==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 27-NOV-07 2ZDP . COMPND 2 MOLECULE: HEME-DEGRADING MONOOXYGENASE ISDI; . SOURCE 2 ORGANISM_SCIENTIFIC: STAPHYLOCOCCUS AUREUS; . AUTHOR W.C.LEE,M.L.RENIERE,E.P.SKAAR,M.E.P.MURPHY . 220 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12427.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 155 70.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 79 35.9 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 . 0 0.0 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 . 19 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 29 13.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), 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 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 3 1 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 4 0 3 1 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 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 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 A 0 0 149 0, 0.0 2,-0.3 0, 0.0 60,-0.0 0.000 360.0 360.0 360.0 136.2 -2.5 42.8 55.1 2 0 A H - 0 0 83 1,-0.1 60,-0.3 104,-0.0 103,-0.1 -0.612 360.0-126.9 -89.5 139.7 -4.6 41.4 52.3 3 1 A M - 0 0 39 101,-0.4 101,-2.6 -2,-0.3 2,-0.3 -0.198 29.6-139.5 -63.9 167.2 -6.6 38.2 52.3 4 2 A F E -AB 59 103A 4 55,-2.2 55,-2.8 99,-0.2 2,-0.4 -0.971 9.7-153.5-139.9 145.1 -6.0 35.8 49.4 5 3 A M E -AB 58 102A 5 97,-2.7 97,-2.5 -2,-0.3 2,-0.4 -0.991 4.9-168.0-122.6 133.6 -8.1 33.6 47.2 6 4 A A E -AB 57 101A 4 51,-2.2 51,-2.8 -2,-0.4 2,-0.4 -0.937 7.6-164.6-112.7 144.1 -7.1 30.4 45.4 7 5 A E E -AB 56 100A 4 93,-2.9 93,-2.5 -2,-0.4 2,-0.5 -0.994 11.4-164.1-125.9 130.1 -9.3 28.8 42.7 8 6 A N E -AB 55 99A 42 47,-2.1 47,-2.6 -2,-0.4 2,-0.6 -0.985 17.4-157.8-106.2 119.1 -9.1 25.3 41.3 9 7 A R E -AB 54 98A 50 89,-2.8 89,-1.6 -2,-0.5 2,-0.5 -0.878 4.4-159.6-102.3 116.5 -11.2 25.3 38.1 10 8 A L E -AB 53 97A 9 43,-3.4 43,-2.1 -2,-0.6 2,-0.6 -0.851 7.9-153.8-100.2 125.0 -12.4 21.8 37.0 11 9 A Q E -AB 52 96A 81 85,-2.5 84,-2.5 -2,-0.5 85,-1.2 -0.875 28.9-171.3 -93.0 122.5 -13.4 21.2 33.4 12 10 A L E -AB 51 94A 0 39,-2.6 39,-1.5 -2,-0.6 82,-0.2 -0.802 29.7 -95.1-120.7 152.7 -15.9 18.3 33.6 13 11 A Q > - 0 0 83 80,-2.2 3,-2.1 -2,-0.3 4,-0.2 -0.350 64.8 -84.0 -54.8 141.6 -17.7 15.9 31.3 14 12 A K T 3 S+ 0 0 133 35,-0.5 -1,-0.1 1,-0.2 36,-0.1 -0.238 116.0 16.7 -52.1 132.7 -21.2 17.2 30.6 15 13 A G T 3 S+ 0 0 66 -3,-0.1 4,-0.3 1,-0.0 -1,-0.2 0.422 97.6 100.6 85.7 -1.7 -23.6 16.2 33.4 16 14 A S <> + 0 0 3 -3,-2.1 4,-1.8 1,-0.2 5,-0.2 0.406 48.1 97.8 -98.5 3.3 -20.9 15.3 35.9 17 15 A A H > S+ 0 0 1 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.917 83.4 47.7 -56.3 -48.4 -21.1 18.5 38.0 18 16 A E H > S+ 0 0 86 1,-0.2 4,-2.3 -3,-0.2 -1,-0.2 0.935 111.2 47.5 -65.6 -47.4 -23.3 17.1 40.8 19 17 A E H > S+ 0 0 118 -4,-0.3 4,-0.5 1,-0.2 -1,-0.2 0.866 115.8 48.4 -61.2 -33.6 -21.5 13.9 41.4 20 18 A T H >< S+ 0 0 1 -4,-1.8 3,-1.4 2,-0.2 4,-0.3 0.943 108.6 