==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE 30-MAY-04 1W00 . COMPND 2 MOLECULE: STEROID DELTA-ISOMERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS PUTIDA; . AUTHOR D.S.JANG,H.J.CHA,K.Y.CHOI . 247 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12107.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 182 73.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 4.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 70 28.3 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 . 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 . 3 1.2 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 . 12 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 59 23.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.2 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 1 1 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 6 0 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 2 A N 0 0 65 0, 0.0 106,-0.2 0, 0.0 105,-0.2 0.000 360.0 360.0 360.0 59.4 1.8 5.6 17.9 2 3 A L + 0 0 60 104,-0.8 105,-0.2 76,-0.2 76,-0.1 0.807 360.0 98.3 -97.0 -39.0 2.9 2.4 16.2 3 4 A P S S- 0 0 8 0, 0.0 75,-0.5 0, 0.0 102,-0.1 -0.227 73.3-123.4 -55.1 139.3 6.6 3.0 15.5 4 5 A T > - 0 0 71 73,-0.1 4,-2.5 74,-0.1 3,-0.2 -0.269 30.9 -97.1 -76.3 168.7 9.0 1.5 18.0 5 6 A A H > S+ 0 0 6 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.930 127.6 48.8 -52.5 -47.6 11.6 3.7 19.9 6 7 A Q H > S+ 0 0 136 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.842 110.2 50.3 -63.2 -34.9 14.2 2.7 17.4 7 8 A E H > S+ 0 0 107 2,-0.2 4,-2.9 -3,-0.2 -1,-0.2 0.859 108.5 53.9 -71.6 -33.3 12.0 3.5 14.4 8 9 A V H X S+ 0 0 0 -4,-2.5 4,-2.9 2,-0.2 5,-0.3 0.944 107.2 50.2 -63.7 -47.8 11.2 6.9 16.0 9 10 A Q H X S+ 0 0 39 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.910 113.1 47.5 -57.3 -42.6 15.0 7.6 16.3 10 11 A G H X S+ 0 0 42 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.934 112.4 47.8 -65.3 -46.1 15.3 6.7 12.6 11 12 A L H X S+ 0 0 38 -4,-2.9 4,-2.1 1,-0.2 -2,-0.2 0.894 115.0 45.2 -62.6 -41.1 12.3 8.8 11.5 12 13 A M H X S+ 0 0 0 -4,-2.9 4,-1.7 2,-0.2 -1,-0.2 0.851 112.0 50.7 -73.4 -33.7 13.4 11.8 13.4 13 14 A A H X S+ 0 0 26 -4,-2.2 4,-1.9 -5,-0.3 -2,-0.2 0.901 110.8 51.5 -68.1 -38.2 17.1 11.6 12.3 14 15 A R H X S+ 0 0 105 -4,-2.4 4,-2.5 1,-0.2 5,-0.2 0.932 104.5 56.4 -61.5 -47.3 15.7 11.3 8.7 15 16 A Y H X S+ 0 0 9 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.899 107.1 48.7 -51.9 -45.4 13.7 14.4 9.2 16 17 A I H X S+ 0 0 6 -4,-1.7 4,-2.7 1,-0.2 -1,-0.2 0.901 109.5 53.0 -63.0 -41.1 16.8 16.4 10.2 17 18 A E H X S+ 0 0 117 -4,-1.9 4,-1.8 1,-0.2 -2,-0.2 0.904 109.5 48.1 -60.4 -44.1 18.6 15.1 7.1 18 19 A L H X>S+ 0 0 16 -4,-2.5 4,-1.8 2,-0.2 5,-1.8 0.883 111.9 49.0 -65.5 -40.2 15.8 16.2 4.8 19 20 A V H <5S+ 0 0 12 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.915 110.4 52.8 -64.1 -41.6 15.8 19.7 6.4 20 21 A D H <5S+ 0 0 38 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.830 114.2 40.3 -63.1 -35.1 19.5 19.8 6.0 21 22 A V H <5S- 0 0 102 -4,-1.8 -1,-0.2 -5,-0.1 -2,-0.2 0.692 109.9-125.0 -86.3 -21.7 19.3 19.0 2.3 22 23 A G T <5 + 0 0 35 -4,-1.8 2,-1.3 1,-0.2 -3,-0.2 0.766 50.7 157.7 84.9 26.8 16.3 21.2 1.8 23 24 A D >< + 0 0 73 -5,-1.8 4,-2.0 1,-0.2 -1,-0.2 -0.706 11.1 175.3 -88.1 93.7 13.9 18.7 0.3 24 25 A I H > S+ 0 0 10 -2,-1.3 4,-2.9 2,-0.2 5,-0.2 0.892 76.8 53.0 -64.3 -43.4 10.5 20.3 1.1 25 26 A E H > S+ 0 0 108 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.915 111.0 46.6 -61.0 -43.8 8.5 17.8 -0.8 26 27 A A H > S+ 0 0 11 2,-0.2 4,-0.7 1,-0.2 -1,-0.2 0.881 113.0 49.9 -66.1 -39.4 10.1 14.9 1.1 27 28 A I H >< S+ 0 0 0 -4,-2.0 3,-1.6 1,-0.2 4,-0.5 0.960 109.5 50.4 -63.4 -51.6 9.7 16.6 4.4 28 29 A V H >< S+ 0 0 15 -4,-2.9 3,-1.5 1,-0.3 -1,-0.2 0.856 102.8 61.6 -56.0 -36.4 6.0 17.3 3.8 29 30 A Q H 3< S+ 0 0 139 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.750 92.0 67.4 -63.0 -22.9 5.5 13.6 2.9 30 31 A M T << S+ 0 0 17 -3,-1.6 81,-2.7 -4,-0.7 -1,-0.3 0.735 89.3 85.0 -70.4 -20.4 6.5 12.7 6.4 31 32 A Y E < S-a 111 0A 0 -3,-1.5 2,-0.2 -4,-0.5 81,-0.2 -0.433 76.5-124.2 -85.4 156.9 3.4 14.3 7.8 32 33 A A E > - 0 0 3 79,-2.5 3,-1.8 -2,-0.1 -1,-0.1 -0.555 33.0-104.1 -91.7 161.5 -0.1 12.9 8.2 33 34 A D E 3 S+ 0 0 110 1,-0.3 15,-0.3 -2,-0.2 16,-0.3 0.819 122.0 39.8 -54.7 -37.5 -3.2 14.6 6.7 34 35 A D E 3 S+ 0 0 95 13,-0.1 -1,-0.3 14,-0.1 78,-0.1 0.255 88.3 138.9 -98.7 11.7 -4.3 15.9 10.1 35 36 A A E < - 0 0 0 -3,-1.8 13,-0.7 76,-0.2 2,-0.4 -0.127 37.8-152.4 -57.3 151.6 -0.8 16.8 11.3 36 37 A T E -aB 113 47A 35 76,-1.4 78,-2.0 11,-0.2 2,-0.4 -0.962 2.9-155.2-127.8 145.7 -0.2 20.1 13.2 37 38 A V E -aB 114 46A 0 9,-2.2 9,-2.9 -2,-0.4 2,-0.5 -0.986 9.2-177.4-123.2 128.4 2.9 22.2 13.4 38 39 A E E -a 115 0A 33 76,-2.4 78,-2.3 -2,-0.4 3,-0.4 -0.911 16.8-176.7-125.6 98.8 3.7 24.5 16.3 39 40 A D S S+ 0 0 45 1,-0.5 2,-0.1 -2,-0.5 78,-0.1 -0.871 79.0 21.0-149.0 108.4 6.9 26.2 15.5 40 41 A P S > S- 0 0 32 0, 0.0 3,-2.1 0, 0.0 -1,-0.5 0.506 106.4-121.9 -75.8 150.2 7.9 28.0 17.6 41 42 A F T 