==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-MAR-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 04-FEB-11 3QMJ . COMPND 2 MOLECULE: ENOYL-COA HYDRATASE, ECHA8_6; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM MARINUM; . AUTHOR SEATTLE STRUCTURAL GENOMICS CENTER FOR INFECTIOUS DISEASE (S . 211 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10276.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 153 72.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 30 14.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 10 4.7 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 . 0 0.0 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 4.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 23 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 74 35.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.9 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 0 1 0 1 0 1 1 1 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 2 1 2 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 PARALLEL BRIDGES PER LADDER . 0 1 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 1 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 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 V 0 0 120 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 133.4 12.8 1.6 -10.4 2 2 A T + 0 0 38 1,-0.2 15,-3.2 16,-0.1 2,-0.4 0.620 360.0 43.2 -82.8 -16.9 15.3 -1.3 -10.4 3 3 A L E -A 16 0A 17 13,-0.2 2,-0.3 14,-0.1 13,-0.2 -0.958 69.7-156.0-134.6 113.5 13.8 -3.0 -13.5 4 4 A Q E -A 15 0A 45 11,-2.4 11,-2.8 -2,-0.4 2,-0.4 -0.721 14.1-166.7 -84.2 138.3 12.7 -1.2 -16.7 5 5 A I E +A 14 0A 87 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.997 11.7 169.0-129.8 127.0 10.0 -3.1 -18.7 6 6 A D E -A 13 0A 105 7,-1.9 7,-3.0 -2,-0.4 2,-0.4 -0.995 20.5-147.8-147.3 137.3 9.1 -2.1 -22.3 7 7 A D E +A 12 0A 68 -2,-0.3 2,-0.2 5,-0.2 5,-0.2 -0.843 22.0 161.7-105.0 141.3 7.0 -3.8 -25.0 8 8 A D E > S-A 11 0A 75 3,-1.7 3,-1.0 -2,-0.4 -2,-0.0 -0.792 73.9 -16.0-162.6 109.3 7.6 -3.5 -28.7 9 9 A N T 3 S- 0 0 102 -2,-0.2 3,-0.1 1,-0.2 186,-0.1 0.849 125.5 -54.4 59.5 40.4 6.2 -5.9 -31.4 10 10 A R T 3 S+ 0 0 92 1,-0.2 37,-3.1 35,-0.1 38,-1.8 0.574 112.1 117.9 71.2 13.9 5.3 -8.6 -28.8 11 11 A V E < -Ab 8 48A 0 -3,-1.0 -3,-1.7 36,-0.2 2,-0.6 -0.956 53.2-153.9-104.6 124.3 8.9 -8.7 -27.3 12 12 A R E -Ab 7 49A 26 36,-3.0 38,-2.2 -2,-0.5 2,-0.5 -0.917 8.6-155.0-100.6 118.4 9.0 -7.7 -23.7 13 13 A T E -Ab 6 50A 5 -7,-3.0 -7,-1.9 -2,-0.6 2,-0.6 -0.807 5.6-163.4 -95.6 123.1 12.4 -6.3 -22.8 14 14 A L E -Ab 5 51A 0 36,-2.8 38,-2.3 -2,-0.5 2,-0.7 -0.954 8.0-168.2-101.4 118.2 13.5 -6.5 -19.2 15 15 A T E -Ab 4 52A 35 -11,-2.8 -11,-2.4 -2,-0.6 38,-0.2 -0.922 20.7-133.3-112.7 104.7 16.4 -4.1 -18.6 16 16 A L E -Ab 3 53A 1 36,-2.8 38,-2.5 -2,-0.7 -13,-0.2 -0.398 25.3-163.5 -54.5 127.2 18.1 -4.7 -15.2 17 17 A N + 0 0 56 -15,-3.2 -14,-0.1 36,-0.2 -1,-0.1 -0.415 56.2 97.7-132.0 56.5 18.4 -1.1 -13.9 18 18 A R > > + 0 0 33 36,-0.2 5,-2.9 -2,-0.1 3,-1.2 -0.523 40.7 160.6-125.7 62.2 20.9 -0.7 -11.1 19 19 A P G > 5 + 0 0 46 0, 0.0 3,-1.5 0, 0.0 38,-0.2 0.801 69.6 57.2 -59.5 -33.9 23.7 0.5 -13.3 20 20 A E G 3 5S+ 0 0 149 1,-0.3 35,-0.0 2,-0.1 -2,-0.0 0.794 111.2 43.6 -64.8 -31.1 25.7 2.0 -10.4 21 21 A A G X 5S- 0 0 28 -3,-1.2 3,-1.9 3,-0.1 39,-0.3 0.003 121.2-109.2 -97.7 23.9 25.7 -1.4 -8.7 22 22 A L T < 5 - 0 0 32 -3,-1.5 38,-2.2 1,-0.3 39,-0.2 0.851 69.4 -66.8 44.7 40.2 26.6 -3.1 -12.0 23 23 A N T 3 - 0 0 18 -2,-1.1 4,-2.7 36,-0.2 5,-0.2 -0.370 51.9 -90.9 -75.7 175.7 19.4 -7.1 -4.5 27 27 A E H > S+ 0 0 24 1,-0.2 4,-2.5 2,-0.2 55,-0.4 0.906 128.7 54.1 -56.9 -43.6 16.2 -8.6 -3.1 28 28 A A H > S+ 0 0 52 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.896 111.8 44.1 -60.6 -40.8 14.1 -5.9 -4.8 29 29 A L H > S+ 0 0 0 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.870 112.4 51.7 -73.2 -38.0 15.6 -6.7 -8.2 30 30 A Y H X S+ 0 0 2 -4,-2.7 4,-2.4 2,-0.2 -2,-0.2 0.921 114.9 44.6 -55.7 -45.2 15.3 -10.5 -7.7 31 31 A D H X S+ 0 0 38 -4,-2.5 4,-2.4 -5,-0.2 -2,-0.2 0.926 114.2 47.4 -67.8 -49.1 11.6 -9.9 -6.8 32 32 A A H X S+ 0 0 32 -4,-2.6 4,-2.5 2,-0.2 -1,-0.2 0.891 114.8 46.3 -58.6 -43.6 10.9 -7.5 -9.7 33 33 A T H X S+ 0 0 2 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.945 113.2 47.7 -68.2 -47.1 12.6 -9.8 -12.2 34 34 A A H X S+ 0 0 0 -4,-2.4 4,-1.7 -5,-0.2 -2,-0.2 0.929 115.5 45.8 -58.4 -46.5 10.9 -13.0 -11.0 35 35 A Q H X S+ 0 0 81 -4,-2.4 4,-2.5 1,-0.2 5,-0.2 0.909 108.0 56.6 -64.5 -42.0 7.5 -11.2 -11.0 36 36 A A H X S+ 0 0 3 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.862 107.9 49.7 -57.2 -35.4 8.2 -9.7 -14.5 37 37 A L H X S+ 0 0 5 -4,-1.8 4,-2.4 2,-0.2 -1,-0.2 0.868 109.5 48.7 -72.7 -40.8 8.7 -13.2 -15.8 38 38 A L H X S+ 0 0 70 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.937 113.8 48.1 -63.6 -47.5 5.4 -14.7 -14.3 39 39 A D H X S+ 0 0 73 -4,-2.5 4,-1.7 1,-0.2 -2,-0.2 0.923 112.2 48.2 -55.0 -51.6 3.6 -11.7 -15.8 40 40 A A H < S+ 0 0 0 