==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 10-DEC-04 2BFO . COMPND 2 MOLECULE: PTERIDINE REDUCTASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: LEISHMANIA MAJOR; . AUTHOR A.W.SCHUETTELKOPF,W.N.HUNTER . 1044 14 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 37971.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 759 72.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 136 13.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 8 0.8 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 0.1 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 . 67 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 110 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 379 36.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 1.5 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 0 0 2 0 3 5 0 6 5 5 0 0 0 0 4 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 4 12 4 4 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 . 4 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 4 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 6 A V 0 0 124 0, 0.0 25,-0.1 0, 0.0 24,-0.1 0.000 360.0 360.0 360.0 115.9 8.7 31.0 34.6 2 7 A P - 0 0 47 0, 0.0 25,-3.1 0, 0.0 2,-0.4 -0.275 360.0-138.2 -67.0 145.7 9.6 31.5 38.3 3 8 A V E -a 27 0A 0 23,-0.2 92,-2.3 25,-0.1 91,-1.4 -0.806 14.9-167.7-103.7 143.2 8.5 28.8 40.8 4 9 A A E -ab 28 95A 0 23,-2.7 25,-2.7 -2,-0.4 2,-0.6 -0.992 9.0-154.9-130.6 130.3 7.1 29.4 44.3 5 10 A L E -ab 29 96A 0 90,-3.0 92,-2.4 -2,-0.4 2,-0.5 -0.911 14.4-173.5 -98.5 123.7 6.6 26.7 47.0 6 11 A V E > -ab 30 97A 0 23,-2.8 25,-2.4 -2,-0.6 3,-0.7 -0.929 12.4-148.3-120.2 110.6 3.8 27.6 49.5 7 12 A T T 3 S+ 0 0 2 90,-2.0 92,-0.3 -2,-0.5 25,-0.1 -0.481 84.7 16.1 -73.9 148.7 3.3 25.4 52.6 8 13 A G T 3 S+ 0 0 22 91,-0.2 3,-0.4 -2,-0.1 6,-0.3 0.912 81.5 152.0 54.8 44.8 -0.2 25.1 53.9 9 14 A A < + 0 0 0 22,-2.3 9,-0.2 -3,-0.7 23,-0.2 0.627 38.2 93.9 -81.2 -12.8 -1.5 26.4 50.5 10 15 A A S S- 0 0 6 21,-0.6 2,-0.3 4,-0.1 -1,-0.2 0.806 92.9 -9.3 -55.0 -40.9 -4.9 24.6 50.6 11 16 A K S >> S+ 0 0 94 -3,-0.4 4,-1.5 4,-0.0 3,-0.9 -0.857 102.1 12.3-147.4-178.5 -6.9 27.4 52.1 12 17 A R H 3> S- 0 0 116 -2,-0.3 4,-2.0 1,-0.2 5,-0.2 -0.132 122.6 -4.0 52.6-132.3 -7.3 30.8 53.8 13 18 A L H 3> S+ 0 0 23 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.864 135.9 55.0 -61.8 -41.2 -4.0 32.9 53.8 14 19 A G H <> S+ 0 0 1 -3,-0.9 4,-2.0 -6,-0.3 -2,-0.2 0.906 109.8 46.0 -59.6 -43.4 -2.0 30.2 52.2 15 20 A R H X S+ 0 0 120 -4,-1.5 4,-2.8 2,-0.2 -2,-0.2 0.919 111.7 51.4 -62.2 -45.1 -4.4 29.9 49.2 16 21 A S H X S+ 0 0 13 -4,-2.0 4,-2.3 1,-0.2 -1,-0.2 0.844 109.8 50.9 -62.6 -35.9 -4.5 33.7 48.8 17 22 A I H X S+ 0 0 0 -4,-2.0 4,-2.7 2,-0.2 5,-0.2 0.918 111.0 47.0 -67.7 -44.0 -0.8 33.7 48.7 18 23 A A H X S+ 0 0 0 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.910 113.0 49.5 -63.8 -42.5 -0.6 31.0 46.1 19 24 A E H X S+ 0 0 56 -4,-2.8 4,-2.4 2,-0.2 -2,-0.2 0.925 111.7 49.2 -62.2 -45.4 -3.3 32.8 44.0 20 25 A G H X S+ 0 0 14 -4,-2.3 4,-0.8 2,-0.2 -2,-0.2 0.927 113.5 44.4 -59.8 -49.6 -1.4 36.1 44.3 21 26 A L H ><>S+ 0 0 0 -4,-2.7 5,-2.4 1,-0.2 3,-0.8 0.909 113.4 52.5 -61.9 -39.9 1.9 34.6 43.3 22 27 A H H ><5S+ 0 0 4 -4,-2.7 3,-1.5 1,-0.2 -2,-0.2 0.882 104.4 55.6 -63.3 -38.7 0.1 32.8 40.5 23 28 A A H 3<5S+ 0 0 74 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.668 104.5 54.6 -68.5 -18.0 -1.5 36.0 39.3 24 29 A E T <<5S- 0 0 114 -3,-0.8 -1,-0.3 -4,-0.8 -2,-0.2 0.373 130.8 -94.2 -93.2 -0.8 2.1 37.5 39.0 25 30 A G T < 5S+ 0 0 25 -3,-1.5 -3,-0.2 1,-0.3 -2,-0.1 0.422 75.4 145.7 105.7 0.9 3.1 34.6 36.7 26 31 A Y < - 0 0 23 -5,-2.4 2,-0.4 -6,-0.2 -1,-0.3 -0.423 49.0-131.2 -70.9 141.3 4.6 32.2 39.2 27 32 A A E -a 3 0A 2 -25,-3.1 -23,-2.7 -2,-0.1 2,-0.5 -0.803 35.9-142.8 -82.4 136.2 4.3 28.4 38.8 28 33 A V E -ac 4 54A 0 25,-3.1 27,-1.6 -2,-0.4 2,-0.8 -0.914 21.5-159.0-120.8 119.5 3.1 27.3 42.3 29 34 A C E -ac 5 55A 0 -25,-2.7 -23,-2.8 -2,-0.5 2,-0.8 -0.784 21.5-156.5 -85.7 106.3 3.8 24.2 44.3 30 35 A L E -ac 6 56A 0 25,-2.8 27,-1.4 -2,-0.8 2,-0.2 -0.780 6.6-161.3 -89.7 109.7 0.9 23.9 46.7 31 36 A H E + c 0 57A 3 -25,-2.4 -22,-2.3 -2,-0.8 -21,-0.6 -0.631 14.4 172.5 -87.5 149.7 1.9 21.9 49.9 32 37 A Y E - c 0 58A 37 25,-2.2 27,-2.1 -2,-0.2 4,-0.1 -0.986 26.4-166.9-151.3 156.9 -0.8 20.5 52.1 33 38 A H S S- 0 0 58 -2,-0.3 -1,-0.1 25,-0.2 3,-0.1 0.768 88.6 -8.1-106.6 -67.3 -1.1 18.2 55.1 34 39 A R S S+ 0 0 202 1,-0.1 2,-1.4 25,-0.1 3,-0.3 0.586 112.6 84.1-110.1 -16.4 -4.8 17.2 55.5 35 40 A S > + 0 0 21 1,-0.2 4,-2.6 2,-0.1 5,-0.2 -0.343 45.5 145.9 -90.3 58.8 -6.7 19.4 53.0 36 41 A A H > S+ 0 0 36 -2,-1.4 4,-2.9 1,-0.2 5,-0.3 0.928 71.6 48.7 -57.2 -47.7 -6.1 17.2 50.0 37 42 A A H > S+ 0 0 73 -3,-0.3 4,-2.0 1,-0.2 -1,-0.2 0.916 114.1 45.8 -63.7 -42.6 -9.5 18.0 48.4 38 43 A E H > S+ 0 0 82 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.898 113.8 50.0 -66.5 -40.8 -9.0 21.8 48.9 39 44 A A H X S+ 0 0 0 -4,-2.6 4,-2.5 2,-0.2 -2,-0.2 0.952 112.5 45.0 -62.1 -51.6 -5.5 21.6 47.5 40 45 A N H X S+ 0 0 78 -4,-2.9 4,-2.4 1,-0.2 -2,-0.2 0.841 110.5 54.8 -64.1 -35.3 -6.4 19.6 44.4 41 46 A A H X S+ 0 0 58 -4,-2.0 4,-2.1 -5,-0.3 -1,-0.2 0.903 110.6 46.6 -63.1 -41.3 -9.4 21.9 43.7 42 47 A L H X S+ 0 0 8 -4,-1.8 4,-2.8 2,-0.2 -2,-0.2 0.929 110.4 51.3 -66.6 -47.3 -7.0 24.9 43.8 43 48 A S H X S+ 0 0 15 -4,-2.5 4,-3.6 1,-0.2 5,-0.3 0.932 109.4 52.4 -52.0 -48.7 -4.4 