51.1 -71.0 -47.6 -18.2 15.9 41.5 21 19 A I H >< S+ 0 0 2 -4,-3.0 3,-2.1 1,-0.3 4,-0.2 0.886 102.7 61.6 -56.9 -39.5 -19.5 18.5 43.9 22 20 A E H >< S+ 0 0 96 -4,-2.3 3,-1.1 1,-0.3 4,-0.3 0.718 89.8 69.1 -63.6 -20.7 -20.7 15.8 46.3 23 21 A R T << S+ 0 0 115 -3,-1.4 -1,-0.3 -4,-0.5 3,-0.2 0.627 96.4 56.7 -67.9 -14.0 -17.1 14.6 46.7 24 22 A F T < S+ 0 0 46 -3,-2.1 -1,-0.2 -4,-0.3 -2,-0.2 0.456 77.1 91.2 -99.1 -3.0 -16.4 17.9 48.5 25 23 A Y S < S+ 0 0 98 -3,-1.1 2,-0.5 -4,-0.2 -1,-0.2 0.888 77.7 66.1 -63.7 -39.7 -19.0 17.6 51.3 26 24 A N S S- 0 0 132 -4,-0.3 2,-0.1 -3,-0.2 -1,-0.0 -0.742 85.0-129.3 -88.2 124.8 -16.7 15.8 53.8 27 25 A R - 0 0 57 -2,-0.5 -2,-0.1 1,-0.1 -1,-0.0 -0.397 16.3-167.1 -70.5 146.6 -13.7 17.8 55.1 28 26 A Q - 0 0 102 -2,-0.1 49,-0.2 -4,-0.1 -1,-0.1 -0.042 65.7 -62.6-129.2 29.8 -10.3 16.2 54.9 29 27 A G S > S+ 0 0 8 47,-0.1 3,-2.3 48,-0.1 4,-0.3 0.214 98.9 113.9 116.7 -11.7 -8.1 18.5 57.1 30 28 A I G > S+ 0 0 13 1,-0.3 3,-1.7 2,-0.2 6,-0.2 0.831 74.8 66.8 -57.5 -29.3 -8.1 21.9 55.4 31 29 A E G 3 S+ 0 0 64 1,-0.3 -1,-0.3 3,-0.0 5,-0.0 0.623 93.5 60.6 -66.7 -14.4 -10.0 23.1 58.5 32 30 A T G < S+ 0 0 89 -3,-2.3 2,-0.4 2,-0.1 -1,-0.3 0.507 81.4 103.8 -89.3 -7.7 -6.8 22.4 60.6 33 31 A I S X S- 0 0 24 -3,-1.7 3,-1.8 -4,-0.3 2,-0.1 -0.635 77.3-119.8 -83.7 128.3 -4.7 24.9 58.6 34 32 A E T 3 S+ 0 0 171 -2,-0.4 34,-0.1 1,-0.2 33,-0.1 -0.430 99.6 23.5 -65.3 130.1 -3.9 28.2 60.3 35 33 A G T 3 S+ 0 0 16 1,-0.3 25,-2.4 -2,-0.1 2,-0.3 0.232 83.8 132.3 97.7 -13.3 -5.3 31.0 58.1 36 34 A F E < +C 59 0A 7 -3,-1.8 -1,-0.3 23,-0.2 23,-0.2 -0.585 21.1 161.3 -71.3 132.5 -7.9 29.0 56.3 37 35 A Q E + 0 0 61 21,-2.7 184,-2.9 1,-0.4 2,-0.3 0.745 50.3 2.9-119.6 -51.6 -11.2 31.0 56.3 38 36 A Q E -CD 58 220A 1 20,-1.6 20,-2.9 182,-0.2 -1,-0.4 -0.985 45.4-161.4-144.5 155.4 -13.8 29.9 53.7 39 37 A M E -CD 57 219A 8 180,-2.5 180,-2.4 -2,-0.3 2,-0.4 -0.999 8.8-176.2-135.7 136.0 -14.4 27.3 51.0 40 38 A F E -CD 56 218A 2 16,-2.5 16,-2.8 -2,-0.4 2,-0.5 -0.995 9.2-163.2-126.2 139.5 -17.0 27.5 48.1 41 39 A V E -CD 55 217A 0 176,-2.6 175,-2.3 -2,-0.4 176,-1.4 -0.990 23.2-176.5-120.2 120.8 -17.7 24.9 45.5 42 40 A T E -CD 54 215A 1 12,-2.5 12,-1.9 -2,-0.5 2,-0.5 -0.850 27.3-146.7-121.5 151.9 -19.6 26.2 42.5 43 41 A K E -CD 53 214A 80 171,-2.6 171,-2.4 -2,-0.3 2,-0.3 -0.979 30.8-126.0-108.9 124.7 -21.2 25.1 39.3 44 42 A T E - D 0 213A 9 8,-2.4 2,-0.6 -2,-0.5 8,-0.3 -0.547 17.3-135.0 -69.8 130.6 -21.0 27.6 36.5 45 43 A L + 0 0 68 167,-3.0 167,-0.4 -2,-0.3 2,-0.3 -0.798 56.4 106.7 -86.6 119.3 -24.4 28.4 34.9 46 44 A N S S- 0 0 79 -2,-0.6 165,-0.0 2,-0.1 167,-0.0 -0.957 74.6-101.8-171.2-176.0 -24.1 28.4 31.1 47 45 A T + 0 0 146 -2,-0.3 4,-0.1 4,-0.0 -2,-0.1 -0.075 66.9 137.0-117.0 33.3 -24.9 26.5 27.9 48 46 A E - 0 0 114 2,-0.2 -2,-0.1 1,-0.1 4,-0.1 -0.251 63.3-119.5 -78.9 166.4 -21.4 25.0 27.3 49 47 A D S S+ 0 0 130 -35,-0.1 -35,-0.5 2,-0.1 2,-0.3 0.648 98.5 47.4 -79.9 -20.3 -20.6 21.4 26.2 50 48 A T S S- 0 0 38 -37,-0.1 -37,-0.2 -36,-0.1 -2,-0.2 -0.931 86.7-119.1-118.6 148.1 -18.6 20.7 29.4 51 49 A D E -A 12 0A 16 -39,-1.5 -39,-2.6 -2,-0.3 2,-0.4 -0.426 23.4-146.8 -74.8 158.2 -19.6 21.4 33.0 52 50 A E E +A 11 0A 48 -8,-0.3 -8,-2.4 -41,-0.2 2,-0.4 -0.969 16.2 179.6-133.3 123.5 -17.5 23.7 35.1 53 51 A V E -AC 10 43A 0 -43,-2.1 -43,-3.4 -2,-0.4 2,-0.4 -0.975 9.3-163.8-121.9 130.7 -16.9 23.3 38.8 54 52 A K E -AC 9 42A 6 -12,-1.9 -12,-2.5 -2,-0.4 2,-0.6 -0.944 10.9-155.1-116.9 140.6 -14.8 25.7 40.8 55 53 A I E -AC 8 41A 19 -47,-2.6 -47,-2.1 -2,-0.4 2,-0.5 -0.953 17.0-170.7-113.6 109.7 -13.3 25.3 44.2 56 54 A L E -AC 7 40A 9 -16,-2.8 -16,-2.5 -2,-0.6 2,-0.4 -0.882 2.0-170.5-103.2 129.3 -12.6 28.7 45.8 57 55 A T E -AC 6 39A 8 -51,-2.8 -51,-2.2 -2,-0.5 2,-0.4 -0.985 8.7-152.3-122.3 137.7 -10.7 29.0 49.1 58 56 A I E -AC 5 38A 2 -20,-2.9 -21,-2.7 -2,-0.4 -20,-1.6 -0.919 20.0-179.5-113.2 131.6 -10.3 32.1 51.1 59 57 A W E -AC 4 36A 0 -55,-2.8 -55,-2.2 -2,-0.4 -23,-0.2 -0.897 42.2-121.8-133.2 156.2 -7.2 32.7 53.3 60 58 A E S S- 0 0 116 -25,-2.4 2,-0.3 -2,-0.3 -24,-0.1 0.799 98.3 -10.6 -61.7 -31.1 -5.7 35.2 55.7 61 59 A S > - 0 0 33 -26,-0.2 4,-1.4 -57,-0.1 3,-0.3 -0.980 67.5-106.3-161.8 160.1 -2.6 35.3 53.4 62 60 A E H > S+ 0 0 67 -2,-0.3 4,-2.5 -60,-0.3 5,-0.2 0.877 118.6 61.7 -60.6 -36.6 -1.0 33.7 50.4 63 61 A D H > S+ 0 0 104 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.880 100.1 54.3 -56.7 -38.9 1.5 32.2 52.8 64 62 A S H > S+ 0 0 8 -3,-0.3 4,-1.8 1,-0.2 -1,-0.2 0.922 109.3 47.0 -61.9 -47.8 -1.3 30.3 54.6 65 63 A F H X S+ 0 0 10 -4,-1.4 4,-2.6 1,-0.2 -1,-0.2 0.902 110.3 52.7 -59.1 -45.6 -2.4 28.8 51.3 66 64 A N H X S+ 0 0 54 -4,-2.5 4,-1.6 1,-0.2 -2,-0.2 0.887 105.6 54.3 -60.9 -40.3 1.1 27.8 50.4 67 65 A N H < S+ 0 0 87 -4,-2.4 4,-0.3 2,-0.2 -1,-0.2 0.905 109.4 48.7 -55.9 -43.3 1.5 26.1 53.8 68 66 A W H >< S+ 0 0 29 -4,-1.8 3,-1.7 1,-0.2 6,-0.5 0.928 107.0 54.8 -62.2 -46.5 -1.6 24.0 53.0 69 67 A L H 3< S+ 0 0 70 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.833 112.0 44.7 -55.6 -33.3 -0.3 23.2 49.5 70 68 A N T 3< S+ 0 0 139 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.464 98.5 109.2 -86.7 -2.1 2.9 21.8 51.2 71 69 A S S <> S- 0 0 23 -3,-1.7 4,-1.5 -4,-0.3 5,-0.1 -0.305 75.6-126.3 -86.7 158.3 1.0 19.9 53.8 72 70 A D H > S+ 0 0 118 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.873 111.0 58.7 -60.3 -38.7 0.2 16.3 54.5 73 71 A V H > S+ 0 0 24 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.868 101.8 53.0 -67.2 -33.5 -3.5 17.1 54.6 74 72 A F H > S+ 0 0 59 -6,-0.5 4,-1.5 2,-0.2 -1,-0.2 0.953 112.0 45.8 -60.1 -48.0 -3.4 18.4 51.1 75 73 A K H < S+ 0 0 121 -4,-1.5 4,-0.4 1,-0.2 -2,-0.2 0.911 112.9 50.6 -62.3 -43.4 -1.8 15.2 49.9 76 74 A E H >< S+ 0 0 92 -4,-2.7 3,-1.2 1,-0.2 4,-0.3 0.922 108.5 51.3 -57.2 -48.9 -4.3 13.1 51.9 77 75 A A H 3< S+ 0 0 22 -4,-2.5 3,-0.2 1,-0.3 -1,-0.2 0.812 116.7 40.5 -60.6 -32.0 -7.3 14.9 50.5 78 76 A H T >< S+ 0 0 68 -4,-1.5 3,-1.3 -5,-0.2 -1,-0.3 0.337 