==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE 14-DEC-99 1DMM . COMPND 2 MOLECULE: STEROID DELTA-ISOMERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS PUTIDA; . AUTHOR D.H.KIM,D.S.JANG,G.H.NAM,B.H.OH,K.Y.CHOI . 123 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7223.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 92 74.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 4.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 35 28.5 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 . 2 1.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 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 . 1 0.8 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 . 9 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 9 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 29 23.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 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 1 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 0 3 0 1 0 1 0 0 0 0 0 1 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 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 2 A N 0 0 102 0, 0.0 104,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 172.3 14.1 60.8 54.4 2 3 A L - 0 0 80 104,-0.1 104,-0.2 105,-0.1 75,-0.1 -0.496 360.0-110.0 -59.4 116.0 14.0 57.6 52.3 3 4 A P - 0 0 4 0, 0.0 74,-0.4 0, 0.0 -1,-0.1 -0.147 26.7-125.9 -53.9 144.3 10.3 57.4 52.0 4 5 A T > - 0 0 73 1,-0.1 4,-2.6 72,-0.1 5,-0.2 -0.351 36.5 -94.9 -79.7 172.5 8.6 54.5 53.8 5 6 A A H > S+ 0 0 24 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.916 130.0 50.5 -55.6 -41.3 6.4 52.2 51.8 6 7 A Q H > S+ 0 0 159 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.848 109.7 48.9 -65.3 -37.3 3.4 54.4 53.0 7 8 A E H > S+ 0 0 97 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.887 106.5 56.8 -70.7 -38.4 5.1 57.6 51.9 8 9 A V H X S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.2 5,-0.2 0.916 105.5 51.0 -59.2 -42.7 6.0 56.2 48.5 9 10 A Q H X S+ 0 0 88 -4,-1.7 4,-1.6 1,-0.2 -1,-0.2 0.892 112.3 47.2 -62.7 -39.3 2.3 55.5 47.8 10 11 A G H X S+ 0 0 44 -4,-1.4 4,-2.0 2,-0.2 -1,-0.2 0.900 111.9 49.2 -69.1 -40.9 1.4 59.1 48.8 11 12 A L H X S+ 0 0 40 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.890 112.8 46.3 -65.6 -41.4 4.1 60.6 46.7 12 13 A M H X S+ 0 0 0 -4,-2.4 4,-1.5 2,-0.2 -1,-0.2 0.835 110.6 52.3 -73.0 -30.5 3.3 58.6 43.6 13 14 A A H X S+ 0 0 29 -4,-1.6 4,-1.5 -5,-0.2 -2,-0.2 0.926 110.3 49.2 -68.8 -43.2 -0.5 59.3 43.9 14 15 A R H X S+ 0 0 124 -4,-2.0 4,-2.3 1,-0.2 3,-0.3 