3 S+ 0 0 15 75,-2.8 160,-0.5 -3,-0.4 77,-0.3 -0.325 101.6 49.3 -56.5 135.6 5.8 26.3 20.2 42 43 A G T 3 S+ 0 0 41 1,-0.6 -1,-0.3 158,-0.1 75,-0.0 0.036 92.8 100.7 116.0 -21.3 3.5 28.9 21.8 43 44 A Q S < S- 0 0 103 -3,-2.1 -1,-0.6 1,-0.1 3,-0.1 -0.647 90.1 -78.6 -93.6 151.9 2.5 30.0 18.3 44 45 A P - 0 0 94 0, 0.0 -5,-0.3 0, 0.0 -1,-0.1 -0.129 55.7 -99.5 -50.9 142.3 -0.8 29.0 16.7 45 46 A P - 0 0 73 0, 0.0 2,-0.5 0, 0.0 -7,-0.2 -0.351 29.3-142.0 -65.6 138.2 -0.9 25.4 15.2 46 47 A I E +B 37 0A 47 -9,-2.9 -9,-2.2 -3,-0.1 2,-0.3 -0.901 27.2 174.1-103.4 128.4 -0.5 25.1 11.5 47 48 A H E +B 36 0A 129 -2,-0.5 4,-0.2 -11,-0.2 -11,-0.2 -0.939 33.3 61.1-133.5 157.0 -2.7 22.4 9.9 48 49 A G S > S- 0 0 20 -13,-0.7 4,-2.7 -15,-0.3 5,-0.2 0.389 75.1-110.1 96.9 126.0 -3.4 21.3 6.3 49 50 A R H > S+ 0 0 67 -16,-0.3 4,-3.2 1,-0.2 5,-0.3 0.880 117.9 52.9 -54.5 -46.3 -0.7 19.9 4.0 50 51 A E H > S+ 0 0 157 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.920 113.5 46.2 -56.0 -43.4 -0.8 23.0 1.7 51 52 A Q H > S+ 0 0 89 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.910 113.0 47.3 -65.7 -45.5 -0.2 25.1 4.8 52 53 A I H X S+ 0 0 2 -4,-2.7 4,-1.9 2,-0.2 -2,-0.2 0.882 112.8 50.2 -65.1 -36.9 2.6 22.9 6.1 53 54 A A H X S+ 0 0 22 -4,-3.2 4,-1.6 -5,-0.2 -2,-0.2 0.904 110.5 49.3 -67.4 -40.4 4.2 22.8 2.7 54 55 A A H X S+ 0 0 57 -4,-2.2 4,-1.9 -5,-0.3 -2,-0.2 0.861 107.0 57.4 -65.6 -34.6 4.0 26.6 2.5 55 56 A F H X S+ 0 0 56 -4,-2.1 4,-0.9 1,-0.2 -2,-0.2 0.933 110.1 42.2 -61.2 -47.3 5.5 26.8 6.0 56 57 A Y H X>S+ 0 0 11 -4,-1.9 4,-2.9 1,-0.2 5,-0.6 0.753 109.6 59.2 -72.8 -23.9 8.6 24.8 5.0 57 58 A R H X5S+ 0 0 117 -4,-1.6 4,-1.3 3,-0.2 -1,-0.2 0.890 106.6 45.9 -72.7 -38.1 8.9 26.8 1.7 58 59 A Q H <5S+ 0 0 171 -4,-1.9 -1,-0.2 2,-0.2 -2,-0.2 0.737 120.5 41.6 -75.8 -21.8 9.2 30.1 3.5 59 60 A G H <5S+ 0 0 50 -4,-0.9 -2,-0.2 -5,-0.2 -3,-0.2 0.882 133.1 16.6 -91.2 -44.2 11.8 28.6 5.9 60 61 A L H <5 0 0 28 -4,-2.9 4,-0.3 1,-0.1 -3,-0.2 0.664 360.0 360.0-102.9 -21.7 13.9 26.5 3.6 61 62 A G << 0 0 85 -4,-1.3 -1,-0.1 -5,-0.6 -4,-0.1 -0.017 360.0 360.0 -57.1 360.0 13.0 27.9 0.2 62 ! 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 63 65 A K 0 0 217 0, 0.0 2,-0.1 0, 0.0 -2,-0.1 0.000 360.0 360.0 360.0 4.6 21.1 27.7 2.2 64 66 A V - 0 0 29 -4,-0.3 2,-0.3 -5,-0.1 24,-0.2 -0.358 360.0-166.3 -63.1 133.5 19.7 26.5 5.6 65 67 A R E -C 87 0A 135 22,-2.3 22,-2.8 -2,-0.1 2,-0.3 -0.890 5.6-174.7-120.0 152.4 21.7 23.8 7.3 66 68 A A E +C 86 0A 6 -2,-0.3 2,-0.3 20,-0.2 20,-0.2 -0.984 5.2 173.4-151.6 