==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=31-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOMERASE 13-JUL-10 3NXJ . COMPND 2 MOLECULE: STEROID DELTA-ISOMERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: COMAMONAS TESTOSTERONI; . AUTHOR A.GONZALEZ,Y.TSAI,J.SCHWANS,F.SUNDEN,D.HERSCHLAG . 250 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12732.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 188 75.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 4.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 61 24.4 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 . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 1.6 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 0.4 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 . 21 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 11.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 54 21.6 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+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 1 0 1 0 0 0 0 0 1 1 0 0 1 1 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 . 3 3 1 2 4 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 2 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 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 0 196 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -94.1 26.4 50.0 21.1 2 2 A N - 0 0 24 105,-0.1 3,-0.1 104,-0.1 103,-0.1 -0.931 360.0-167.1 165.4-162.9 25.4 46.4 21.7 3 3 A T >> - 0 0 53 -2,-0.3 4,-2.6 1,-0.1 3,-0.7 -0.508 39.8-109.8 155.7 141.6 25.9 43.0 19.8 4 4 A P H 3> S+ 0 0 54 0, 0.0 4,-2.7 0, 0.0 5,-0.3 0.924 122.8 58.4 -50.4 -42.3 24.6 39.4 19.8 5 5 A E H 34 S+ 0 0 145 1,-0.2 -2,-0.1 2,-0.2 5,-0.0 0.869 108.9 43.8 -51.2 -43.0 28.1 38.6 21.0 6 6 A H H X> S+ 0 0 62 -3,-0.7 4,-3.4 2,-0.2 3,-0.7 0.845 114.0 49.2 -72.7 -37.1 27.5 40.9 24.0 7 7 A M H 3X S+ 0 0 5 -4,-2.6 4,-0.9 1,-0.3 -2,-0.2 0.725 110.7 50.3 -74.2 -24.9 24.0 39.5 24.5 8 8 A T H 3< S+ 0 0 35 -4,-2.7 -1,-0.3 -5,-0.3 4,-0.2 0.373 113.6 49.2 -88.7 0.1 25.5 36.0 24.4 9 9 A A H <> S+ 0 0 22 -3,-0.7 4,-2.1 -5,-0.3 3,-0.5 0.817 109.4 47.7 -95.6 -58.2 27.9 37.5 27.0 10 10 A V H X S+ 0 0 4 -4,-3.4 4,-1.7 1,-0.2 -2,-0.2 0.743 111.6 53.1 -52.9 -31.2 25.3 39.0 29.3 11 11 A V H X S+ 0 0 0 -4,-0.9 4,-1.9 2,-0.2 -1,-0.2 0.874 107.3 50.4 -74.4 -37.4 23.4 35.7 29.2 12 12 A Q H > S+ 0 0 116 -3,-0.5 4,-1.5 -4,-0.2 -2,-0.2 0.893 113.7 44.6 -69.1 -38.7 26.4 33.6 30.2 13 13 A R H X S+ 0 0 138 -4,-2.1 4,-4.3 2,-0.2 5,-0.3 0.882 108.5 57.4 -71.0 -41.3 27.2 35.9 33.2 14 14 A Y H X S+ 0 0 12 -4,-1.7 4,-2.1 1,-0.2 -2,-0.2 0.913 111.4 43.2 -55.9 -44.3 23.5 36.0 34.2 15 15 A V H X S+ 0 0 14 -4,-1.9 4,-3.2 2,-0.2 -1,-0.2 0.829 116.9 47.8 -67.9 -34.8 23.6 32.2 34.4 16 16 A A H X S+ 0 0 53 -4,-1.5 4,-0.8 2,-0.2 6,-0.3 0.902 109.5 50.7 -74.2 -43.7 27.0 32.4 36.2 17 17 A A H >X>S+ 0 0 7 -4,-4.3 4,-0.9 2,-0.2 5,-0.8 0.952 118.5 41.3 -56.3 -48.9 25.8 35.1 38.6 18 18 A L H ><5S+ 0 0 16 -4,-2.1 3,-1.4 -5,-0.3 45,-0.3 0.959 110.5 55.3 -57.9 -57.0 22.9 32.8 39.4 19 19 A N H 3<5S+ 0 0 83 -4,-3.2 -1,-0.2 1,-0.3 -2,-0.2 0.520 113.6 43.5 -60.3 -8.9 24.9 29.5 39.4 20 20 A A H <<5S- 0 0 78 -4,-0.8 -1,-0.3 -3,-0.7 -2,-0.2 0.582 111.3-114.6-107.7 -18.5 27.2 31.1 42.1 21 21 A G T <<5 + 0 0 39 -3,-1.4 -3,-0.2 -4,-0.9 -2,-0.1 0.220 62.5 158.6 94.7 -10.3 24.5 32.6 44.3 22 22 A D < + 0 0 82 -5,-0.8 4,-0.4 -6,-0.3 -1,-0.3 -0.251 15.2 175.5 -48.7 115.1 26.1 35.9 43.2 23 23 A L S > S+ 0 0 59 2,-0.2 4,-1.1 -3,-0.1 -1,-0.2 0.776 72.9 52.1-102.1 -35.5 23.4 38.5 43.8 24 24 A D H > S+ 0 0 141 1,-0.2 4,-0.5 2,-0.2 3,-0.3 0.927 109.8 54.6 -62.2 -43.2 25.1 41.8 42.9 25 25 A G H >4 S+ 0 0 21 1,-0.2 3,-0.7 2,-0.2 4,-0.4 0.791 101.8 53.9 -60.9 -36.7 26.1 40.2 39.6 26 26 A I H >4 S+ 0 0 0 -4,-0.4 3,-0.6 1,-0.2 4,-0.4 0.860 108.2 53.1 -67.0 -34.2 22.6 39.2 38.5 27 27 A V H 3< S+ 0 0 36 -4,-1.1 -1,-0.2 -3,-0.3 -2,-0.2 0.592 98.9 66.0 -74.6 -13.6 21.6 42.9 39.1 28 28 A A T << S+ 0 0 54 -3,-0.7 -1,-0.2 -4,-0.5 -2,-0.2 0.532 89.1 58.4 -94.5 -8.9 24.4 44.3 36.9 29 29 A L S < S+ 0 0 14 -3,-0.6 80,-3.3 -4,-0.4 -1,-0.2 0.752 101.0 75.7 -84.7 -24.5 23.4 43.1 33.4 30 30 A F E S-a 109 0A 6 -4,-0.4 