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.880 108.8 54.9 -55.5 -42.4 5.3 -12.2 -19.2 41 41 A A H < S+ 0 0 23 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.890 116.4 37.5 -58.1 -41.8 4.4 -15.9 -19.0 42 42 A D H < S+ 0 0 131 -4,-2.1 -1,-0.2 -5,-0.1 -2,-0.2 0.635 92.6 100.4 -82.7 -21.8 0.7 -15.0 -18.5 43 43 A D >< - 0 0 48 -4,-1.7 3,-1.4 -5,-0.2 -4,-0.0 -0.600 56.1-159.2 -80.8 121.3 0.5 -12.0 -20.8 44 44 A P T 3 S+ 0 0 109 0, 0.0 -1,-0.2 0, 0.0 155,-0.1 0.632 90.7 60.9 -73.8 -13.9 -1.1 -12.9 -24.2 45 45 A Q T 3 S+ 0 0 56 154,-0.0 2,-0.5 2,-0.0 -35,-0.1 0.264 91.7 80.5 -91.3 6.7 0.5 -9.9 -25.9 46 46 A V < + 0 0 0 -3,-1.4 -35,-0.2 -6,-0.2 3,-0.1 -0.976 42.5 164.1-118.0 118.0 4.0 -11.1 -25.1 47 47 A A + 0 0 0 -37,-3.1 2,-0.3 -2,-0.5 -36,-0.2 0.802 69.5 19.2 -93.0 -40.4 5.7 -13.7 -27.3 48 48 A V E -b 11 0A 0 -38,-1.8 -36,-3.0 47,-0.1 2,-0.4 -0.961 62.7-142.6-135.2 144.9 9.3 -13.3 -26.3 49 49 A V E -bc 12 97A 0 47,-2.4 49,-3.2 -2,-0.3 2,-0.5 -0.947 11.9-164.6-108.1 134.7 11.3 -11.9 -23.4 50 50 A L E -bc 13 98A 0 -38,-2.2 -36,-2.8 -2,-0.4 2,-0.5 -0.976 7.7-162.7-114.9 122.5 14.6 -10.1 -23.9 51 51 A L E +bc 14 99A 4 47,-3.2 49,-3.0 -2,-0.5 2,-0.3 -0.911 22.8 143.7-114.0 129.1 16.8 -9.6 -20.9 52 52 A T E -bc 15 100A 5 -38,-2.3 -36,-2.8 -2,-0.5 2,-0.3 -0.888 37.6-110.4-150.6 176.6 19.6 -7.1 -20.8 53 53 A G E -b 16 0A 9 47,-0.5 2,-0.3 -2,-0.3 -36,-0.2 -0.885 20.5-121.6-119.1 151.5 21.4 -4.7 -18.4 54 54 A S S > S- 0 0 38 -38,-2.5 3,-0.6 -2,-0.3 -36,-0.2 -0.657 75.4 -6.4 -86.0 142.5 21.7 -0.9 -18.2 55 55 A G T 3 S- 0 0 49 -2,-0.3 -2,-0.1 1,-0.2 -35,-0.1 -0.279 119.1 -25.1 77.0-150.9 25.1 0.6 -18.3 56 56 A R T 3 S+ 0 0 191 -37,-0.2 48,-0.6 47,-0.1 2,-0.3 0.724 118.1 64.9 -78.2 -22.9 28.5 -1.1 -18.4 57 57 A G E < -g 104 0C 0 -3,-0.6 48,-0.1 46,-0.2 45,-0.1 -0.681 53.7-161.0-100.2 150.7 27.4 -4.4 -16.6 58 58 A F E S- 0 0 2 46,-2.1 2,-0.3 -2,-0.3 47,-0.2 0.871 84.5 -38.3 -80.7 -69.4 25.0 -7.2 -17.6 59 59 A S E -g 105 0C 0 45,-1.8 47,-2.6 44,-0.1 -36,-0.2 -0.847 39.2-154.8-155.7 128.0 24.8 -8.3 -13.9 60 60 A A - 0 0 32 -38,-2.2 -36,-0.2 -39,-0.3 2,-0.1 0.415 53.6-127.0 -71.2 1.0 27.4 -8.5 -11.1 61 61 A G + 0 0 2 -38,-0.4 -36,-2.3 -39,-0.2 -1,-0.3 -0.456 66.4 13.2 89.0-159.0 25.2 -11.2 -9.6 62 62 A T B S-f 25 0B 44 -38,-0.2 2,-1.3 -2,-0.1 -36,-0.2 -0.254 81.1-115.8 -53.0 131.5 23.9 -11.4 -6.0 63 63 A D > - 0 0 21 -38,-2.3 4,-2.0 1,-0.2 -1,-0.1 -0.629 34.6-176.4 -73.4 96.7 24.3 -8.0 -4.2 64 64 A L H > S+ 0 0 108 -2,-1.3 4,-2.0 2,-0.2 -1,-0.2 0.788 