138.2 20.7 21.5 10.2 67 69 A C E -C 85 0A 69 18,-1.8 18,-2.2 -2,-0.3 2,-0.2 -0.993 36.4-104.2-145.0 152.1 22.3 18.9 12.4 68 70 A L E -C 84 0A 64 -2,-0.3 16,-0.3 16,-0.2 4,-0.0 -0.516 23.7-170.6 -71.0 137.7 21.6 16.8 15.4 69 71 A T S S+ 0 0 69 14,-2.1 15,-0.2 1,-0.2 -1,-0.1 0.233 72.7 5.3-112.5 10.6 23.4 18.1 18.5 70 72 A G S S- 0 0 20 13,-0.7 -1,-0.2 153,-0.0 3,-0.1 -0.944 95.0 -68.9-178.2 164.2 22.6 15.1 20.6 71 73 A P - 0 0 60 0, 0.0 2,-0.2 0, 0.0 -2,-0.1 -0.260 53.8 -99.1 -69.1 156.7 20.9 11.7 20.3 72 74 A V - 0 0 8 10,-0.1 2,-0.7 -63,-0.1 10,-0.2 -0.542 29.4-143.9 -74.2 136.4 17.1 11.3 19.7 73 75 A R E -D 81 0A 2 8,-3.5 8,-2.4 -2,-0.2 2,-0.3 -0.915 26.4-175.1-104.4 109.9 15.2 10.5 22.9 74 76 A A E -D 80 0A 0 -2,-0.7 6,-0.2 6,-0.2 2,-0.2 -0.752 13.5-154.5-110.2 155.3 12.3 8.1 22.0 75 77 A S - 0 0 2 4,-2.7 3,-0.4 -2,-0.3 -67,-0.2 -0.543 30.3-112.2-112.4-179.9 9.4 6.6 24.0 76 78 A H S S+ 0 0 128 91,-0.5 92,-0.1 1,-0.2 4,-0.1 0.335 106.3 69.0 -97.9 6.1 7.5 3.4 23.5 77 79 A N S S- 0 0 40 90,-0.2 -1,-0.2 2,-0.2 -75,-0.1 -0.107 121.9 -89.7-114.9 37.9 4.3 5.2 22.5 78 80 A G S S+ 0 0 0 -75,-0.5 27,-3.1 -3,-0.4 2,-0.3 0.700 90.8 117.5 68.2 22.9 5.4 6.5 19.1 79 81 A C E + E 0 104A 5 25,-0.2 -4,-2.7 -78,-0.1 2,-0.3 -0.868 35.0 174.2-121.6 155.2 6.8 9.8 20.4 80 82 A G E -DE 74 103A 0 23,-2.3 23,-2.6 -2,-0.3 2,-0.3 -0.984 17.1-154.4-154.3 162.8 10.3 11.3 20.4 81 83 A A E -DE 73 102A 0 -8,-2.4 -8,-3.5 -2,-0.3 21,-0.2 -0.997 15.8-179.8-141.2 139.9 12.3 14.5 21.2 82 84 A M E - E 0 101A 0 19,-2.4 19,-2.6 -2,-0.3 2,-0.3 -1.000 21.2-134.7-145.9 145.7 15.6 15.6 19.7 83 85 A P E + E 0 100A 2 0, 0.0 -14,-2.1 0, 0.0 -13,-0.7 -0.774 36.0 155.1 -98.0 140.3 18.1 18.5 20.1 84 86 A F E -CE 68 99A 14 15,-2.9 15,-3.0 -2,-0.3 2,-0.4 -0.984 34.3-126.7-158.0 167.4 19.5 20.2 17.0 85 87 A R E -CE 67 98A 91 -18,-2.2 -18,-1.8 -2,-0.3 2,-0.5 -0.966 16.3-153.1-123.5 137.8 21.1 23.4 15.6 86 88 A V E -CE 66 97A 17 11,-3.0 11,-2.2 -2,-0.4 2,-0.6 -0.935 2.2-155.8-113.8 129.1 19.9 25.3 12.5 87 89 A E E +CE 65 96A 112 -22,-2.8 -22,-2.3 -2,-0.5 2,-0.2 -0.902 37.4 131.1-102.9 123.6 22.2 27.5 10.4 88 90 A M E - E 0 95A 60 7,-1.8 7,-2.5 -2,-0.6 2,-0.4 -0.746 52.7 -86.5-149.3-164.6 20.4 30.2 8.5 89 91 A V E + E 0 94A 92 5,-0.2 2,-0.4 -2,-0.2 -25,-0.0 -0.971 35.3 175.5-124.1 134.4 20.5 33.9 7.7 90 92 A W E > S- E 0 93A 135 3,-3.1 3,-1.1 -2,-0.4 -2,-0.0 -0.997 70.9 -1.1-140.4 135.5 18.9 36.7 9.7 91 93 A N T 3 S- 0 0 130 -2,-0.4 -1,-0.1 1,-0.3 -2,-0.0 0.757 132.2 -59.2 59.8 23.6 19.0 40.5 9.3 92 94 