2,-0.2 78,-0.3 80,-0.2 -0.087 83.8-117.1 -77.0 172.2 20.1 44.9 33.8 31 31 A A E - 0 0 8 78,-1.3 -1,-0.1 77,-0.1 -2,-0.1 -0.534 36.6-102.2 -97.8 175.5 19.3 48.6 33.6 32 32 A D E S+ 0 0 129 -2,-0.2 16,-1.4 1,-0.2 17,-0.2 0.657 120.0 35.8 -75.4 -14.8 17.9 50.5 36.6 33 33 A D E S+ 0 0 101 14,-0.2 14,-0.7 15,-0.1 -1,-0.2 0.550 85.1 133.0-113.6 -10.2 14.3 50.4 35.4 34 34 A A E - 0 0 0 75,-0.3 13,-0.7 12,-0.1 2,-0.2 0.083 49.0-126.6 -44.3 150.7 14.2 47.0 33.6 35 35 A T E -aB 111 46A 56 75,-1.3 77,-2.8 11,-0.2 2,-0.4 -0.682 13.1-156.0-108.4 155.7 11.2 44.7 34.3 36 36 A V E +aB 112 45A 0 9,-2.0 9,-1.4 -2,-0.2 2,-0.3 -0.995 11.1 177.0-134.3 126.5 10.9 41.1 35.5 37 37 A E E -a 113 0A 39 75,-2.4 77,-1.0 -2,-0.4 5,-0.1 -0.688 20.7-171.9-130.0 72.3 7.9 38.9 34.8 38 38 A D S S+ 0 0 26 -2,-0.3 2,-0.2 5,-0.2 7,-0.1 -0.973 74.8 21.9-126.9 125.8 8.6 35.5 36.2 39 39 A P S > S- 0 0 53 0, 0.0 3,-0.8 0, 0.0 76,-0.2 0.689 114.6-104.3 -64.7 164.6 6.9 33.2 35.7 40 40 A V T 3 S+ 0 0 3 74,-1.6 -2,-0.1 1,-0.2 76,-0.1 -0.423 103.2 34.0 -64.4 130.5 5.4 34.9 32.6 41 41 A G T 3 S+ 0 0 42 1,-0.4 -1,-0.2 -2,-0.2 -3,-0.1 -0.447 91.2 103.1 125.2 -54.3 2.0 36.4 33.3 42 42 A S S < S- 0 0 39 -3,-0.8 -1,-0.4 1,-0.2 0, 0.0 0.197 89.5 -65.4 -54.9 174.9 2.2 37.4 37.0 43 43 A E - 0 0 158 1,-0.1 2,-0.4 -3,-0.1 -5,-0.2 -0.507 63.9-114.2 -69.0 128.6 2.7 40.9 38.3 44 44 A P - 0 0 70 0, 0.0 2,-0.3 0, 0.0 -7,-0.2 -0.555 10.7-129.0 -84.8 121.8 6.1 42.2 37.2 45 45 A R E -B 36 0A 85 -9,-1.4 -9,-2.0 -2,-0.4 2,-0.3 -0.436 39.2-168.2 -59.5 115.8 9.0 43.0 39.6 46 46 A S E > +B 35 0A 74 -2,-0.3 4,-1.2 -11,-0.2 -11,-0.2 -0.835 41.1 19.9-116.3 154.3 9.9 46.5 38.5 47 47 A G H > S- 0 0 18 -14,-0.7 4,-1.1 -13,-0.7 3,-0.3 0.307 99.4 -78.3 69.2 153.4 12.9 48.7 39.3 48 48 A T H > S+ 0 0 34 -16,-1.4 4,-1.7 1,-0.2 3,-0.4 0.893 124.9 76.6 -49.3 -37.1 16.2 47.2 40.7 49 49 A A H > S+ 0 0 51 1,-0.2 4,-1.1 -17,-0.2 -1,-0.2 0.872 100.6 29.3 -37.9 -73.8 14.2 47.1 44.0 50 50 A A H X S+ 0 0 41 -4,-1.2 4,-1.4 -3,-0.3 -1,-0.2 0.703 117.2 65.4 -68.8 -16.7 11.8 44.1 43.5 51 51 A I H >X S+ 0 0 2 -4,-1.1 