0.918 105.2 60.2 -58.0 -45.6 0.3 63.0 44.2 15 16 A Y H X S+ 0 0 5 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.887 104.8 46.1 -49.8 -47.1 2.5 62.7 41.1 16 17 A I H X S+ 0 0 3 -4,-1.5 4,-2.3 2,-0.2 -1,-0.2 0.822 108.6 57.7 -67.4 -32.5 -0.4 61.5 38.9 17 18 A E H X S+ 0 0 122 -4,-1.5 4,-2.2 -3,-0.3 5,-0.3 0.927 107.9 47.1 -61.0 -46.6 -2.6 64.4 40.4 18 19 A L H X>S+ 0 0 19 -4,-2.3 4,-2.1 1,-0.2 5,-1.4 0.887 112.0 49.2 -63.5 -43.3 0.0 66.8 39.1 19 20 A V H <5S+ 0 0 15 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.880 110.0 53.2 -64.1 -38.0 0.2 65.2 35.7 20 21 A D H <5S+ 0 0 56 -4,-2.3 43,-0.2 1,-0.2 -2,-0.2 0.931 116.1 36.1 -63.2 -48.9 -3.6 65.2 35.5 21 22 A V H <5S- 0 0 109 -4,-2.2 -1,-0.2 -5,-0.1 -2,-0.2 0.785 109.5-126.9 -76.5 -26.5 -4.0 69.0 36.2 22 23 A G T <5 + 0 0 28 -4,-2.1 2,-1.6 -5,-0.3 -3,-0.2 0.787 46.0 163.6 87.9 30.3 -0.8 69.7 34.2 23 24 A D >< + 0 0 81 -5,-1.4 4,-2.1 1,-0.2 3,-0.4 -0.623 10.2 179.4 -84.8 83.3 1.3 71.7 36.7 24 25 A I H > S+ 0 0 17 -2,-1.6 4,-2.8 1,-0.2 5,-0.2 0.883 76.2 53.1 -53.5 -46.3 4.7 71.3 35.0 25 26 A E H > S+ 0 0 143 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.874 111.2 46.7 -62.0 -36.8 6.6 73.3 37.5 26 27 A A H 4 S+ 0 0 22 -3,-0.4 4,-0.4 2,-0.2 -1,-0.2 0.845 112.9 49.5 -73.8 -34.1 5.3 71.3 40.4 27 28 A I H >X S+ 0 0 0 -4,-2.1 3,-2.0 1,-0.2 4,-0.6 0.956 108.6 52.9 -66.3 -50.4 6.0 68.0 38.6 28 29 A V H >< S+ 0 0 18 -4,-2.8 3,-1.1 1,-0.3 -1,-0.2 0.839 104.9 55.7 -53.2 -37.3 9.6 69.1 37.8 29 30 A Q T 3< S+ 0 0 124 -4,-1.3 -1,-0.3 1,-0.3 -2,-0.2 0.607 93.5 68.3 -75.9 -10.2 10.2 69.8 41.4 30 31 A M T <4 S+ 0 0 12 -3,-2.0 80,-2.5 -4,-0.4 -1,-0.3 0.689 91.6 79.8 -78.7 -19.1 9.3 66.3 42.4 31 32 A Y E << S-a 110 0A 0 -3,-1.1 80,-0.2 -4,-0.6 2,-0.1 -0.561 92.6-106.6 -87.6 151.3 12.4 65.1 40.6 32 33 A A E > - 0 0 2 78,-2.7 3,-1.8 -2,-0.2 16,-0.1 -0.418 40.1-107.6 -66.9 154.9 15.9 65.3 42.0 33 34 A D E 3 S+ 0 0 112 1,-0.3 16,-2.2 15,-0.1 17,-0.3 0.805 120.0 32.3 -56.4 -31.2 17.9 68.0 40.3 34 35 A D E 3 S+ 0 0 78 14,-0.2 -1,-0.3 15,-0.1 -2,-0.0 -0.008 89.1 144.5-115.2 26.7 19.9 65.4 38.4 35 36 A A E < - 0 0 0 -3,-1.8 13,-3.3 12,-0.1 2,-0.4 -0.109 39.6-139.4 -59.4 159.0 17.2 62.8 38.0 36 37 A T E -aB 112 47A 38 75,-1.7 77,-1.6 11,-0.2 2,-0.4 -0.960 12.0-160.5-124.1 147.8 17.1 60.6 34.9 37 38 A V E -aB 113 46A 1 9,-2.5 9,-2.5 -2,-0.4 2,-0.4 -0.967 8.7-166.5-127.4 140.1 13.9 59.6 33.1 38 39 A E E -a 114 0A 39 75,-2.0 77,-2.7 -2,-0.4 3,-0.3 -0.890 18.0-171.5-129.5 98.1 13.4 56.7 30.6 39 40 A D S S+ 0 0 46 -2,-0.4 2,-0.1 1,-0.4 77,-0.1 -0.936 