77.6 59.1 -69.6 -28.9 26.7 -9.1 -1.5 65 65 A A H > S+ 0 0 76 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.932 108.7 44.2 -65.3 -45.4 26.8 -5.6 0.1 66 66 A E H > S+ 0 0 57 1,-0.2 4,-2.8 2,-0.2 -2,-0.2 0.930 111.0 55.8 -62.7 -42.3 23.0 -5.8 0.7 67 67 A M H X S+ 0 0 75 -4,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.865 105.7 51.0 -58.6 -39.4 23.4 -9.4 1.9 68 68 A Q H X S+ 0 0 127 -4,-2.0 4,-1.1 2,-0.2 -1,-0.2 0.931 110.3 48.9 -60.4 -48.3 25.9 -8.3 4.5 69 69 A A H >X S+ 0 0 45 -4,-1.9 4,-1.3 1,-0.2 3,-0.6 0.932 111.1 51.3 -56.6 -47.1 23.6 -5.6 5.8 70 70 A R H 3< S+ 0 0 25 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.863 110.9 45.6 -60.2 -41.8 20.7 -8.1 6.0 71 71 A I H 3< S+ 0 0 116 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.653 116.8 46.8 -77.8 -16.6 22.6 -10.7 8.0 72 72 A T H << S+ 0 0 97 -4,-1.1 -2,-0.2 -3,-0.6 -1,-0.2 0.518 90.1 102.3-102.4 -10.1 23.9 -8.0 10.4 73 73 A D S < S- 0 0 78 -4,-1.3 3,-0.0 -3,-0.2 -3,-0.0 -0.411 84.7-114.5 -66.2 149.4 20.6 -6.2 11.0 74 74 A P S S+ 0 0 126 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 0.881 107.6 35.7 -44.8 -45.6 18.7 -6.7 14.2 75 75 A N S S- 0 0 134 2,-0.0 2,-0.1 0, 0.0 -2,-0.1 -0.967 86.2-130.2-120.9 130.6 16.0 -8.4 12.1 76 76 A F - 0 0 120 -2,-0.4 2,-0.3 -5,-0.1 -5,-0.1 -0.448 27.5-166.6 -71.7 147.6 16.6 -10.5 9.0 77 77 A S - 0 0 62 -2,-0.1 2,-0.3 -7,-0.1 -4,-0.1 -0.984 7.8-176.4-141.6 151.2 14.5 -9.5 5.9 78 78 A E - 0 0 147 -2,-0.3 2,-0.2 4,-0.0 4,-0.0 -0.931 25.3-111.4-141.0 160.4 13.8 -11.2 2.6 79 79 A G - 0 0 19 -2,-0.3 -51,-0.1 1,-0.1 -52,-0.0 -0.487 36.3-108.7 -84.7 165.0 12.0 -10.6 -0.7 80 80 A K S S+ 0 0 93 -2,-0.2 -1,-0.1 1,-0.1 -52,-0.1 0.806 114.5 9.5 -60.6 -31.3 8.9 -12.5 -1.7 81 81 A F S > S+ 0 0 61 -54,-0.2 4,-2.2 3,-0.0 3,-0.2 0.778 83.3 166.8-114.8 -56.9 11.0 -14.4 -4.3 82 82 A G H > - 0 0 6 -55,-0.4 4,-1.7 2,-0.2 5,-0.1 -0.190 68.7 -38.1 65.8-162.5 14.7 -13.7 -3.9 83 83 A F H > S+ 0 0 82 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.939 142.1 52.4 -56.4 -50.1 17.4 -15.8 -5.7 84 84 A R H > S+ 0 0 75 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.885 110.4 47.5 -58.4 -45.7 15.3 -19.0 -5.2 85 85 A G H X S+ 0 0 16 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.801 109.3 53.3 -66.5 -33.3 12.2 -17.5 -6.7 86 86 A L H X S+ 0 0 0 -4,-1.7 4,-2.9 2,-0.2 5,-0.2 0.944 107.4 51.4 -66.5 -47.3 14.1 -16.1 -9.7 87 87 A I H X S+ 0 0 27 -4,-2.4 4,-3.1 1,-0.2 -2,-0.2 0.892 111.2 48.2 -54.1 -44.1 15.5 -19.6 -10.5 88 88 A