81.4 111.3-101.5 6.9 -6.1 14.3 47.0 79 77 A K T < S+ 0 0 135 -3,-1.2 -1,-0.2 -4,-0.4 -2,-0.1 0.834 88.4 29.0 -49.7 -48.4 -4.8 10.7 47.4 80 78 A N T 3 S+ 0 0 122 -4,-0.3 2,-0.3 -3,-0.2 -1,-0.3 0.290 91.6 119.6-103.2 8.1 -7.5 9.1 45.2 81 79 A V < + 0 0 54 -3,-1.3 2,-0.3 11,-0.0 -3,-0.0 -0.577 38.0 178.8 -78.1 133.9 -8.2 11.9 42.8 82 80 A R - 0 0 81 -2,-0.3 12,-0.3 7,-0.1 2,-0.3 -0.971 23.7-135.3-132.9 149.0 -7.5 11.3 39.1 83 81 A L > - 0 0 40 -2,-0.3 3,-1.9 10,-0.1 12,-0.2 -0.731 30.4-117.0 -90.5 152.3 -7.8 13.2 35.9 84 82 A K T 3 S+ 0 0 94 10,-3.2 5,-0.2 -2,-0.3 11,-0.2 0.761 118.2 60.0 -55.3 -27.1 -9.3 11.5 32.8 85 83 A S T 3 S+ 0 0 89 9,-0.4 -1,-0.3 10,-0.3 2,-0.1 0.566 84.9 101.0 -79.6 -11.8 -5.9 12.1 31.3 86 84 A D S X S- 0 0 62 -3,-1.9 3,-2.1 1,-0.1 6,-0.1 -0.451 86.0-115.5 -75.6 151.2 -4.1 10.0 34.0 87 85 A D T 3 S+ 0 0 158 1,-0.3 3,-0.2 -2,-0.1 -1,-0.1 0.806 119.6 33.1 -53.1 -34.9 -3.1 6.4 33.1 88 86 A D T 3 S+ 0 0 91 1,-0.1 3,-0.4 -5,-0.1 -1,-0.3 0.048 91.8 102.9-109.5 23.1 -5.6 5.1 35.8 89 87 A G X + 0 0 2 -3,-2.1 3,-1.5 -5,-0.2 -1,-0.1 0.095 34.7 122.4 -96.7 24.0 -8.2 7.9 35.2 90 88 A Q T 3 S+ 0 0 115 1,-0.3 -1,-0.2 -3,-0.2 -6,-0.1 0.836 78.3 43.7 -55.9 -39.5 -10.7 5.9 33.2 91 89 A Q T 3 S+ 0 0 181 -3,-0.4 -1,-0.3 -8,-0.1 -2,-0.1 0.514 91.2 107.5 -84.9 -5.9 -13.6 6.5 35.6 92 90 A S < - 0 0 11 -3,-1.5 -9,-0.1 -9,-0.2 -3,-0.0 -0.593 49.8-166.1 -81.7 129.1 -12.8 10.2 36.2 93 91 A P + 0 0 9 0, 0.0 -80,-2.2 0, 0.0 2,-0.9 0.412 62.0 107.3 -84.4 1.8 -15.1 12.9 34.6 94 92 A I E +B 12 0A 8 -12,-0.3 -10,-3.2 -82,-0.2 -9,-0.4 -0.726 43.8 178.9 -87.7 108.8 -12.4 15.5 35.3 95 93 A L E - 0 0 64 -84,-2.5 2,-0.3 -2,-0.9 -10,-0.3 0.864 63.8 -26.8 -75.4 -40.8 -10.9 16.5 32.0 96 94 A S E -B 11 0A 47 -85,-1.2 -85,-2.5 -12,-0.1 2,-0.3 -0.970 52.9-144.3-164.2 163.9 -8.5 19.1 33.4 97 95 A N E -B 10 0A 72 -2,-0.3 2,-0.4 -87,-0.2 -87,-0.2 -0.968 9.4-167.9-133.6 154.9 -7.9 21.5 36.2 98 96 A K E -B 9 0A 130 -89,-1.6 -89,-2.8 -2,-0.3 2,-0.4 -0.986 15.0-137.7-143.3 137.0 -6.3 24.9 36.3 99 97 A V E -B 8 0A 74 -2,-0.4 2,-0.3 -91,-0.2 -91,-0.2 -0.776 18.1-175.3 -97.2 134.0 -5.3 27.0 39.3 100 98 A F E -B 7 0A 44 -93,-2.5 -93,-2.9 -2,-0.4 2,-0.3 -0.951 7.6-157.1-124.4 146.3 -5.9 30.7 39.6 101 99 A K E -B 6 0A 80 55,-0.5 55,-3.0 -2,-0.3 2,-0.4 -0.958 9.2-173.6-130.4 146.8 -4.7 33.0 42.4 102 100 A Y E -BE 5 155A 1 -97,-2.5 -97,-2.7 -2,-0.3 2,-0.4 -0.997 24.7-134.8-143.8 137.8 -6.0 36.4 43.6 103 101 A D E -BE 4 154A 50 51,-2.4 51,-2.6 -2,-0.4 2,-0.8 -0.788 30.3-133.7 -84.5 131.8 -5.2 39.1 46.0 104 102 A I E + E 0 153A 4 -101,-2.6 -101,-0.4 -2,-0.4 49,-0.2 -0.809 26.4 177.8 -90.3 112.7 -8.4 40.2 47.9 105 103 A G E + 0 0 12 47,-2.5 2,-0.3 -2,-0.8 48,-0.2 0.682 67.1 9.3 -85.4 -20.8 -8.6 44.0 47.9 106 104 A Y E - E 0 152A 43 46,-1.3 46,-2.5 2,-0.0 2,-0.3 -0.963 58.2-177.1-160.9 143.2 -11.9 44.2 49.8 107 105 A H E - E 0 151A 51 -2,-0.3 2,-0.4 44,-0.2 44,-0.2 -0.994 0.7-176.7-144.8 136.6 -14.3 42.0 51.6 108 106 A Y E - E 0 150A 68 42,-2.3 42,-2.3 -2,-0.3 2,-0.4 -1.000 4.9-172.9-129.8 131.7 -17.7 42.8 53.2 109 107 A Q E E 0 149A 80 -2,-0.4 40,-0.2 40,-0.2 39,-0.1 -0.983 360.0 360.0-128.8 126.2 -19.8 40.2 55.2 110 108 A K 0 0 128 38,-2.8 -2,-0.0 -2,-0.4 38,-0.0 -0.388 360.0 360.0 -68.8 360.0 -23.3 40.8 56.4 111 !