4,-3.0 -3,-0.4 3,-1.1 1.000 99.0 44.3 -66.8 -75.9 14.4 42.4 41.2 52 52 A R H 3X S+ 0 0 118 -4,-1.7 4,-1.6 1,-0.3 -2,-0.1 0.871 119.2 45.6 -31.2 -57.2 17.4 41.7 43.5 53 53 A E H 3X S+ 0 0 117 -4,-1.1 4,-3.9 -5,-0.3 -1,-0.3 0.797 109.3 54.4 -66.0 -31.3 14.9 40.4 46.1 54 54 A F H < S+ 0 0 63 -4,-1.5 3,-0.9 1,-0.2 -1,-0.2 0.816 105.0 62.8 -86.6 -32.6 14.8 32.1 44.5 59 59 A L H 3< + 0 0 28 -4,-1.6 -1,-0.2 -3,-0.2 4,-0.2 0.506 69.4 104.2 -73.7 -0.8 18.5 31.9 45.3 60 60 A K T 3< S+ 0 0 158 -4,-0.7 -1,-0.2 -3,-0.3 -2,-0.1 0.586 81.6 50.5 -57.8 -12.4 17.8 30.6 48.8 61 61 A L S < S- 0 0 52 -3,-0.9 2,-0.6 27,-0.0 27,-0.1 -0.989 106.6 -94.6-125.3 140.4 18.7 27.1 47.6 62 62 A P - 0 0 127 0, 0.0 2,-0.5 0, 0.0 25,-0.3 -0.348 49.8-160.8 -50.0 100.6 21.9 26.1 45.6 63 63 A L - 0 0 21 -2,-0.6 2,-0.7 -45,-0.3 23,-0.2 -0.807 10.4-150.5 -89.3 128.5 20.4 26.4 42.2 64 64 A A B +F 85 0B 53 21,-1.9 21,-2.2 -2,-0.5 2,-0.5 -0.928 22.1 178.1 -98.9 110.6 22.3 24.6 39.4 65 65 A V + 0 0 2 -2,-0.7 -46,-0.2 -50,-0.2 2,-0.2 -0.879 6.7 162.2-123.2 99.9 21.7 26.6 36.3 66 66 A E - 0 0 138 -2,-0.5 17,-1.7 17,-0.1 2,-0.6 -0.672 43.5-107.7-107.4 161.6 23.4 25.5 33.1 67 67 A L - 0 0 39 -2,-0.2 15,-0.2 15,-0.2 4,-0.0 -0.866 22.2-163.9 -91.4 121.5 22.5 26.4 29.5 68 68 A T + 0 0 50 -2,-0.6 2,-0.3 13,-0.5 14,-0.2 0.312 69.4 9.2 -86.7 6.4 20.8 23.4 27.7 69 69 A Q S S- 0 0 46 12,-0.6 2,-0.1 0, 0.0 -1,-0.1 -0.985 92.5 -62.4-173.0 168.0 21.4 25.0 24.3 70 70 A E - 0 0 69 -2,-0.3 11,-0.3 1,-0.1 2,-0.2 -0.348 53.1-118.6 -59.4 131.9 22.9 27.7 22.1 71 71 A V - 0 0 13 9,-0.1 2,-0.5 -63,-0.1 9,-0.2 -0.550 21.5-148.1 -72.2 138.7 21.7 31.2 22.9 72 72 A R E +C 79 0A 1 7,-2.4 7,-3.5 -2,-0.2 2,-0.4 -0.968 21.7 177.4-109.4 125.3 19.9 32.9 20.0 73 73 A A E +C 78 0A 3 -2,-0.5 2,-0.3 5,-0.2 5,-0.2 -0.994 10.1 143.4-133.2 134.2 20.4 36.7 19.9 74 74 A V E > +C 77 0A 29 3,-2.4 3,-2.1 -2,-0.4 93,-0.1 -0.938 59.3 1.6-165.8 148.2 19.2 39.3 17.4 75 75 A A T 3 S- 0 0 43 1,-0.3 2,-0.8 -2,-0.3 -1,-0.1 0.889 126.2 -47.1 37.4 78.1 17.9 42.9 17.3 76 76 A N T 3 S+ 0 0 73 1,-0.1 27,-4.3 26,-0.1 -1,-0.3 