54.7 -69.7 -30.3 22.6 5.2 -20.4 58 58 A R H X S+ 0 0 123 -4,-2.5 4,-1.9 -5,-0.2 -2,-0.2 0.925 111.9 45.6 -66.2 -38.1 24.6 6.6 -23.3 59 59 A Q H < S+ 0 0 158 -4,-2.5 4,-0.3 -5,-0.2 -2,-0.2 0.892 118.6 43.0 -68.2 -41.0 24.4 10.0 -21.6 60 60 A G H < S+ 0 0 46 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.880 132.4 16.3 -75.3 -37.8 25.3 8.6 -18.2 61 61 A L H >< S+ 0 0 19 -4,-2.7 3,-1.9 -5,-0.2 5,-0.3 0.461 95.5 95.9-113.9 -10.7 28.1 6.2 -19.1 62 62 A G T 3< S+ 0 0 51 -4,-1.9 -3,-0.1 -5,-0.4 -1,-0.1 0.678 74.6 68.3 -66.7 -20.2 29.2 7.2 -22.6 63 63 A G T 3 S- 0 0 67 -4,-0.3 -1,-0.3 -5,-0.1 -2,-0.1 0.612 99.7-134.7 -71.1 -14.9 32.1 9.4 -21.3 64 64 A G S < S+ 0 0 62 -3,-1.9 -2,-0.1 1,-0.1 -3,-0.1 0.437 77.5 102.3 81.3 -3.2 33.8 6.1 -20.2 65 65 A K + 0 0 153 26,-0.1 2,-0.4 2,-0.0 26,-0.1 -0.168 53.1 104.5-109.6 38.1 34.9 7.3 -16.7 66 66 A V + 0 0 25 -5,-0.3 2,-0.3 24,-0.1 24,-0.2 -0.976 41.4 178.7-116.3 136.0 32.2 5.6 -14.6 67 67 A R E -C 89 0A 139 22,-2.3 22,-2.6 -2,-0.4 2,-0.3 -0.925 5.6-169.5-123.5 162.7 32.8 2.4 -12.6 68 68 A A E +C 88 0A 6 -2,-0.3 2,-0.3 20,-0.2 20,-0.2 -0.992 6.9 174.6-150.7 147.0 30.3 0.6 -10.4 69 69 A C E -C 87 0A 82 18,-2.2 18,-2.5 -2,-0.3 -2,-0.0 -0.995 35.9-104.9-154.0 143.3 30.4 -2.1 -7.8 70 70 A L E -C 86 0A 53 -2,-0.3 16,-0.3 16,-0.2 4,-0.0 -0.324 22.5-168.5 -58.1 141.4 28.1 -3.9 -5.4 71 71 A T S S- 0 0 71 14,-2.5 15,-0.2 1,-0.2 -1,-0.1 0.093 72.3 -1.3-121.2 20.3 28.7 -2.8 -1.7 72 72 A G S S- 0 0 25 13,-0.6 -1,-0.2 154,-0.0 126,-0.0 -0.932 96.6 -55.7 172.9 174.6 26.5 -5.6 -0.3 73 73 A P - 0 0 48 0, 0.0 2,-0.5 0, 0.0 -2,-0.1 -0.312 51.7-106.3 -70.1 152.4 24.4 -8.5 -1.3 74 74 A V - 0 0 7 10,-0.1 2,-0.4 -64,-0.1 10,-0.2 -0.648 31.1-143.0 -73.1 125.8 21.5 -8.4 -3.6 75 75 A R E -D 83 0A 2 8,-3.0 8,-2.6 -2,-0.5 2,-0.4 -0.806 24.2-170.5 -86.8 133.9 18.2 -8.7 -1.6 76 76 A A E -D 82 0A 0 -2,-0.4 6,-0.3 6,-0.2 173,-0.2 -0.987 13.0-151.8-132.3 142.1 15.6 -10.7 -3.5 77 77 A S - 0 0 0 4,-3.0 3,-0.5 -2,-0.4 -68,-0.2 -0.354 30.1-113.5 -97.1 178.7 11.9 -11.5 -3.1 78 78 A H S S+ 0 0 126 90,-0.5 91,-0.1 