23.2 41.6 44 49 A A H X S+ 0 0 59 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.921 109.2 48.4 -55.5 -49.8 -7.1 22.5 39.1 45 50 A T H X S+ 0 0 66 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.927 116.2 43.4 -56.8 -48.4 -8.3 26.1 39.1 46 51 A L H X S+ 0 0 0 -4,-2.8 4,-1.8 1,-0.2 -2,-0.2 0.914 114.6 48.0 -66.3 -45.6 -4.7 27.4 38.6 47 52 A N H < S+ 0 0 45 -4,-3.6 -1,-0.2 1,-0.2 -2,-0.2 0.788 109.7 55.5 -62.7 -29.3 -3.8 24.7 35.9 48 53 A A H < S+ 0 0 86 -4,-2.1 -2,-0.2 -5,-0.3 -1,-0.2 0.912 109.3 45.0 -70.5 -42.7 -7.0 25.6 34.2 49 54 A R H < S+ 0 0 157 -4,-1.9 -2,-0.2 1,-0.3 -1,-0.2 0.829 136.8 7.9 -65.0 -34.7 -6.1 29.3 34.0 50 55 A R S >< S- 0 0 77 -4,-1.8 3,-0.9 -5,-0.1 -1,-0.3 -0.876 89.3-115.9-154.4 108.1 -2.5 28.5 32.8 51 56 A P T 3 S+ 0 0 110 0, 0.0 -3,-0.1 0, 0.0 -4,-0.1 -0.165 93.9 4.7 -51.1 138.6 -1.5 24.9 31.9 52 57 A N T 3 S+ 0 0 88 2,-0.1 -5,-0.1 1,-0.1 3,-0.1 0.842 89.8 122.8 53.8 42.3 1.2 23.3 34.1 53 58 A S < + 0 0 2 -3,-0.9 -25,-3.1 -10,-0.2 2,-0.3 0.327 67.3 41.3-109.0 8.8 1.3 26.2 36.5 54 59 A A E +c 28 0A 4 -27,-0.2 2,-0.3 -4,-0.1 -25,-0.2 -0.996 50.6 169.8-158.3 144.8 0.5 24.2 39.7 55 60 A I E -c 29 0A 27 -27,-1.6 -25,-2.8 -2,-0.3 2,-0.4 -0.913 22.2-134.0-143.8 167.4 1.2 21.0 41.5 56 61 A T E -c 30 0A 41 -2,-0.3 2,-0.4 -27,-0.2 -25,-0.2 -0.999 14.9-175.7-132.5 139.8 0.4 19.6 45.0 57 62 A V E -c 31 0A 37 -27,-1.4 -25,-2.2 -2,-0.4 2,-0.3 -0.993 17.1-140.7-132.4 136.3 2.6 17.7 47.5 58 63 A Q E +c 32 0A 91 -2,-0.4 2,-0.2 -27,-0.2 -25,-0.2 -0.743 30.9 154.0 -98.1 140.8 1.5 16.3 50.9 59 64 A A - 0 0 5 -27,-2.1 2,-0.6 -2,-0.3 -25,-0.1 -0.808 40.7-137.2-170.7 130.9 3.6 16.4 54.0 60 65 A D - 0 0 37 -2,-0.2 4,-0.2 1,-0.1 18,-0.1 -0.798 19.2-170.0 -81.6 121.3 3.3 16.4 57.8 61 66 A L + 0 0 8 -2,-0.6 70,-0.3 2,-0.1 -1,-0.1 0.344 43.6 124.2 -97.1 5.6 5.7 19.1 58.9 62 67 A S S S- 0 0 6 64,-0.2 2,-2.7 1,-0.1 61,-0.3 -0.352 81.0-104.1 -60.6 146.5 5.4 18.2 62.6 63 68 A N S S+ 0 0 39 59,-3.1 2,-0.3 56,-0.1 -1,-0.1 -0.322 86.3 108.1 -74.3 61.2 8.9 17.4 64.0 64 69 A V S S- 0 0 54 -2,-2.7 2,-0.2 -4,-0.2 -4,-0.1 -0.959 73.7-106.4-135.2 149.6 8.3 13.6 63.9 65 70 A A - 0 0 59 -2,-0.3 2,-0.3 9,-0.1 9,-0.3 -0.500 38.9-144.8 -68.8 142.3 9.6 10.7 61.8 66 71 A T B -G 73 0B 41 7,-3.4 7,-3.2 -2,-0.2 3,-0.1 -0.760 26.8 -80.2-110.5 163.5 7.1 9.3 59.3 67 72 A A - 0 0 83 -2,-0.3 -1,-0.1 5,-0.2 0, 0.0 -0.299 65.4 -87.3 -51.5 130.2 6.3 5.8 57.9 68 73 A P 0 0 78 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 -0.290 360.0 360.0 -44.8 122.6 8.8 4.8 55.2 69 74 A V 0 0 163 -3,-0.1 -2,-0.1 0, 0.0 0, 0.0 0.486 360.0 360.0 -18.9 360.0 7.3 6.2 51.9 70 ! 