K H X S+ 0 0 67 -4,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.884 111.9 48.3 -67.1 -41.6 12.0 -21.1 -10.4 89 89 A A H X S+ 0 0 12 -4,-2.0 4,-0.9 2,-0.2 -2,-0.2 0.937 116.5 44.9 -60.8 -45.8 10.6 -18.4 -12.7 90 90 A L H >< S+ 0 0 5 -4,-2.9 3,-0.6 1,-0.2 -2,-0.2 0.921 112.9 49.5 -62.4 -47.3 13.5 -18.9 -15.1 91 91 A A H 3< S+ 0 0 60 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.850 119.1 38.1 -64.3 -34.8 13.3 -22.7 -15.0 92 92 A G H 3< S+ 0 0 59 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.479 79.6 129.2 -95.1 -3.9 9.6 -22.7 -15.7 93 93 A F << - 0 0 8 -4,-0.9 4,-0.1 -3,-0.6 -55,-0.1 -0.337 40.6-165.4 -59.7 120.4 9.4 -19.8 -18.2 94 94 A P + 0 0 41 0, 0.0 113,-0.2 0, 0.0 112,-0.2 0.512 59.3 69.4 -95.7 -1.9 7.5 -21.2 -21.1 95 95 A K S S- 0 0 5 1,-0.1 -47,-0.1 111,-0.1 22,-0.1 -0.646 99.6 -73.6-109.0 163.6 8.2 -18.7 -23.8 96 96 A P - 0 0 9 0, 0.0 -47,-2.4 0, 0.0 2,-0.5 -0.369 46.1-158.7 -57.8 134.0 11.5 -17.9 -25.6 97 97 A L E -c 49 0A 0 -49,-0.2 20,-2.8 18,-0.2 21,-1.5 -0.987 7.3-170.6-118.7 122.5 14.0 -16.1 -23.4 98 98 A I E -cd 50 118A 0 -49,-3.2 -47,-3.2 -2,-0.5 2,-0.4 -0.956 5.8-157.7-115.6 128.9 16.8 -14.1 -25.1 99 99 A C E -cd 51 119A 0 19,-2.4 21,-2.7 -2,-0.5 2,-0.6 -0.904 5.3-162.9-104.0 136.3 19.7 -12.7 -23.2 100 100 A A E -cd 52 120A 0 -49,-3.0 2,-1.1 -2,-0.4 -47,-0.5 -0.911 13.0-155.7-116.0 97.4 21.7 -9.8 -24.5 101 101 A V E + d 0 121A 0 19,-3.0 21,-3.0 -2,-0.6 24,-0.2 -0.632 19.6 172.3 -80.4 100.4 24.9 -9.8 -22.4 102 102 A N - 0 0 32 -2,-1.1 2,-0.3 19,-0.2 -1,-0.2 0.539 61.5 -25.2 -90.9 -10.8 26.1 -6.2 -22.6 103 103 A G S S+ 0 0 4 1,-0.1 -46,-0.2 23,-0.1 -44,-0.1 -0.868 106.1 4.5-172.6-151.6 28.9 -6.4 -20.1 104 104 A L E -g 57 0C 34 -48,-0.6 -46,-2.1 -2,-0.3 -45,-1.8 -0.096 48.3-171.1 -59.4 138.6 30.1 -8.3 -17.1 105 105 A G E +gh 59 127C 0 21,-1.9 23,-2.5 -47,-0.2 2,-0.4 -0.962 10.5 177.0-129.3 112.0 28.1 -11.3 -16.0 106 106 A V E > - h 0 128C 26 -47,-2.6 3,-2.4 -2,-0.4 2,-0.3 -0.931 54.3 -28.9-121.9 138.3 29.2 -12.7 -12.6 107 107 A G T >> S+ 0 0 22 21,-2.3 4,-3.0 -2,-0.4 3,-1.7 -0.410 142.4 6.6 63.7-117.6 27.6 -15.6 -10.7 108 108 A I H 3> S+ 0 0 8 1,-0.3 4,-1.9 -2,-0.3 -1,-0.3 0.784 126.1 69.0 -64.5 -26.4 23.9 -15.7 -11.5 109 109 A G H <4 S+ 0 0 1 -3,-2.4 -1,-0.3 1,-0.2 -2,-0.2 0.733 113.6 29.6 -62.2 -21.2 24.8 -13.0 -14.1 110 110 A A H X4 S+ 0 0 3 -3,-1.7 3,-1.6 18,-0.2 -2,-0.2 0.774 118.8 51.8-100.1 -45.6 26.6 -15.8 -15.9 111 111 A T H >< S+ 0 0 18 -4,-3.0 3,-1.8 1,-0.3 4,-0.2 0.717 90.9 77.5 -74.0 -16.3 24.7 -18.9 -15.0 112 112 A I G >< S+ 0 0 2 -4,-1.9 3,-1.9 1,-0.3 4,-0.3 0.770 79.2 75.0 -57.9 -24.2 21.4 -17.3 -16.0 113 113 A L G X S+ 0 0 4 -3,-1.6 3,-1.0 1,-0.3 -1,-0.3 0.718 78.7 71.9 -63.1 -21.1 22.5 -18.1 -19.6 114 114 A G G < S+ 0 0 16 -3,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.706 99.9 46.5 -66.0 -19.2 21.7 -21.8 -18.9 115 115 A Y G < S+ 0 0 20 -3,-1.9 2,-0.3 -4,-0.2 -1,-0.2 0.424 90.9 107.8-100.3 -1.8 18.0 -20.8 -19.1 116 116 A A < - 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0 0 40 -2,-0.3 3,-1.1 -57,-0.2 4,-1.1 -0.336 48.4-102.4 -61.3 158.5 29.9 -5.4 -31.4 180 182 A P G >4 S+ 0 0 65 0, 0.0 3,-0.7 0, 0.0 4,-0.5 0.918 123.1 46.5 -53.3 -45.8 28.6 -3.3 -28.5 181 183 A E G 34 S+ 0 0 140 1,-0.2 -2,-0.0 2,-0.1 -59,-0.0 0.629 114.6 47.4 -71.7 -16.3 26.5 -1.1 -30.7 182 184 A E G <> S+ 0 0 94 -3,-1.1 4,-2.7 2,-0.1 5,-0.3 0.484 86.9 89.9-101.4 -6.1 25.0 -4.1 -32.6 183 185 A L H S+ 0 0 69 -4,-0.5 4,-3.2 2,-0.2 5,-0.3 0.908 116.9 52.9 -71.3 -41.8 20.6 -5.0 -29.0 185 187 A P H > S+ 0 0 70 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.921 115.5 41.9 -56.4 -41.8 19.7 -4.5 -32.6 186 188 A E H X S+ 0 0 54 -4,-2.7 4,-2.0 2,-0.2 5,-0.2 0.948 116.4 47.3 -70.8 -47.2 20.8 -8.1 -33.4 187 189 A A H X S+ 0 0 0 -4,-2.9 4,-2.5 -5,-0.3 -3,-0.2 0.940 115.3 46.8 -57.0 -46.2 19.2 -9.5 -30.3 188 190 A R H X S+ 0 0 58 -4,-3.2 4,-2.5 1,-0.2 -1,-0.2 0.893 108.1 55.0 -64.9 -40.9 16.0 -7.6 -31.1 189 191 A R H X S+ 0 0 116 -4,-2.2 4,-1.3 -5,-0.3 -1,-0.2 0.914 113.1 42.6 -57.5 -43.9 15.9 -8.6 -34.8 190 192 A H H X S+ 0 0 30 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.902 112.3 53.7 -70.7 -41.0 16.0 -12.3 -33.8 191 193 A A H X S+ 0 0 0 -4,-2.5 4,-2.7 -5,-0.2 -2,-0.2 0.882 108.1 50.8 -56.2 -42.7 13.5 -11.8 -31.0 192 194 A E H X S+ 0 0 65 -4,-2.5 4,-1.2 2,-0.2 -1,-0.2 0.786 105.6 55.5 -68.7 -31.4 11.1 -10.1 -33.5 193 195 A I H < S+ 0 0 82 -4,-1.3 3,-0.4 -5,-0.2 4,-0.3 0.957 115.4 39.1 -63.4 -46.9 11.4 -13.1 -35.9 194 196 A L H >< S+ 0 0 51 -4,-2.0 3,-1.6 1,-0.2 -2,-0.2 0.905 112.1 56.7 -66.5 -41.0 10.4 -15.4 -33.1 195 197 A A H 3< S+ 0 0 0 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.700 95.7 65.1 -70.7 -21.9 7.7 -13.1 -31.7 196 198 A A T 3< S+ 0 0 75 -4,-1.2 -1,-0.3 -3,-0.4 -2,-0.2 0.581 88.3 88.2 -72.4 -13.3 5.9 -12.9 -35.1 197 199 A K S < S- 0 0 93 -3,-1.6 2,-0.1 -4,-0.3 5,-0.0 -0.455 100.1 -82.4 -84.6 159.3 5.1 -16.6 -34.7 198 200 A P > - 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