0.270 121.8 104.0 58.5 -16.3 18.2 43.9 20.9 77 77 A E E < -CD 74 102A 22 -3,-2.1 -3,-2.4 -2,-0.8 2,-0.4 -0.669 49.6-170.2 -99.4 152.7 16.4 40.6 21.8 78 78 A A E -CD 73 101A 0 23,-2.2 23,-4.6 -2,-0.3 2,-0.3 -0.969 1.7-172.1-143.9 123.9 18.1 37.5 23.3 79 79 A A E +CD 72 100A 4 -7,-3.5 -7,-2.4 -2,-0.4 2,-0.3 -0.851 9.9 169.1-112.8 150.1 16.4 34.1 23.6 80 80 A F E - D 0 99A 0 19,-1.5 19,-1.9 -2,-0.3 2,-0.2 -0.871 26.3-139.9-166.2 132.5 17.8 31.0 25.4 81 81 A A E + D 0 98A 0 -11,-0.3 -12,-0.6 -2,-0.3 -13,-0.5 -0.618 39.7 145.2 -85.9 149.8 16.7 27.6 26.7 82 82 A F - 0 0 7 15,-1.4 2,-0.3 -15,-0.2 -15,-0.2 -0.959 37.2-109.4-168.5 180.0 18.0 26.3 30.1 83 83 A T - 0 0 30 -17,-1.7 2,-0.3 -2,-0.3 13,-0.2 -0.864 6.8-162.2-124.1 157.4 17.5 24.4 33.3 84 84 A V E - G 0 95B 26 11,-1.7 11,-3.3 -2,-0.3 2,-0.5 -0.879 18.5-173.9-139.1 105.6 17.1 25.2 37.0 85 85 A S E +FG 64 94B 38 -21,-2.2 -21,-1.9 -2,-0.3 2,-0.3 -0.893 9.7 164.4-108.8 130.0 17.7 22.2 39.4 86 86 A F E - G 0 93B 71 7,-1.2 7,-1.3 -2,-0.5 2,-0.3 -0.999 22.5-148.2-149.1 142.2 17.1 22.3 43.1 87 87 A E E + G 0 92B 120 -25,-0.3 2,-0.3 -2,-0.3 5,-0.2 -0.809 18.5 164.6-107.7 148.4 16.8 19.9 46.1 88 88 A Y E > S- G 0 91B 143 3,-1.0 3,-1.0 -2,-0.3 -2,-0.0 -0.839 70.3 -9.0-164.1 120.9 14.7 20.3 49.3 89 89 A Q T 3 S- 0 0 158 -2,-0.3 3,-0.1 1,-0.2 -2,-0.0 0.791 126.8 -50.3 58.2 38.6 13.8 17.5 51.9 90 90 A G T 3 S+ 0 0 67 1,-0.3 2,-0.3 0, 0.0 -1,-0.2 0.416 109.9 108.0 88.8 1.8 15.1 14.6 49.8 91 91 A R E < -G 88 0B 97 -3,-1.0 -3,-1.0 33,-0.0 2,-0.4 -0.761 59.2-132.2-112.7 157.0 13.5 15.2 46.4 92 92 A K E -G 87 0B 161 -2,-0.3 32,-2.0 33,-0.2 2,-0.3 -0.926 23.6-176.1-113.9 132.0 14.9 16.4 43.1 93 93 A T E -G 86 0B 15 -7,-1.3 -7,-1.2 -2,-0.4 2,-0.3 -0.872 10.2-170.4-127.7 156.3 13.4 19.1 40.9 94 94 A V E -G 85 0B 42 -2,-0.3 28,-2.7 -9,-0.2 2,-0.4 -0.832 7.0-160.9-152.1 106.9 14.1 20.7 37.5 95 95 A V E -GH 84 121B 18 -11,-3.3 -11,-1.7 -2,-0.3 26,-0.3 -0.761 6.7-164.1 -88.4 131.9 12.6 23.8 36.0 96 96 A A + 0 0 3 24,-2.4 -13,-0.2 -2,-0.4 21,-0.1 -0.648 25.6 160.1-115.8 75.2 13.0 24.0 32.2 97 97 A P - 