78.8 17.1-141.2 109.3 10.1 57.2 28.8 40 41 A P S > S- 0 0 23 0, 0.0 3,-1.9 0, 0.0 -1,-0.4 0.618 104.9-116.5 -78.6 157.9 9.4 54.9 27.2 41 42 A F T 3 S+ 0 0 93 74,-3.1 76,-0.2 -3,-0.3 -2,-0.1 -0.362 103.0 46.9 -59.6 132.7 11.8 52.4 28.7 42 43 A G T 3 S+ 0 0 64 1,-0.6 -1,-0.2 74,-0.1 74,-0.0 0.077 91.8 99.4 118.6 -19.5 14.2 51.3 25.9 43 44 A Q S < S- 0 0 108 -3,-1.9 -1,-0.6 1,-0.1 0, 0.0 -0.635 90.3 -86.9 -94.6 152.2 14.9 54.9 24.8 44 45 A P - 0 0 106 0, 0.0 -5,-0.3 0, 0.0 -1,-0.1 -0.309 55.4-109.2 -57.4 144.3 18.0 56.8 25.9 45 46 A P - 0 0 73 0, 0.0 2,-0.4 0, 0.0 -7,-0.2 -0.275 18.1-132.1 -75.3 161.3 17.3 58.5 29.2 46 47 A I E -B 37 0A 36 -9,-2.5 -9,-2.5 6,-0.0 2,-0.4 -0.907 25.1-151.6-110.2 141.5 16.9 62.3 29.7 47 48 A H E > +B 36 0A 97 -2,-0.4 4,-0.5 -11,-0.2 -11,-0.2 -0.952 43.4 10.2-122.5 135.4 18.9 63.7 32.6 48 49 A G H > S- 0 0 10 -13,-3.3 4,-2.3 -2,-0.4 -14,-0.2 0.240 82.9 -79.4 86.9 152.6 18.4 66.7 34.9 49 50 A R H > S+ 0 0 60 -16,-2.2 4,-2.6 1,-0.2 5,-0.2 0.817 122.7 58.7 -58.0 -35.5 15.6 69.1 35.6 50 51 A E H > S+ 0 0 174 -17,-0.3 4,-2.0 1,-0.2 -1,-0.2 0.969 111.7 39.4 -61.2 -52.6 16.1 71.2 32.5 51 52 A Q H X S+ 0 0 110 -4,-0.5 4,-2.3 1,-0.2 -2,-0.2 0.861 115.4 53.1 -66.1 -32.2 15.7 68.3 30.1 52 53 A I H X S+ 0 0 0 -4,-2.3 4,-2.8 2,-0.2 5,-0.2 0.900 108.0 49.8 -70.8 -38.6 12.8 66.8 32.1 53 54 A A H X S+ 0 0 25 -4,-2.6 4,-2.5 -5,-0.2 5,-0.2 0.936 111.8 48.9 -65.7 -41.7 10.9 70.1 32.1 54 55 A A H X S+ 0 0 59 -4,-2.0 4,-2.3 -5,-0.2 -2,-0.2 0.918 111.1 51.1 -61.1 -43.8 11.4 70.4 28.4 55 56 A F H X S+ 0 0 63 -4,-2.3 4,-1.6 1,-0.2 -2,-0.2 0.935 113.3 43.5 -58.8 -50.1 10.1 66.8 28.0 56 57 A F H X S+ 0 0 10 -4,-2.8 4,-3.1 2,-0.2 -1,-0.2 0.820 111.5 53.3 -68.6 -32.5 7.0 67.4 30.1 57 58 A R H < S+ 0 0 141 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.960 109.4 49.9 -65.6 -48.0 6.2 70.7 28.4 58 59 A Q H < S+ 0 0 179 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.851 120.6 35.9 -54.4 -40.7 6.4 69.0 25.0 59 60 A G H < 0 0 58 -4,-1.6 -2,-0.2 -5,-0.2 -1,-0.2 0.865 360.0 360.0 -86.3 -40.6 4.0 66.2 26.2 60 61 A L < 0 0 61 -4,-3.1 -1,-0.1 -5,-0.1 -36,-0.1 -0.762 360.0 360.0 -85.7 360.0 1.6 68.0 28.5 61 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 62 65 A K 0 0 205 0, 0.0 2,-0.4 0, 0.0 26,-0.2 0.000 360.0 360.0 360.0 76.5 -5.8 68.7 27.1 63 66 A V - 0 0 43 -43,-0.2 2,-0.4 24,-0.1 24,-0.2 -0.998 360.0-170.2-138.8 138.5 -4.6 65.6 28.9 64 67 A R E -C 86 0A 137 22,-1.7 22,-2.8 -2,-0.4 2,-0.4 -0.967 5.1-169.4-128.9 146.1 -6.0 63.7 31.9 65 68 A A E -C 85 0A 4 -2,-0.4 2,-0.4 20,-0.2 