168,-0.2 -72,-0.1 0.326 108.4 65.3 -91.4 8.9 9.9 -14.5 -4.2 79 79 A N S S- 0 0 62 89,-0.2 -1,-0.2 2,-0.2 -74,-0.1 -0.141 122.7 -89.5-124.0 32.7 7.9 -12.4 -6.7 80 80 A G S S+ 0 0 0 -3,-0.5 27,-2.7 -76,-0.5 2,-0.3 0.646 90.6 113.2 80.1 17.0 10.7 -11.4 -9.1 81 81 A C E + E 0 106A 6 25,-0.2 -4,-3.0 87,-0.1 2,-0.3 -0.827 34.8 167.6-118.6 164.6 11.9 -8.2 -7.4 82 82 A G E -DE 76 105A 0 23,-2.6 23,-2.6 -2,-0.3 2,-0.3 -0.985 21.5-143.2-163.7 174.2 15.0 -7.2 -5.7 83 83 A A E -DE 75 104A 0 -8,-2.6 -8,-3.0 -2,-0.3 21,-0.2 -0.997 16.6-175.7-145.5 144.8 17.1 -4.4 -4.2 84 84 A M E - E 0 103A 0 19,-2.0 19,-1.9 -2,-0.3 2,-0.4 -1.000 19.3-138.2-144.0 145.1 20.9 -3.8 -4.1 85 85 A P E + E 0 102A 2 0, 0.0 -14,-2.5 0, 0.0 -13,-0.6 -0.819 36.1 155.1 -99.1 137.5 23.3 -1.4 -2.7 86 86 A F E -CE 70 101A 10 15,-2.6 15,-2.8 -2,-0.4 2,-0.4 -0.937 34.8-126.8-153.8 170.4 26.2 -0.2 -4.8 87 87 A R E -CE 69 100A 87 -18,-2.5 -18,-2.2 -2,-0.3 2,-0.4 -0.994 13.8-156.8-123.8 135.5 28.7 2.6 -5.3 88 88 A V E -CE 68 99A 22 11,-2.8 11,-2.7 -2,-0.4 2,-0.5 -0.909 8.6-156.4-110.0 137.4 29.3 4.4 -8.6 89 89 A E E +CE 67 98A 100 -22,-2.6 -22,-2.3 -2,-0.4 2,-0.2 -0.965 32.9 127.0-113.6 129.8 32.7 6.2 -9.1 90 90 A M E - E 0 97A 44 7,-1.7 7,-2.9 -2,-0.5 2,-0.4 -0.780 57.5 -73.0-157.5-164.2 33.0 9.1 -11.6 91 91 A V E + E 0 96A 80 -2,-0.2 2,-0.4 5,-0.2 -26,-0.1 -0.914 36.9 178.9-108.2 137.7 34.2 12.6 -11.8 92 92 A W E > S- E 0 95A 161 3,-2.7 3,-1.9 -2,-0.4 -2,-0.0 -0.990 75.5 -12.3-133.4 127.5 32.3 15.6 -10.2 93 93 A N T 3 S- 0 0 131 -2,-0.4 -1,-0.1 1,-0.3 0, 0.0 0.880 129.3 -53.0 51.2 42.7 33.8 19.1 -10.5 94 94 A G T 3 S+ 0 0 71 1,-0.2 -1,-0.3 0, 0.0 -3,-0.0 0.544 119.3 94.7 79.2 3.4 37.1 17.9 -11.8 95 95 A Q E < S-E 92 0A 102 -3,-1.9 -3,-2.7 0, 0.0 2,-0.3 -0.938 84.0 -95.4-129.4 153.1 37.7 15.4 -8.9 96 96 A P E +E 91 0A 109 0, 0.0 2,-0.3 0, 0.0 -5,-0.2 -0.516 51.8 177.8 -64.7 126.4 37.1 11.7 -8.4 97 97 A C E -E 90 0A 7 -7,-2.9 -7,-1.7 -2,-0.3 2,-0.4 -0.778 21.4-144.5-127.1 167.5 33.8 11.2 -6.6 98 98 A A E -EF 89 126A 7 28,-2.4 28,-2.9 -2,-0.3 2,-0.4 -0.989 7.4-164.1-135.0 