==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE 31-MAR-08 3CPO . COMPND 2 MOLECULE: DELTA(5)-3-KETOSTEROID ISOMERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS PUTIDA; . AUTHOR J.M.M.CAAVEIRO,B.PYBUS,D.RINGE,G.PETSKO . 122 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7101.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 91 74.6 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 28.7 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 . 2 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 . 7 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 8 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 30 24.6 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 0 0 1 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 3 A L 0 0 107 0, 0.0 104,-0.2 0, 0.0 75,-0.1 0.000 360.0 360.0 360.0 120.2 -14.0 10.0 -15.0 2 4 A P - 0 0 7 0, 0.0 74,-0.4 0, 0.0 101,-0.1 -0.187 360.0-132.1 -67.3 139.2 -10.3 9.4 -14.8 3 5 A T > - 0 0 75 72,-0.1 4,-3.0 73,-0.1 5,-0.2 -0.245 39.7 -90.7 -66.4 171.9 -8.7 6.5 -16.6 4 6 A A H > S+ 0 0 21 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.919 130.5 48.2 -56.6 -45.3 -6.3 4.3 -14.7 5 7 A Q H > S+ 0 0 164 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.905 111.3 50.7 -62.1 -42.6 -3.4 6.4 -15.8 6 8 A E H > S+ 0 0 108 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.892 107.1 53.4 -64.7 -35.8 -5.2 9.5 -14.8 7 9 A V H X S+ 0 0 0 -4,-3.0 4,-2.9 2,-0.2 5,-0.3 0.914 106.6 53.5 -59.5 -45.1 -6.0 8.1 -11.3 8 10 A Q H X S+ 0 0 87 -4,-2.2 4,-2.1 -5,-0.2 -2,-0.2 0.941 112.3 44.7 -54.8 -46.9 -2.3 7.4 -10.9 9 11 A G H X S+ 0 0 43 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.905 114.3 48.1 -65.8 -42.7 -1.6 11.1 -11.7 10 12 A L H X S+ 0 0 42 -4,-2.7 4,-2.4 2,-0.2 -2,-0.2 0.912 113.0 46.8 -66.6 -41.6 -4.4 12.4 -9.4 11 13 A M H X S+ 0 0 0 -4,-2.9 4,-1.9 2,-0.2 -1,-0.2 0.900 112.2 50.5 -71.8 -35.5 -3.5 10.3 -6.4 12 14 A A H X S+ 0 0 35 -4,-2.1 4,-2.2 -5,-0.3 -1,-0.2 0.921 109.9 50.7 -64.3 -39.2 0.2 11.2 -6.8 13 15 A R H X S+ 0 0 120 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.921 104.1 58.5 -68.3 -34.8 -0.7 14.9 -6.9 14 16 A Y H X S+ 0 0 7 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.934 107.2 47.5 -54.3 -45.8 -2.8 14.5 -3.8 15 17 A I H X S+ 0 0 0 -4,-1.9 4,-2.8 1,-0.2 -1,-0.2 0.916 109.7 52.6 -65.0 -40.0 0.3 13.3 -1.9 16 18 A E H X S+ 0 0 111 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.890 110.6 48.5 -60.9 -35.6 2.4 16.2 -3.3 