20,-0.2 -0.982 3.6-177.4-133.5 145.7 -4.3 60.9 33.9 66 69 A C E -C 84 0A 50 18,-1.9 18,-2.4 -2,-0.4 2,-0.4 -1.000 32.4-114.5-146.5 147.0 -5.6 58.5 36.4 67 70 A L E -C 83 0A 64 -2,-0.4 16,-0.3 16,-0.2 4,-0.1 -0.636 25.5-168.5 -72.4 129.5 -4.3 55.8 38.7 68 71 A T + 0 0 83 14,-2.4 15,-0.2 -2,-0.4 -1,-0.1 0.241 68.9 5.5-106.3 13.5 -6.0 52.6 37.5 69 72 A G S S- 0 0 22 13,-0.6 -1,-0.1 3,-0.0 3,-0.1 -0.943 97.7 -63.0-176.0 169.6 -4.8 50.5 40.4 70 73 A P - 0 0 88 0, 0.0 2,-0.5 0, 0.0 -2,-0.1 -0.213 52.9-103.0 -67.9 157.8 -3.0 50.9 43.7 71 74 A V - 0 0 9 10,-0.1 2,-0.6 -62,-0.1 10,-0.2 -0.697 31.4-143.1 -80.1 128.9 0.6 52.0 44.0 72 75 A R E -D 80 0A 144 8,-3.0 8,-2.7 -2,-0.5 2,-0.4 -0.830 25.7-175.8 -93.3 122.0 2.8 49.1 44.8 73 76 A A E -D 79 0A 37 -2,-0.6 6,-0.2 6,-0.2 2,-0.1 -0.960 14.8-158.4-128.7 144.6 5.6 50.1 47.1 74 77 A S - 0 0 39 4,-2.2 3,-0.4 -2,-0.4 -66,-0.2 -0.389 33.0-109.9-102.2-176.3 8.6 48.4 48.6 75 78 A H S S+ 0 0 173 1,-0.2 -70,-0.1 -2,-0.1 4,-0.1 0.426 105.4 69.9 -97.0 -1.8 10.6 49.3 51.7 76 79 A N S S- 0 0 83 2,-0.1 -1,-0.2 -72,-0.1 3,-0.1 -0.003 121.7 -86.5-107.7 33.0 13.7 50.5 49.8 77 80 A G S S+ 0 0 0 -74,-0.4 27,-2.8 -3,-0.4 2,-0.3 0.739 91.1 124.0 75.6 23.6 12.3 53.7 48.3 78 81 A C E + E 0 103A 30 25,-0.2 -4,-2.2 -75,-0.1 2,-0.3 -0.824 31.8 171.5-117.5 153.5 10.9 52.1 45.2 79 82 A G E -DE 73 102A 5 23,-1.7 23,-2.4 -2,-0.3 2,-0.3 -0.987 14.9-161.9-156.5 154.7 7.4 52.1 43.8 80 83 A A E -DE 72 101A 32 -8,-2.7 -8,-3.0 -2,-0.3 21,-0.2 -0.999 13.7-178.3-140.1 141.3 5.5 51.0 40.8 81 84 A M E - E 0 100A 2 19,-2.2 19,-1.9 -2,-0.3 2,-0.4 -0.998 21.2-137.0-147.7 144.0 2.0 52.1 39.6 82 85 A P E + E 0 99A 24 0, 0.0 -14,-2.4 0, 0.0 -13,-0.6 -0.822 36.5 154.5 -96.4 133.4 -0.5 51.5 36.8 83 86 A F E -CE 67 98A 15 15,-2.8 15,-2.8 -2,-0.4 2,-0.4 -0.974 33.2-128.0-152.8 168.4 -2.2 54.4 35.2 84 87 A R E -CE 66 97A 69 -18,-2.4 -18,-1.9 -2,-0.3 2,-0.5 -0.924 11.3-156.0-120.6 146.6 -3.9 55.6 32.0 85 88 A V E -CE 65 96A 21 11,-2.6 11,-2.3 -2,-0.4 2,-0.5 -0.980 8.2-160.9-121.9 128.2 -3.3 58.7 30.0 86 89 A E E +CE 64 95A 80 -22,-2.8 -22,-1.7 -2,-0.5 9,-0.2 -0.936 24.0 148.7-113.5 126.4 -6.0 60.1 27.9 87 90 A M E - E 0 94A 56 7,-3.7 7,-2.7 -2,-0.5 2,-0.4 -0.728 46.2-117.1-138.3-173.8 -5.2 62.5 25.1 88 91 A V E > - E 0 93A 46 5,-0.3 2,-1.1 -2,-0.2 3,-0.5 -0.874 25.6-157.2-133.6 95.8 -6.4 63.6 21.6 89 92 A W E > S- E 0 92A 155 3,-1.8 3,-1.0 -2,-0.4 -2,-0.0 -0.689 76.0 -26.1 -81.8 101.7 -3.7 62.8 19.1 90 93 A N T 3 S- 0 0 144 -2,-1.1 2,-1.9 1,-0.3 -1,-0.3 0.984 126.9 -44.6 57.4 68.4 -4.4 65.2 16.2 