A G T 3 S+ 0 0 62 1,-0.2 -1,-0.3 0, 0.0 -3,-0.0 0.785 119.5 102.8 76.7 29.0 21.2 39.6 6.3 93 95 A Q E < S-E 90 0A 113 -3,-1.1 -3,-3.1 0, 0.0 -1,-0.2 -0.998 78.2 -97.5-145.1 145.8 23.8 37.9 8.5 94 96 A P E +E 89 0A 88 0, 0.0 2,-0.3 0, 0.0 -5,-0.2 -0.377 50.9 166.4 -63.4 131.7 24.7 34.3 9.3 95 97 A C E -E 88 0A 11 -7,-2.5 -7,-1.8 30,-0.2 2,-0.4 -0.903 29.3-132.9-142.2 169.9 23.3 33.0 12.5 96 98 A A E -EF 87 124A 16 28,-3.0 28,-2.8 -2,-0.3 2,-0.4 -0.978 13.5-163.4-128.7 140.9 22.7 29.8 14.5 97 99 A L E -EF 86 123A 13 -11,-2.2 -11,-3.0 -2,-0.4 2,-0.5 -0.988 10.5-146.5-129.3 125.0 19.5 28.7 16.3 98 100 A D E +E 85 0A 19 24,-2.4 2,-0.3 -2,-0.4 21,-0.3 -0.785 29.4 171.6 -91.8 127.5 19.3 26.0 19.0 99 101 A V E -E 84 0A 5 -15,-3.0 -15,-2.9 -2,-0.5 2,-0.4 -0.921 29.0-152.3-136.5 158.7 16.1 23.9 18.9 100 102 A I E -EG 83 117A 0 17,-1.4 17,-2.5 -2,-0.3 2,-0.4 -0.987 18.2-155.4-131.2 119.5 14.4 20.9 20.4 101 103 A L E -EG 82 116A 1 -19,-2.6 -19,-2.4 -2,-0.4 2,-0.5 -0.835 7.0-169.0-100.9 134.6 11.8 19.1 18.3 102 104 A V E -EG 81 115A 4 13,-2.4 13,-2.9 -2,-0.4 2,-0.3 -0.987 14.6-180.0-118.7 126.0 9.1 16.9 19.9 103 105 A M E -EG 80 114A 1 -23,-2.6 -23,-2.3 -2,-0.5 2,-0.5 -0.962 22.6-155.9-131.9 149.0 7.1 14.7 17.6 104 106 A R E -EG 79 113A 89 9,-2.2 8,-3.3 -2,-0.3 9,-1.6 -0.992 20.2-157.6-120.4 122.8 4.2 12.3 17.9 105 107 A F E - G 0 111A 0 -27,-3.1 6,-0.2 -2,-0.5 2,-0.1 -0.652 10.2-129.3 -98.7 159.5 4.0 9.8 15.1 106 108 A D > - 0 0 7 4,-2.8 3,-2.1 -2,-0.2 -104,-0.8 -0.357 35.3 -86.0-100.8-175.5 0.9 7.8 14.0 107 109 A E T 3 S+ 0 0 116 1,-0.3 -1,-0.0 -106,-0.2 -29,-0.0 0.506 128.3 53.8 -65.4 -6.0 0.1 4.2 13.4 108 110 A H T 3 S- 0 0 148 2,-0.2 -1,-0.3 -105,-0.0 3,-0.1 0.326 119.9-106.5-110.3 2.4 1.3 4.7 9.8 109 111 A G S < S+ 0 0 24 -3,-2.1 2,-0.3 1,-0.3 -2,-0.1 0.687 80.0 128.8 79.4 18.1 4.7 6.1 10.8 110 112 A R - 0 0 79 1,-0.0 -4,-2.8 -79,-0.0 2,-0.3 -0.801 69.0 -94.7-108.7 150.8 3.7 9.6 9.8 111 113 A I E +aG 31 105A 0 -81,-2.7 -79,-2.5 -2,-0.3 -6,-0.3 -0.451 38.5 173.8 -66.6 119.8 4.0 12.8 11.9 112 114 A Q E S+ 0 0 22 -8,-3.3 -76,-1.4 1,-0.4 2,-0.3 0.842 72.1 11.3 -91.3 -43.8 0.8 13.6 13.8 113 115 A T E -aG 36 104A 26 -9,-1.6 -9,-2.2 -78,-0.2 2,-0.4 -1.000 60.6-168.4-140.4 139.2 2.2 16.5 15.8 114 116 A M E -aG 37 103A 0 -78,-2.0 -76,-2.4 -2,-0.3 2,-0.5 -0.993 7.5-179.9-128.8 122.8 5.4 18.5 15.6 115 117 A Q E -aG 38 102A 40 -13,-2.9 -13,-2.4 -2,-0.4 2,-0.6 -0.960 6.7-167.0-129.3 114.2 6.4 20.9 18.3 116 118 A A E - 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