* 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 0.0 112 -1 B A 0 0 152 0, 0.0 2,-0.3 0, 0.0 60,-0.0 0.000 360.0 360.0 360.0 124.2 -32.4 25.8 46.8 113 0 B H - 0 0 82 1,-0.1 60,-0.3 104,-0.0 103,-0.1 -0.782 360.0 -94.6-118.1 156.9 -28.8 26.8 47.0 114 1 B M - 0 0 46 101,-0.4 101,-2.6 -2,-0.3 2,-0.3 -0.243 45.6-141.2 -56.8 161.4 -26.7 29.9 47.7 115 2 B F E -FG 170 214A 4 55,-2.5 55,-2.8 99,-0.2 2,-0.4 -0.969 12.6-157.2-137.7 142.4 -25.8 31.9 44.6 116 3 B M E -FG 169 213A 3 97,-2.6 97,-2.5 -2,-0.3 2,-0.4 -0.984 4.3-169.2-124.5 132.2 -22.7 33.8 43.3 117 4 B A E -FG 168 212A 2 51,-2.2 51,-2.8 -2,-0.4 2,-0.4 -0.949 8.2-163.6-113.6 143.8 -22.6 36.5 40.7 118 5 B E E -FG 167 211A 6 93,-2.9 93,-2.5 -2,-0.4 2,-0.5 -0.987 11.8-163.9-125.4 129.2 -19.3 37.8 39.3 119 6 B N E -FG 166 210A 41 47,-2.3 47,-2.7 -2,-0.4 2,-0.7 -0.984 17.0-156.6-105.9 122.5 -18.6 40.9 37.4 120 7 B R E -FG 165 209A 51 89,-2.7 89,-1.4 -2,-0.5 2,-0.6 -0.892 3.8-156.4-104.7 114.5 -15.2 40.6 35.7 121 8 B L E -FG 164 208A 8 43,-3.5 43,-1.9 -2,-0.7 2,-0.6 -0.819 5.1-154.8 -95.2 119.4 -13.5 43.8 34.9 122 9 B Q E -FG 163 207A 83 85,-2.5 84,-2.7 -2,-0.6 85,-1.2 -0.850 28.5-175.6 -88.7 117.6 -10.9 43.9 32.1 123 10 B L E -FG 162 205A 0 39,-2.8 39,-1.9 -2,-0.6 82,-0.2 -0.834 30.6-100.1-120.1 152.7 -8.7 46.9 32.9 124 11 B Q E > -F 161 0A 80 80,-2.2 3,-1.8 -2,-0.3 37,-0.2 -0.419 61.5 -81.1 -66.6 147.0 -5.7 48.7 31.4 125 12 B K T 3 S+ 0 0 110 35,-0.6 -1,-0.1 1,-0.3 35,-0.1 -0.197 115.4 19.2 -50.8 131.8 -2.4 47.6 32.9 126 13 B G T 3 S+ 0 0 66 -3,-0.1 4,-0.3 1,-0.0 -1,-0.3 0.452 97.5 96.2 89.4 1.9 -1.7 49.4 36.2 127 14 B S <> + 0 0 3 -3,-1.8 4,-1.7 1,-0.1 5,-0.2 0.381 48.8 98.1-107.9 5.0 -5.2 50.5 37.0 128 15 B A H > S+ 0 0 1 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.930 84.0 48.8 -58.7 -49.4 -6.3 47.6 39.4 129 16 B E H > S+ 0 0 87 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.930 112.1 45.9 -61.2 -48.6 -5.6 49.5 42.6 130 17 B E H > S+ 0 0 119 -4,-0.3 4,-0.6 1,-0.2 -1,-0.2 0.839 115.8 49.0 -63.9 -30.5 -7.4 52.8 41.7 131 18 B T H >< S+ 0 0 1 -4,-1.7 3,-1.2 2,-0.2 4,-0.3 0.942 109.0 51.0 -73.9 -46.5 -10.3 50.6 40.4 132 19 B I H >< S+ 0 0 2 -4,-3.1 3,-2.1 1,-0.3 4,-0.3 0.886 103.1 60.5 -58.1 -39.6 -10.5 48.5 43.6 133 20 B E H >< S+ 0 0 94 -4,-2.2 3,-1.1 1,-0.3 4,-0.4 0.756 91.8 67.4 -63.4 -22.5 -10.6 51.6 45.8 134 21 B R T << S+ 0 0 117 -3,-1.2 -1,-0.3 -4,-0.6 3,-0.3 0.657 97.4 56.0 -66.7 -16.7 -13.8 52.7 44.1 135 22 B F T < S+ 0 0 45 -3,-2.1 -1,-0.2 -4,-0.3 -2,-0.2 0.467 80.5 86.2 -97.4 -3.9 -15.5 49.7 45.8 136 23 B Y S < S+ 0 0 96 -3,-1.1 2,-0.6 -4,-0.3 -1,-0.2 0.881 77.0 75.0 -61.8 -38.3 -14.6 50.6 49.3 137 24 B N S S- 0 0 113 -4,-0.4 2,-0.1 -3,-0.3 -1,-0.1 -0.694 81.9-135.8 -83.8 113.1 -17.7 52.8 49.7 138 25 B R - 0 0 48 -2,-0.6 -2,-0.1 1,-0.1 -1,-0.0 -0.414 18.0-173.0 -65.8 140.3 -21.0 50.8 50.1 139 26 B Q - 0 0 85 -2,-0.1 49,-0.2 46,-0.0 -1,-0.1 -0.007 62.8 -70.7-128.4 25.4 -23.9 52.2 48.0 140 27 B G S > S+ 0 0 10 47,-0.1 3,-2.1 48,-0.1 4,-0.3 0.286 94.8 118.4 111.3 -8.3 -26.8 50.1 49.2 141 28 B I G > S+ 0 0 11 1,-0.3 3,-1.9 2,-0.2 6,-0.2 0.882 76.1 63.4 -54.8 -33.8 -26.2 46.5 48.0 142 29 B E G 3 S+ 0 0 49 1,-0.3 -1,-0.3 4,-0.1 4,-0.1 0.624 92.4 64.8 -68.3 -12.0 -26.0 45.4 51.6 143 30 B T G < S+ 0 0 94 -3,-2.1 2,-0.5 2,-0.1 -1,-0.3 0.477 77.3 103.7 -88.8 -4.9 -29.7 46.5 52.1 144 31 B I S X S- 0 0 25 -3,-1.9 3,-2.4 -4,-0.3 35,-0.0 -0.689 82.0-113.2 -83.6 125.8 -31.0 43.9 49.7 145 32 B E T 3 S+ 0 0 157 -2,-0.5 34,-0.1 1,-0.3 33,-0.1 -0.329 103.8 26.1 -53.4 128.8 -32.7 41.0 51.4 146 33 B G T 3 S+ 0 0 7 1,-0.4 25,-2.2 -4,-0.1 -1,-0.3 0.194 83.7 132.7 100.3 -18.2 -30.6 37.9 50.7 147 34 B F E < + H 0 170A 5 -3,-2.4 -1,-0.4 23,-0.2 23,-0.2 -0.511 21.2 162.7 -64.3 134.1 -27.2 39.7 50.2 148 35 B Q E - 0 0 55 21,-2.9 -38,-2.8 1,-0.4 2,-0.3 0.743 50.1 -1.0-118.6 -50.5 -24.5 37.9 52.1 149 36 B Q E -EH 109 169A 3 20,-1.5 20,-2.9 -40,-0.2 2,-0.4 -0.990 45.0-158.5-147.8 152.7 -20.9 38.8 51.1 150 37 B M E -EH 108 168A 5 -42,-2.3 -42,-2.3 -2,-0.3 2,-0.4 -0.997 10.4-176.2-130.5 137.7 -18.9 40.8 48.6 151 38 B F E -EH 107 167A 2 16,-2.5 16,-2.7 -2,-0.4 2,-0.5 -0.990 9.6-162.4-127.4 144.2 -15.2 40.2 47.5 152 39 B V E -EH 106 166A 0 -46,-2.5 -47,-2.5 -2,-0.4 -46,-1.3 -0.994 22.0-175.9-125.0 120.7 -13.1 42.4 45.2 153 40 B T E -EH 104 165A 0 12,-2.5 12,-1.9 -2,-0.5 2,-0.5 -0.864 25.9-146.2-121.4 150.6 -10.1 40.6 43.8 154 41 B K E -EH 103 164A 79 -51,-2.6 -51,-2.4 -2,-0.3 10,-0.2 -0.976 30.9-125.1-108.8 124.4 -7.0 41.3 41.7 155 42 B T E -E 102 0A 9 8,-2.6 2,-0.9 -2,-0.5 8,-0.3 -0.495 15.0-138.3 -68.6 132.8 -5.9 38.4 39.5 156 43 B L + 0 0 72 -55,-3.0 -55,-0.5 -2,-0.2 2,-0.2 -0.833 55.6 112.5 -92.5 105.0 -2.3 37.4 40.0 157 44 B N S S- 0 0 78 -2,-0.9 6,-0.0 2,-0.1 -57,-0.0 -0.831 72.9-108.0-153.1-171.0 -0.9 36.7 36.6 158 45 B T + 0 0 134 -2,-0.2 2,-0.1 2,-0.0 -2,-0.1 -0.041 67.3 132.9-117.3 30.1 1.6 38.0 34.0 159 46 B E - 0 0 113 2,-0.2 -2,-0.1 1,-0.1 4,-0.1 -0.332 64.8-120.1 -84.7 163.2 -1.0 39.3 31.4 160 47 B D S S+ 0 0 134 -2,-0.1 -35,-0.6 -35,-0.1 2,-0.3 0.328 96.1 55.7 -90.8 7.1 -0.9 42.7 29.7 161 48 B T E S-F 124 0A 40 -37,-0.2 -37,-0.2 -36,-0.1 2,-0.2 -0.958 86.0-120.3-125.7 152.7 -4.3 43.9 31.1 162 49 B D E -F 123 0A 8 -39,-1.9 -39,-2.8 -2,-0.3 2,-0.4 -0.560 23.4-150.3 -82.9 155.4 -5.2 44.0 34.8 163 50 B E E +F 122 0A 46 -8,-0.3 -8,-2.6 -41,-0.2 2,-0.4 -0.978 14.8 179.8-133.9 121.6 -8.2 41.9 36.0 164 51 B V E -FH 121 154A 0 -43,-1.9 -43,-3.5 -2,-0.4 2,-0.4 -0.977 10.3-160.9-118.4 131.6 -10.5 42.8 38.9 165 52 B K E -FH 120 153A 4 -12,-1.9 -12,-2.5 -2,-0.4 2,-0.6 -0.940 8.2-155.7-115.8 136.4 -13.4 40.6 39.8 166 53 B I E -FH 119 152A 