17 19 A L H X>S+ 0 0 18 -4,-2.5 4,-1.8 2,-0.2 5,-1.7 0.867 111.5 48.0 -72.1 -36.0 -0.3 18.6 -2.1 18 20 A V H <5S+ 0 0 7 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.928 110.3 55.2 -64.3 -43.8 -0.3 17.0 1.4 19 21 A D H <5S+ 0 0 49 -4,-2.8 43,-0.3 1,-0.3 -2,-0.2 0.893 114.4 36.6 -59.3 -40.4 3.5 17.2 1.4 20 22 A V H <5S- 0 0 104 -4,-2.0 -1,-0.3 -5,-0.1 -2,-0.2 0.729 109.3-125.8 -86.4 -22.8 3.6 20.9 0.8 21 23 A G T <5 + 0 0 28 -4,-1.8 2,-1.5 1,-0.2 -3,-0.2 0.805 45.8 163.7 89.3 31.6 0.6 21.5 2.9 22 24 A D >< - 0 0 76 -5,-1.7 4,-2.5 1,-0.2 -1,-0.2 -0.632 11.4-178.8 -86.8 89.7 -1.5 23.4 0.5 23 25 A I H > S+ 0 0 22 -2,-1.5 4,-2.9 1,-0.2 5,-0.2 0.894 77.9 48.9 -55.6 -48.1 -4.9 23.2 2.2 24 26 A E H > S+ 0 0 148 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.926 111.8 48.7 -66.8 -34.6 -6.9 25.1 -0.5 25 27 A A H > S+ 0 0 18 2,-0.2 4,-0.8 1,-0.2 -1,-0.2 0.907 111.8 50.8 -71.2 -36.5 -5.4 23.0 -3.3 26 28 A I H >X S+ 0 0 0 -4,-2.5 3,-1.4 1,-0.2 4,-0.6 0.956 109.8 49.4 -63.6 -48.6 -6.2 19.8 -1.4 27 29 A V H >< S+ 0 0 17 -4,-2.9 3,-1.5 1,-0.3 -1,-0.2 0.896 103.8 59.4 -60.8 -36.0 -9.7 20.8 -0.8 28 30 A Q H 3< S+ 0 0 92 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.712 95.3 64.7 -65.5 -21.4 -10.2 21.7 -4.5 29 31 A M H << S+ 0 0 7 -3,-1.4 80,-3.0 -4,-0.8 -1,-0.3 0.710 92.5 80.3 -70.6 -21.4 -9.4 18.1 -5.4 30 32 A Y E << S-a 109 0A 0 -3,-1.5 80,-0.2 -4,-0.6 18,-0.1 -0.607 91.5-106.5 -88.1 149.6 -12.5 16.9 -3.6 31 33 A A E > - 0 0 2 78,-3.0 3,-1.8 -2,-0.2 16,-0.1 -0.316 39.6-109.3 -62.9 153.1 -16.1 17.0 -4.9 32 34 A D E 3 S+ 0 0 113 1,-0.3 16,-2.2 15,-0.1 17,-0.3 0.824 120.6 33.9 -59.9 -27.4 -18.0 19.8 -3.2 33 35 A D E 3 S+ 0 0 89 14,-0.3 -1,-0.3 15,-0.1 -2,-0.1 -0.066 92.4 143.8-114.0 28.1 -20.1 17.1 -1.2 34 36 A A E < - 0 0 0 -3,-1.8 13,-2.8 12,-0.1 2,-0.4 -0.133 41.1-133.8 -64.7 163.3 -17.2 14.5 -0.8 35 37 A T E -aB 111 46A 26 75,-2.2 77,-1.8 11,-0.2 2,-0.4 -0.932 12.4-161.8-118.2 151.7 -16.7 12.3 2.2 36 38 A V E -aB 112 45A 2 9,-2.0 9,-2.4 -2,-0.4 2,-0.5 -0.995 6.0-172.0-126.1 128.1 -13.6 11.5 4.2 37 39 A E E -a 113 0A 34 75,-2.2 77,-2.9 -2,-0.4 3,-0.3 -0.964 17.6-172.0-116.8 107.7 -13.1 8.6 6.5 38 40 A N S S+ 0 0 41 1,-0.6 2,-0.1 -2,-0.5 77,-0.1 -0.852 79.5 19.5-151.8 103.6 -9.8 9.0 8.3 39 41 A P S > S- 0 0 32 0, 0.0 3,-2.1 0, 0.0 -1,-0.6 0.539 105.5-119.1 -77.9 153.7 -9.0 6.7 9.9 40 42 A F T 3 S+ 0 0 88 74,-2.9 76,-0.3 -3,-0.3 73,-0.1 -0.379 102.2 48.9 -55.1 132.4 -11.3 4.3 8.2 41 43 A G T 3 S+ 0 0 66 1,-0.6 -1,-0.3 74,-0.1 74,-0.0 0.035 92.3 95.7 114.1 -20.8 -13.7 3.0 10.9 42 44 A Q S < S- 0 0 118 -3,-2.1 -1,-0.6 1,-0.1 0, 0.0 -0.615 90.5 -80.4 -96.3 160.9 -14.5 6.5 12.2 43 45 A P - 0 0 101 0, 0.0 -5,-0.3 0, 0.0 -1,-0.1 -0.272 53.3-104.3 -62.2 143.6 -17.6 8.4 11.0 44 46 A P - 0 0 56 0, 0.0 2,-0.4 0, 0.0 -7,-0.2 -0.319 22.1-138.5 -63.6 151.0 -17.4 10.2 7.7 45 47 A I E -B 36 0A 40 -9,-2.4 -9,-2.0 -2,-0.0 2,-0.4 -0.879 23.3-142.9-105.3 145.1 -16.9 13.9 7.4 46 48 A H E > -B 35 0A 109 -2,-0.4 4,-0.5 -11,-0.2 -11,-0.2 -0.940 44.5 -2.2-122.5 125.4 -19.0 15.6 4.7 47 49 A G H > S- 0 0 13 -13,-2.8 4,-2.6 -2,-0.4 -14,-0.3 0.257 82.2 -72.5 87.9 158.4 -18.4 18.4 2.3 48 50 A R H > S+ 0 0 68 -16,-2.2 4,-2.8 1,-0.2 5,-0.2 0.776 124.1 54.6 -59.6 -37.7 -15.6 20.8 1.5 49 51 A E H > S+ 0 0 175 -17,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.966 113.6 41.9 -62.8 -45.2 -16.0 23.0 4.6 50 52 A Q H X S+ 0 0 99 -4,-0.5 4,-2.3 -3,-0.2 -2,-0.2 0.883 116.0 51.0 -63.8 -42.6 -15.7 20.0 7.0 51 53 A I H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 5,-0.2 0.929 108.5 50.8 -65.4 -42.2 -12.8 18.6 4.9 52 54 A A H X S+ 0 0 14 -4,-2.8 4,-2.6 -5,-0.2 -2,-0.2 0.922 109.5 51.2 -58.8 -42.1 -10.9 21.9 4.9 53 55 A A H X S+ 0 0 45 -4,-2.0 4,-2.3 1,-0.2 5,-0.2 0.915 108.9 52.3 -63.4 -40.1 -11.3 22.0 8.7 54 56 A F H X S+ 0 0 50 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.928 112.8 42.9 -60.0 -48.7 -9.9 18.5 8.9 55 57 A Y H X S+ 0 0 8 -4,-2.4 4,-2.9 1,-0.2 -1,-0.2 0.858 111.7 53.6 -68.9 -35.0 -6.8 19.3 6.8 56 58 A R H < S+ 0 0 138 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.919 112.7 44.6 -65.6 -40.5 -6.2 22.6 8.5 57 59 A Q H < S+ 0 0 165 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.840 120.8 41.0 -65.1 -39.6 -6.2 20.7 12.0 58 60 A G H < 0 0 51 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.817 360.0 360.0 -82.4 -32.1 -4.0 17.9 10.6 59 61 A L < 0 0 63 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 -0.191 360.0 360.0-120.2 360.0 -1.6 20.0 8.5 60 ! 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 61 65 A K 0 0 212 0, 0.0 2,-0.4 0, 0.0 26,-0.3 0.000 360.0 360.0 360.0 126.9 6.0 20.8 9.3 62 66 A V - 0 0 33 -43,-0.3 2,-0.4 24,-0.1 24,-0.2 -0.988 360.0-167.3-132.1 140.0 4.6 17.7 7.6 63 67 A R E -C 85 0A 158 22,-1.9 22,-2.9 -2,-0.4 2,-0.4 -0.956 7.7-177.5-121.9 148.7 6.2 15.5 4.9 64 68 A A E +C 84 0A 3 -2,-0.4 2,-0.4 20,-0.2 20,-0.2 -0.990 5.9 169.0-145.1 135.1 4.3 12.9 2.9 65 69 A C E -C 83 0A 61 18,-2.1 18,-2.3 -2,-0.4 2,-0.1 -0.999 37.5-106.4-147.2 149.4 5.6 10.6 0.3 66 70 A L E -C 82 0A 64 -2,-0.4 16,-0.3 16,-0.2 4,-0.0 -0.445 21.0-166.5 -62.4 141.0 4.5 7.6 -1.6 67 71 A T S S+ 0 0 81 14,-2.3 15,-0.2 1,-0.2 -1,-0.1 0.162 73.6 0.3-116.7 14.5 6.1 4.4 -0.4 68 72 A G S S- 0 0 24 13,-0.6 -1,-0.2 0, 0.0 2,-0.0 -0.931 96.6 -59.3-178.4 176.2 5.0 2.4 -3.4 69 73 A P - 0 0 87 0, 0.0 2,-0.3 0, 0.0 -2,-0.1 -0.270 51.4-103.6 -66.9 153.6 3.1 2.8 -6.6 70 74 A V - 0 0 10 10,-0.2 2,-0.6 -62,-0.1 10,-0.2 -0.590 29.2-145.4 -67.2 135.5 -0.5 3.9 -7.0 71 75 A R E -D 79 0A 143 8,-3.1 8,-2.5 -2,-0.3 2,-0.3 -0.934 24.8-172.2-104.6 111.4 -2.7 0.9 -7.7 72 76 A A E -D 78 0A 34 -2,-0.6 6,-0.3 6,-0.2 2,-0.2 -0.808 11.4-151.2-105.9 155.0 -5.5 2.2 -10.1 73 77 A S - 0 0 35 4,-3.1 3,-0.5 -2,-0.3 -66,-0.2 -0.500 28.1-114.5-108.3 177.0 -8.7 0.5 -11.4 74 78 A H S S+ 0 0 180 1,-0.2 4,-0.1 -2,-0.2 -70,-0.0 0.168 107.1 67.6 -95.6 16.3 -10.7 1.0 -14.6 75 79 A N S S- 0 0 104 2,-0.2 -1,-0.2 -72,-0.1 3,-0.1 0.014 122.5 -89.2-126.2 37.9 -13.7 2.4 -12.7 76 80 A G S S+ 0 0 1 -3,-0.5 27,-3.1 -74,-0.4 2,-0.3 0.669 92.5 110.1 73.4 23.0 -12.2 5.7 -11.4 77 81 A C E + E 0 102A 27 25,-0.2 -4,-3.1 -75,-0.1 2,-0.3 -0.815 35.8 166.0-126.1 164.3 -10.8 4.3 -8.1 78 82 A G E -DE 72 101A 8 23,-2.2 23,-2.8 -2,-0.3 2,-0.3 -0.991 20.8-143.2-165.0 172.8 -7.4 3.6 -6.7 79 83 A A E -DE 71 100A 31 -8,-2.5 -8,-3.1 -2,-0.3 21,-0.2 -0.993 17.3-178.6-142.9 146.4 -5.3 2.8 -3.6 80 84 A M E - E 0 99A 2 19,-2.1 19,-1.9 -2,-0.3 2,-0.4 -0.999 20.5-135.4-149.0 145.9 -1.9 4.0 -2.6 81 85 A P E + E 0 98A 23 0, 0.0 -14,-2.3 0, 0.0 -13,-0.6 -0.837 35.5 155.5 -99.5 139.5 0.6 3.5 0.3 82 86 A F E -CE 66 97A 10 15,-2.6 15,-2.8 -2,-0.4 2,-0.4 -0.952 34.8-127.8-154.6 170.0 2.4 6.4 1.8 83 87 A R E -CE 65 96A 80 -18,-2.3 -18,-2.1 -2,-0.3 2,-0.5 -0.992 14.5-158.5-125.9 134.0 4.1 7.7 4.9 84 88 A V E -CE 64 95A 15 11,-2.7 11,-2.8 -2,-0.4 2,-0.5 -0.943 7.1-160.6-113.4 128.1 3.3 11.0 6.7 85 89 A E E +CE 63 94A 72 -22,-2.9 -22,-1.9 -2,-0.5 2,-0.3 -0.938 22.9 156.1-109.5 132.0 6.0 12.5 8.9 86 90 A M E - E 0 93A 55 7,-2.3 7,-3.1 -2,-0.5 2,-0.5 -0.871 42.6-107.8-144.3 178.9 5.0 15.0 11.5 87 91 A V E - E 0 92A 84 -26,-0.3 2,-0.4 -2,-0.3 3,-0.2 -0.963 32.6-176.2-119.1 121.3 6.0 16.5 14.8 88 92 A W E > S- E 0 91A 139 3,-3.7 3,-4.2 -2,-0.5 -2,-0.0 -0.982 72.1 -17.2-124.6 129.1 4.0 15.5 17.8 89 93 A N T 3 S- 0 0 139 -2,-0.4 -1,-0.2 1,-0.3 0, 0.0 0.930 127.2 -56.1 34.2 61.7 4.6 17.0 21.2 90 94 A G T 3 S+ 0 0 71 1,-0.2 -1,-0.3 -3,-0.2 -3,-0.0 0.465 122.9 115.4 57.0 -2.6 8.0 18.1 19.9 91 95 A Q E < -E 88 0A 111 -3,-4.2 -3,-3.7 32,-0.0 -1,-0.2 -0.895 65.4-138.0-101.2 111.3 8.4 14.4 19.1 92 96 A P E +E 87 0A 89 0, 0.0 2,-0.3 0, 0.0 -5,-0.3 -0.334 31.3 173.6 -58.6 143.0 8.7 13.7 15.4 93 97 A C E -E 86 0A 11 -7,-3.1 -7,-2.3 30,-0.2 2,-0.4 -0.939 23.2-137.7-147.5 170.3 6.7 10.6 14.4 94 98 A A E -EF 85 122A 8 28,-2.3 28,-2.6 -2,-0.3 2,-0.4 -0.988 8.8-160.2-131.4 147.1 5.8 8.8 11.2 95 99 A L E -EF 84 121A 16 -11,-2.8 -11,-2.7 -2,-0.4 2,-0.4 -0.990 9.9-147.3-128.8 123.4 2.4 7.2 10.2 96 100 A D E +E 83 0A 48 24,-2.1 2,-0.3 -2,-0.4 21,-0.2 -0.811 29.7 173.6 -87.7 132.3 2.1 4.6 7.5 97 101 A V E -E 82 0A 9 -15,-2.8 -15,-2.6 -2,-0.4 2,-0.4 -0.942 29.8-152.5-138.4 150.8 -1.3 4.9 5.6 98 102 A I E -EG 81 115A 82 17,-2.0 17,-3.3 -2,-0.3 2,-0.5 -0.994 18.2-159.5-120.9 125.2 -3.1 3.5 2.6 99 103 A D E -EG 80 114A 1 -19,-1.9 -19,-2.1 -2,-0.4 2,-0.5 -0.862 3.2-163.0-101.2 136.0 -5.7 5.7 1.0 100 104 A V E -EG 79 113A 46 13,-2.8 13,-2.4 -2,-0.5 2,-0.4 -0.973 16.8-173.5-112.3 124.5 -8.5 4.3 -1.1 101 105 A M E -EG 78 112A 1 -23,-2.8 -23,-2.2 -2,-0.5 2,-0.5 -0.956 20.7-161.5-124.7 144.5 -10.2 6.9 -3.4 102 106 A R E -EG 77 111A 103 9,-2.2 8,-3.0 -2,-0.4 9,-1.7 -0.994 18.2-155.4-118.3 124.7 -13.2 6.9 -5.7 103 107 A F E - G 0 109A 2 -27,-3.1 6,-0.2 -2,-0.5 2,-0.1 -0.664 11.1-129.7 -97.3 154.7 -13.2 9.8 -8.2 104 108 A D > - 0 0 8 4,-2.6 3,-2.4 -2,-0.3 -1,-0.1 -0.350 39.1 -82.3 -96.9-177.0 -16.4 11.2 -9.8 105 109 A E T 3 S+ 0 0 125 1,-0.3 -1,-0.1 -104,-0.2 -29,-0.0 0.438 128.2 51.3 -67.6 -7.4 -17.3 11.8 -13.3 106 110 A H T 3 S- 0 0 155 2,-0.2 -1,-0.3 -104,-0.0 3,-0.1 0.225 119.9-101.7-109.5 7.7 -15.5 15.2 -13.2 107 111 A G S < S+ 0 0 20 -3,-2.4 2,-0.3 1,-0.3 -2,-0.1 0.735 79.9 131.1 84.2 14.6 -12.2 13.9 -11.8 108 112 A R - 0 0 86 -78,-0.0 -4,-2.6 1,-0.0 2,-0.5 -0.753 68.0-100.6-102.2 150.8 -12.9 15.0 -8.2 109 113 A I E +aG 30 103A 0 -80,-3.0 -78,-3.0 -2,-0.3 -6,-0.3 -0.610 39.6 176.5 -71.7 117.2 -12.4 12.8 -5.1 110 114 A Q E + 0 0 35 -8,-3.0 -75,-2.2 -2,-0.5 2,-0.4 0.827 69.1 16.1 -86.2 -40.2 -15.9 11.6 -4.2 111 115 A T E -aG 35 102A 25 -9,-1.7 -9,-2.2 -77,-0.2 2,-0.4 -0.998 61.4-170.1-138.1 139.5 -14.9 9.3 -1.3 112 116 A M E -aG 36 101A 0 -77,-1.8 -75,-2.2 -2,-0.4 2,-0.4 -1.000 4.1-178.0-120.6 127.5 -11.6 9.1 0.7 113 117 A Q E -aG 37 100A 42 -13,-2.4 -13,-2.8 -2,-0.4 2,-0.7 -0.986 9.4-162.3-128.6 118.6 -10.9 6.1 3.1 114 118 A A E - 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