0 0 4 0, 0.0 -15,-1.4 0, 0.0 2,-0.5 -0.423 35.6-137.3 -95.6 171.9 12.2 27.6 31.2 98 98 A I E -DE 81 115A 6 17,-1.6 17,-3.1 -17,-0.2 2,-0.2 -0.997 19.4-152.8-124.1 120.0 13.0 29.9 28.2 99 99 A N E -DE 80 114A 2 -19,-1.9 -19,-1.5 -2,-0.5 2,-0.4 -0.627 3.0-155.8 -88.2 154.0 14.0 33.4 28.9 100 100 A H E -DE 79 113A 32 13,-2.3 13,-1.6 -2,-0.2 2,-0.6 -0.964 13.9-160.7-130.0 111.9 13.4 36.3 26.4 101 101 A F E -DE 78 112A 0 -23,-4.6 -23,-2.2 -2,-0.4 2,-0.7 -0.871 7.1-166.2-102.8 114.2 15.9 39.1 27.0 102 102 A R E -DE 77 111A 116 9,-2.0 8,-3.3 -2,-0.6 9,-0.7 -0.884 11.9-162.6-101.7 111.0 15.1 42.5 25.6 103 103 A F E - E 0 109A 3 -27,-4.3 6,-0.2 -2,-0.7 -73,-0.1 -0.709 12.5-131.7 -92.2 140.7 18.2 44.7 25.7 104 104 A N > - 0 0 54 4,-1.4 3,-0.6 -2,-0.3 -1,-0.1 -0.203 37.4 -91.8 -76.6-178.5 18.0 48.4 25.4 105 105 A G T 3 S+ 0 0 69 1,-0.2 -1,-0.1 2,-0.1 -2,-0.0 0.048 116.0 67.3 -86.6 26.2 20.2 50.4 23.0 106 106 A A T 3 S- 0 0 69 2,-0.3 -1,-0.2 0, 0.0 3,-0.1 0.656 115.9 -95.4-112.1 -29.7 23.0 50.9 25.6 107 107 A G S < S+ 0 0 9 -3,-0.6 2,-0.1 1,-0.5 -2,-0.1 0.095 90.5 102.3 130.7 -18.0 24.3 47.4 26.1 108 108 A K S S- 0 0 95 1,-0.1 -4,-1.4 -106,-0.0 -1,-0.5 -0.375 75.6-100.7 -91.6 170.4 22.3 46.4 29.2 109 109 A V E -aE 30 103A 0 -80,-3.3 -78,-1.3 -6,-0.2 -6,-0.3 -0.731 31.5-179.0 -91.6 140.2 19.2 44.2 29.6 110 110 A V E + 0 0 32 -8,-3.3 -75,-1.3 -2,-0.3 2,-0.2 0.429 62.2 20.3-125.5 2.0 15.8 45.9 30.0 111 111 A S E -aE 35 102A 3 -9,-0.7 -9,-2.0 -77,-0.2 2,-0.5 -0.800 55.9-161.6-168.8 131.1 13.1 43.2 30.4 112 112 A M E +aE 36 101A 2 -77,-2.8 -75,-2.4 -2,-0.2 2,-0.4 -0.952 11.3 174.1-120.9 114.5 13.2 39.6 31.5 113 113 A R E -aE 37 100A 39 -13,-1.6 -13,-2.3 -2,-0.5 2,-0.4 -0.912 11.0-166.2-111.7 144.0 10.3 37.2 30.7 114 114 A A E - 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0 0 60 2,-0.1 3,-1.8 3,-0.1 4,-1.3 0.543 59.4 -97.6 74.3 137.0 -4.7 26.3 28.2 130 4 B P H 3> S+ 0 0 66 0, 0.0 4,-1.6 0, 0.0 -1,-0.1 0.849 123.2 65.0 -50.3 -34.7 -1.0 25.4 28.0 131 5 B E H 3> S+ 0 0 151 1,-0.2 4,-0.5 2,-0.2 -2,-0.1 0.763 100.1 50.0 -61.1 -29.3 -2.1 