18 -47,-2.7 -47,-2.3 -2,-0.4 2,-0.5 -0.949 16.7-170.1-110.6 110.1 -16.4 41.6 41.9 167 54 B L E -FH 118 151A 5 -16,-2.7 -16,-2.5 -2,-0.6 2,-0.4 -0.881 3.3-171.5-106.4 126.8 -17.9 38.5 43.6 168 55 B T E -FH 117 150A 7 -51,-2.8 -51,-2.2 -2,-0.5 2,-0.4 -0.976 8.5-153.5-121.4 135.3 -21.3 38.8 45.3 169 56 B I E +FH 116 149A 0 -20,-2.9 -21,-2.9 -2,-0.4 -20,-1.5 -0.920 19.3 176.4-112.4 132.9 -22.7 36.0 47.5 170 57 B W E -FH 115 147A 0 -55,-2.8 -55,-2.5 -2,-0.4 -23,-0.2 -0.906 42.6-123.8-135.9 156.4 -26.5 35.6 47.9 171 58 B E S S+ 0 0 97 -25,-2.2 2,-0.3 -2,-0.3 -24,-0.1 0.718 98.5 2.5 -71.3 -20.7 -29.1 33.4 49.5 172 59 B S > - 0 0 28 -26,-0.2 4,-1.4 -57,-0.1 3,-0.2 -0.985 66.7-117.1-159.9 152.9 -30.7 33.0 46.1 173 60 B E H > S+ 0 0 76 -2,-0.3 4,-2.5 -60,-0.3 5,-0.2 0.860 115.0 63.4 -61.5 -34.0 -30.4 34.0 42.5 174 61 B D H > S+ 0 0 115 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.909 99.6 51.7 -55.2 -43.5 -33.8 35.8 43.0 175 62 B S H > S+ 0 0 3 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.911 109.0 50.2 -66.0 -39.0 -32.2 38.1 45.5 176 63 B F H X S+ 0 0 9 -4,-1.4 4,-2.8 2,-0.2 -1,-0.2 0.941 110.8 49.0 -59.4 -48.1 -29.3 39.0 43.1 177 64 B N H X S+ 0 0 51 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.893 107.4 56.5 -59.6 -37.4 -31.9 39.7 40.4 178 65 B N H < S+ 0 0 96 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.916 108.4 46.9 -59.6 -43.3 -33.8 41.9 42.9 179 66 B W H >< S+ 0 0 31 -4,-2.1 3,-2.0 1,-0.2 6,-0.4 0.934 107.8 55.5 -63.8 -46.8 -30.6 43.9 43.4 180 67 B L H 3< S+ 0 0 60 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.874 111.8 44.9 -50.6 -36.7 -30.0 44.2 39.7 181 68 B N T 3< S+ 0 0 135 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.346 97.8 108.3 -88.4 3.6 -33.5 45.7 39.4 182 69 B S S <> S- 0 0 24 -3,-2.0 4,-1.5 -4,-0.2 5,-0.1 -0.392 76.1-124.2 -89.2 160.5 -33.1 48.1 42.3 183 70 B D H > S+ 0 0 142 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.861 112.0 57.7 -65.2 -36.6 -32.7 51.8 42.7 184 71 B V H > S+ 0 0 40 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.876 102.7 52.6 -65.9 -35.4 -29.5 51.3 44.7 185 72 B F H > S+ 0 0 59 -6,-0.4 4,-1.5 2,-0.2 -1,-0.2 0.945 112.7 45.8 -59.7 -45.3 -27.9 49.3 41.8 186 73 B K H X S+ 0 0 160 -4,-1.5 4,-0.7 1,-0.2 -2,-0.2 0.906 113.7 48.1 -65.8 -43.2 -28.7 52.2 39.4 187 74 B E H >< S+ 0 0 99 -4,-2.6 3,-0.9 1,-0.2 4,-0.3 0.922 109.8 52.5 -63.4 -43.8 -27.4 54.8 41.9 188 75 B A H 3< S+ 0 0 20 -4,-2.6 3,-0.3 -49,-0.2 -1,-0.2 0.838 118.0 37.3 -59.6 -35.5 -24.2 52.9 42.5 189 76 B H H >< S+ 0 0 69 -4,-1.5 3,-1.7 -5,-0.2 -1,-0.2 0.406 82.8 105.8 -97.9 -0.0 -23.5 52.7 38.8 190 77 B K T << S+ 0 0 106 -3,-0.9 -1,-0.2 -4,-0.7 -2,-0.1 0.791 89.1 36.3 -59.0 -31.8 -24.7 56.1 37.6 191 78 B N T 3 S+ 0 0 120 -4,-0.3 2,-0.3 -3,-0.3 -1,-0.3 0.376 90.1 117.1-101.5 4.6 -21.2 57.6 37.0 192 79 B V < + 0 0 54 -3,-1.7 2,-0.3 11,-0.0 -3,-0.0 -0.549 39.4 176.7 -77.8 130.8 -19.5 54.4 35.8 193 80 B R - 0 0 77 -2,-0.3 12,-0.4 7,-0.1 