143.6 31.7 8.4 -5.3 99 99 A L E -EF 88 125A 13 -11,-2.7 -11,-2.8 -2,-0.4 2,-0.4 -0.989 13.0-143.6-129.3 124.1 27.9 8.1 -5.2 100 100 A D E +E 87 0A 13 24,-2.1 2,-0.3 -2,-0.4 21,-0.3 -0.759 28.4 174.9 -85.4 134.8 26.0 5.5 -3.1 101 101 A V E -E 86 0A 5 -15,-2.8 -15,-2.6 -2,-0.4 2,-0.4 -0.928 25.5-153.8-139.4 151.2 22.9 4.1 -4.8 102 102 A I E -EG 85 119A 0 17,-2.0 17,-3.2 -2,-0.3 2,-0.4 -0.990 14.9-157.8-123.2 126.3 20.2 1.5 -4.1 103 103 A N E -EG 84 118A 2 -19,-1.9 -19,-2.0 -2,-0.4 2,-0.5 -0.873 3.5-164.8-100.4 136.1 18.4 0.1 -7.1 104 104 A V E -EG 83 117A 6 13,-2.7 13,-2.1 -2,-0.4 2,-0.4 -0.979 19.4-179.3-113.0 125.4 15.0 -1.6 -6.7 105 105 A M E -EG 82 116A 1 -23,-2.6 -23,-2.6 -2,-0.5 2,-0.4 -0.973 23.0-157.2-132.9 143.3 14.0 -3.6 -9.7 106 106 A R E -EG 81 115A 103 9,-2.0 8,-2.8 -2,-0.4 9,-1.7 -0.992 16.4-152.9-113.8 133.6 11.1 -5.8 -10.8 107 107 A F E - G 0 113A 1 -27,-2.7 6,-0.2 -2,-0.4 2,-0.1 -0.753 12.0-130.4 -99.3 148.7 11.6 -8.5 -13.5 108 108 A D > - 0 0 18 4,-3.0 3,-2.1 -2,-0.3 -1,-0.1 -0.191 38.9 -85.2 -89.8-174.0 8.9 -9.7 -15.8 109 109 A E T 3 S+ 0 0 132 1,-0.3 -106,-0.3 -106,-0.2 -1,-0.1 0.372 128.6 54.4 -78.8 5.5 7.9 -13.2 -16.6 110 110 A H T 3 S- 0 0 104 2,-0.2 -1,-0.3 -108,-0.1 -107,-0.1 0.174 119.8-105.6-112.8 10.3 10.7 -13.3 -19.2 111 111 A G S < S+ 0 0 9 -3,-2.1 2,-0.3 1,-0.3 -2,-0.1 0.706 79.5 128.9 79.8 12.6 13.5 -12.3 -16.8 112 112 A R - 0 0 106 -111,-0.1 -4,-3.0 -80,-0.0 2,-0.5 -0.790 68.8 -98.7 -99.9 154.4 13.7 -8.7 -18.3 113 113 A I E +aG 32 107A 0 -82,-2.9 -80,-2.9 -2,-0.3 -6,-0.3 -0.512 38.3 176.5 -75.1 121.8 13.6 -5.6 -16.1 114 114 A Q E + 0 0 35 -8,-2.8 -77,-1.9 -2,-0.5 2,-0.4 0.859 69.9 18.5 -90.3 -38.4 10.2 -4.1 -16.1 115 115 A T E -aG 37 106A 33 -9,-1.7 -9,-2.0 -79,-0.2 2,-0.4 -0.999 60.6-170.0-138.9 138.2 10.8 -1.3 -13.6 116 116 A M E +aG 38 105A 0 -79,-2.0 -77,-2.4 -2,-0.4 2,-0.4 -0.995 5.2 179.2-121.8 129.4 14.0 0.3 -12.4 117 117 A Q E -aG 39 104A 47 -13,-2.1 -13,-2.7 -2,-0.4 2,-0.7 -0.974 9.3-164.4-132.3 117.7 14.1 2.8 -9.4 118 118 A A E - 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