22.0 26.9 132 6 B H H X> S+ 0 0 56 -3,-1.8 4,-1.7 -4,-0.4 3,-0.8 0.902 104.4 57.9 -75.3 -40.7 -3.5 23.4 23.7 133 7 B M H 3X S+ 0 0 0 -4,-1.3 4,-3.2 1,-0.3 -2,-0.2 0.880 98.5 57.4 -60.6 -42.8 -0.4 25.4 22.8 134 8 B T H 3X S+ 0 0 47 -4,-1.6 4,-2.8 1,-0.2 -1,-0.3 0.835 108.5 50.3 -57.2 -30.4 1.9 22.3 22.7 135 9 B A H X S+ 0 0 0 -4,-3.2 3,-2.6 2,-0.2 4,-2.1 0.998 113.1 46.9 -59.0 -64.9 3.4 24.0 18.3 138 12 B Q H 3X S+ 0 0 110 -4,-2.8 4,-1.3 1,-0.3 -2,-0.2 0.786 112.2 50.8 -45.6 -37.0 3.4 20.3 17.4 139 13 B R H 3X S+ 0 0 134 -4,-2.4 4,-1.4 2,-0.2 -1,-0.3 0.554 108.3 52.4 -82.8 -8.7 1.1 21.0 14.4 140 14 B Y H S+ 0 0 2 -4,-1.4 5,-0.7 1,-0.2 9,-0.2 0.572 112.4 53.0 -64.5 -9.1 2.8 21.5 8.7 144 18 B L H ><5S+ 0 0 11 -4,-1.0 3,-0.9 3,-0.2 45,-0.3 0.903 110.3 42.7 -86.0 -57.4 6.4 22.6 8.2 145 19 B N H 3<5S+ 0 0 78 -4,-2.1 44,-0.4 1,-0.2 -2,-0.2 0.953 121.9 39.2 -50.8 -58.6 7.9 19.1 7.5 146 20 B A T 3<5S- 0 0 84 -4,-2.3 -1,-0.2 -5,-0.1 3,-0.2 0.383 106.9-121.1 -79.7 2.8 5.1 17.9 5.2 147 21 B G T < 5 + 0 0 38 -3,-0.9 2,-1.3 -5,-0.2 -3,-0.2 0.888 50.2 166.1 58.4 37.5 4.6 21.3 3.5 148 22 B D >< + 0 0 83 -5,-0.7 4,-2.4 -6,-0.3 -1,-0.2 -0.732 8.5 177.3 -86.2 89.2 1.0 21.4 4.6 149 23 B L H > S+ 0 0 60 -2,-1.3 4,-2.5 2,-0.2 5,-0.4 0.959 75.5 49.6 -63.2 -53.1 0.3 25.0 3.9 150 24 B D H > S+ 0 0 138 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.954 110.9 52.7 -50.7 -53.0 -3.4 25.1 4.9 151 25 B G H > S+ 0 0 16 2,-0.2 4,-1.8 1,-0.2 3,-0.3 0.947 111.5 46.7 -42.7 -62.9 -2.4 23.4 8.2 152 26 B I H >< S+ 0 0 0 -4,-2.4 3,-0.7 1,-0.2 4,-0.3 0.932 116.3 41.4 -43.7 -66.6 0.2 26.2 8.8 153 27 B V H >< S+ 0 0 30 -4,-2.5 3,-1.1 1,-0.2 -1,-0.2 0.771 108.8 62.6 -58.5 -29.5 -2.0 29.2 7.9 154 28 B A H 3< S+ 0 0 46 -4,-3.0 -1,-0.2 -5,-0.4 -2,-0.2 0.928 93.8 61.8 -60.1 -45.6 -4.9 27.5 9.8 155 29 B L T << S+ 0 0 21 -4,-1.8 80,-2.5 -3,-0.7 -1,-0.2 0.555 99.7 76.4 -58.8 -10.3 -3.0 27.7 13.1 156 30 B F E < S-i 235 0C 8 -3,-1.1 2,-0.2 -4,-0.3 80,-0.2 -0.440 88.1 -94.9-102.8 171.2 -2.9 31.5 12.9 157 31 B A E > - 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