2,-0.3 -0.969 26.3-133.8-132.1 149.4 -18.2 54.4 32.2 194 81 B L > - 0 0 43 -2,-0.3 3,-2.3 1,-0.1 12,-0.2 -0.733 34.3-112.7 -89.6 152.8 -16.2 52.1 29.9 195 82 B K T 3 S+ 0 0 66 10,-2.8 5,-0.3 -2,-0.3 11,-0.1 0.834 118.0 60.3 -50.9 -35.8 -13.3 53.6 28.0 196 83 B S T 3 S+ 0 0 94 9,-0.3 -1,-0.3 10,-0.3 2,-0.1 0.542 82.6 104.4 -73.9 -9.0 -15.3 53.0 24.8 197 84 B D S X S- 0 0 60 -3,-2.3 3,-2.0 3,-0.1 4,-0.2 -0.432 85.8-114.6 -70.8 151.5 -18.2 55.3 26.0 198 85 B D T 3 S+ 0 0 167 1,-0.3 3,-0.2 2,-0.1 -1,-0.1 0.826 119.5 31.4 -52.9 -37.1 -18.4 58.8 24.4 199 86 B D T 3 S+ 0 0 87 1,-0.1 -1,-0.3 -5,-0.1 3,-0.1 -0.109 103.4 83.4-112.0 30.7 -17.6 60.3 27.8 200 87 B G X + 0 0 4 -3,-2.0 3,-1.9 -5,-0.3 -2,-0.1 0.255 43.6 123.3-120.6 11.4 -15.3 57.5 29.1 201 88 B Q T 3 S+ 0 0 111 1,-0.3 -1,-0.1 -3,-0.2 -6,-0.1 0.794 80.8 43.4 -42.9 -44.6 -11.9 58.3 27.5 202 89 B Q T 3 S+ 0 0 171 -3,-0.1 -1,-0.3 -8,-0.1 -7,-0.1 0.592 87.8 110.1 -84.2 -12.8 -10.1 58.4 30.9 203 90 B S < - 0 0 17 -3,-1.9 -3,-0.1 -9,-0.2 -9,-0.0 -0.422 57.8-154.5 -61.1 132.3 -11.8 55.3 32.3 204 91 B P + 0 0 10 0, 0.0 -80,-2.2 0, 0.0 2,-0.8 0.485 64.3 107.7 -86.0 0.9 -9.4 52.4 32.6 205 92 B I E + G 0 123A 8 -12,-0.4 -10,-2.8 -82,-0.2 -9,-0.3 -0.682 42.4 177.4 -84.9 110.6 -12.3 49.9 32.4 206 93 B L E - 0 0 56 -84,-2.7 2,-0.3 -2,-0.8 -10,-0.3 0.877 61.2 -28.5 -79.8 -43.4 -12.1 48.2 28.9 207 94 B S E - G 0 122A 46 -85,-1.2 -85,-2.5 -12,-0.1 2,-0.3 -0.973 52.4-141.0-163.3 165.0 -15.0 45.8 29.3 208 95 B N E - G 0 121A 74 -2,-0.3 2,-0.3 -87,-0.2 -87,-0.2 -0.979 8.7-168.2-134.3 155.1 -17.0 43.7 31.7 209 96 B K E - G 0 120A 113 -89,-1.4 -89,-2.7 -2,-0.3 2,-0.4 -0.989 14.8-140.5-143.3 132.1 -18.4 40.2 31.7 210 97 B V E - G 0 119A 61 -2,-0.3 2,-0.3 -91,-0.2 -91,-0.2 -0.771 16.3-172.5 -97.4 135.5 -20.9 38.7 34.1 211 98 B F E - G 0 118A 47 -93,-2.5 -93,-2.9 -2,-0.4 2,-0.4 -0.936 6.8-154.9-125.4 148.5 -20.8 35.1 35.3 212 99 B K E - G 0 117A 75 -167,-0.4 -167,-3.0 -2,-0.3 2,-0.4 -0.975 10.8-174.5-130.6 141.2 -23.3 33.2 37.4 213 100 B Y E -DG 44 116A 3 -97,-2.5 -97,-2.6 -2,-0.4 2,-0.5 -0.994 24.3-138.1-141.4 135.0 -22.8 30.3 39.7 214 101 B D E -DG 43 115A 46 -171,-2.4 -171,-2.6 -2,-0.4 2,-0.8 -0.812 29.1-134.9 -83.3 128.6 -24.9 27.9 41.8 215 102 B I E +D 42 0A 6 -101,-2.6 -101,-0.4 -2,-0.5 -173,-0.2 -0.791 26.3 177.4 -85.3 110.3 -23.1 27.3 45.1 216 103 B G E + 0 0 13 -175,-2.3 2,-0.3 -2,-0.8 -174,-0.2 0.662 68.3 12.2 -85.9 -18.3 -23.2 23.6 45.8 217 104 B Y E -D 41 0A 40 -176,-1.4 -176,-2.6 2,-0.0 2,-0.3 -0.955 61.0-179.0-159.1 137.9 -21.1 23.7 49.0 218 105 B H E +D 40 0A 50 -2,-0.3 2,-0.3 -178,-0.2 -178,-0.2 -0.997 1.1 178.5-139.9 141.9 -19.9 26.4 51.4 219 106 B Y E -D 39 0A 73 -180,-2.4 -180,-2.5 -2,-0.3 2,-0.4 -0.999 6.0-171.0-140.2 135.7 -17.9 26.3 54.6 220 107 B Q E D 38 0A 85 -2,-0.3 -182,-0.2 -182,-0.2 -183,-0.1 -0.996 360.0 360.0-128.0 125.7 -16.7 29.1 56.9 221 108 B K 0 0 125 -184,-2.9 -2,-0.0 -2,-0.4 -190,-0.0 -0.427 360.0 360.0 -80.5 360.0 -14.2 28.3 59.7