91 94 A G T < S+ 0 0 70 -3,-0.5 -1,-0.3 1,-0.2 -2,-0.1 -0.113 126.2 102.6 72.7 -42.2 -8.1 65.7 16.7 92 95 A Q E < S-E 89 0A 112 -2,-1.9 -3,-1.8 -3,-1.0 2,-0.2 -0.603 72.5-135.1 -76.8 123.5 -8.3 61.9 17.2 93 96 A P E +E 88 0A 83 0, 0.0 -5,-0.3 0, 0.0 2,-0.3 -0.515 29.4 175.9 -79.6 144.2 -8.5 61.0 20.9 94 97 A C E -E 87 0A 10 -7,-2.7 -7,-3.7 -2,-0.2 2,-0.3 -0.985 20.9-145.3-147.9 159.3 -6.4 58.2 22.3 95 98 A A E -EF 86 123A 6 28,-1.7 28,-2.4 -2,-0.3 2,-0.4 -0.934 7.9-162.3-125.7 148.4 -5.5 56.5 25.5 96 99 A L E -EF 85 122A 17 -11,-2.3 -11,-2.6 -2,-0.3 2,-0.5 -1.000 10.6-146.8-133.5 127.4 -2.2 55.0 26.7 97 100 A D E +E 84 0A 54 24,-1.8 2,-0.3 -2,-0.4 -13,-0.2 -0.857 29.8 176.2 -96.9 129.5 -1.9 52.4 29.5 98 101 A V E -E 83 0A 9 -15,-2.8 -15,-2.8 -2,-0.5 2,-0.4 -0.943 28.3-154.3-135.9 151.5 1.4 52.9 31.4 99 102 A I E -EG 82 116A 80 17,-1.6 17,-3.5 -2,-0.3 2,-0.4 -0.996 16.7-161.0-126.3 124.5 3.3 51.5 34.3 100 103 A D E -EG 81 115A 3 -19,-1.9 -19,-2.2 -2,-0.4 2,-0.5 -0.879 3.7-163.8-103.4 137.8 5.9 53.8 36.0 101 104 A V E -EG 80 114A 45 13,-2.8 13,-2.5 -2,-0.4 2,-0.4 -0.991 17.1-176.2-118.4 126.7 8.6 52.5 38.2 102 105 A M E -EG 79 113A 1 -23,-2.4 -23,-1.7 -2,-0.5 2,-0.5 -0.965 19.7-157.5-129.5 144.6 10.3 55.2 40.4 103 106 A R E -EG 78 112A 112 9,-2.3 8,-2.9 -2,-0.4 9,-1.7 -0.980 18.0-153.0-119.1 129.5 13.1 55.2 42.8 104 107 A F E - G 0 110A 4 -27,-2.8 6,-0.2 -2,-0.5 2,-0.2 -0.597 7.8-131.7 -99.4 159.8 13.2 58.0 45.4 105 108 A D > - 0 0 11 4,-2.6 3,-2.6 -2,-0.2 4,-0.1 -0.479 39.4 -84.8-103.6 177.7 16.2 59.5 47.1 106 109 A E T 3 S+ 0 0 111 1,-0.3 -104,-0.1 -104,-0.2 -1,-0.0 0.461 127.3 56.0 -60.1 -3.1 16.9 60.3 50.8 107 110 A H T 3 S- 0 0 112 2,-0.2 -1,-0.3 -106,-0.0 -105,-0.1 0.285 119.8-104.0-112.5 7.9 15.1 63.5 50.3 108 111 A G S < S+ 0 0 21 -3,-2.6 2,-0.3 1,-0.3 -2,-0.1 0.721 80.6 129.2 78.3 19.9 11.8 62.2 49.1 109 112 A R - 0 0 97 -4,-0.1 -4,-2.6 -78,-0.0 2,-0.6 -0.836 68.2-102.0-111.1 150.1 12.6 63.1 45.5 110 113 A I E +aG 31 104A 0 -80,-2.5 -78,-2.7 -2,-0.3 -6,-0.3 -0.569 36.4 176.9 -72.8 114.9 12.4 61.0 42.3 111 114 A Q E + 0 0 79 -8,-2.9 -75,-1.7 -2,-0.6 2,-0.3 0.838 69.2 7.4 -85.0 -40.4 15.9 59.9 41.5 112 115 A T E -aG 36 103A 32 -9,-1.7 -9,-2.3 -77,-0.2 2,-0.4 -0.999 61.4-170.0-146.3 144.0 15.0 57.7 38.5 113 116 A M E -aG 37 102A 1 -77,-1.6 -75,-2.0 -2,-0.3 2,-0.4 -1.000 0.7-172.8-136.5 135.6 11.8 57.0 36.6 114 117 A Q E -aG 38 101A 45 -13,-2.5 -13,-2.8 -2,-0.4 2,-0.5 -0.999 9.2-156.6-128.6 132.4 11.1 54.3 34.0 115 118 A A E - 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