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 71 81 A A 0 0 114 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 125.6 13.7 3.1 57.8 72 82 A P - 0 0 94 0, 0.0 2,-0.5 0, 0.0 -5,-0.2 -0.237 360.0-118.5 -60.5 145.8 11.6 6.0 59.2 73 83 A V B -G 66 0B 18 -7,-3.2 -7,-3.4 4,-0.0 2,-0.1 -0.774 26.3-140.7 -90.5 126.8 11.5 9.3 57.3 74 84 A T > - 0 0 40 -2,-0.5 4,-2.2 -9,-0.3 5,-0.2 -0.408 21.8-113.2 -81.0 159.0 12.8 12.3 59.2 75 85 A L H > S+ 0 0 2 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.877 117.8 55.4 -58.5 -38.6 11.3 15.8 59.1 76 86 A F H > S+ 0 0 56 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.914 107.2 49.0 -61.9 -45.1 14.4 17.1 57.3 77 87 A T H > S+ 0 0 58 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.926 109.9 50.6 -59.7 -48.8 14.0 14.5 54.6 78 88 A R H X S+ 0 0 16 -4,-2.2 4,-1.2 1,-0.2 -1,-0.2 0.857 112.4 49.3 -57.2 -35.9 10.3 15.3 54.0 79 89 A C H X S+ 0 0 0 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.895 108.5 50.3 -72.6 -44.5 11.4 19.0 53.8 80 90 A A H X S+ 0 0 36 -4,-2.8 4,-2.9 1,-0.2 -2,-0.2 0.899 108.3 55.7 -58.3 -38.8 14.1 18.3 51.3 81 91 A E H X S+ 0 0 100 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.821 103.1 53.7 -64.9 -34.0 11.6 16.3 49.2 82 92 A L H X S+ 0 0 2 -4,-1.2 4,-0.7 2,-0.2 -1,-0.2 0.956 113.1 42.5 -64.6 -47.1 9.2 19.3 49.0 83 93 A V H >X S+ 0 0 1 -4,-1.8 4,-1.3 1,-0.2 3,-1.0 0.906 113.8 53.2 -65.5 -42.6 11.9 21.5 47.7 84 94 A A H 3X S+ 0 0 27 -4,-2.9 4,-2.8 1,-0.3 5,-0.2 0.837 98.7 63.0 -59.2 -36.8 13.1 18.7 45.4 85 95 A A H 3X S+ 0 0 26 -4,-2.0 4,-1.5 1,-0.2 -1,-0.3 0.793 102.7 51.9 -61.8 -25.3 9.6 18.3 44.0 86 96 A C H S+ 0 0 0 -3,-1.0 4,-2.6 -4,-0.7 6,-0.9 0.933 112.8 41.8 -75.1 -46.3 9.9 21.9 42.7 87 97 A Y H X5S+ 0 0 28 -4,-1.3 4,-0.6 4,-0.3 -2,-0.2 0.793 113.8 54.3 -72.2 -30.3 13.2 21.2 40.9 88 98 A T H <5S+ 0 0 126 -4,-2.8 -1,-0.2 -5,-0.1 -2,-0.2 0.902 118.9 31.9 -67.0 -44.4 12.1 17.8 39.6 89 99 A H H <5S+ 0 0 90 -4,-1.5 -2,-0.2 -5,-0.2 -3,-0.2 0.884 141.5 11.3 -84.6 -42.2 8.9 19.2 38.0 90 100 A W H <5S- 0 0 48 -4,-2.6 -3,-0.2 -5,-0.2 -2,-0.1 0.437 93.8-119.9-117.2 -4.0 10.0 22.7 36.9 91 101 A G S < + 0 0 119 3,-0.0 4,-1.2 0, 0.0 5,-0.1 0.365 360.0 52.7-150.5 -53.4 -1.8 12.1 78.0 114 133 A R H >> S+ 0 0 143 2,-0.2 4,-3.0 1,-0.2 3,-0.9 0.936 105.6 60.4 -52.8 -50.6 1.9 12.1 77.4 115 134 A E H 3> S+ 0 0 116 1,-0.3 4,-3.3 2,-0.2 5,-0.3 0.911 102.8 49.6 -45.3 -52.7 1.2 11.5 73.7 116 135 A A H 3> S+ 0 0 63 1,-0.2 4,-1.5 2,-0.2 -1,-0.3 0.822 114.2 47.2 -56.9 -33.0 -0.8 14.8 73.5 117 136 A M H S+ 0 0 5 -4,-2.0 5,-2.5 -5,-0.4 4,-1.6 0.867 115.6 49.1 -68.6 -37.7 7.3 23.5 66.9 126 145 A G H <>S+ 0 0 0 -4,-1.8 5,-3.3 -5,-0.2 -64,-0.2 0.958 115.4 40.2 -67.7 -51.3 7.7 21.6 63.7 127 146 A S H <5S+ 0 0 11 -4,-2.3 -2,-0.2 -5,-0.3 -1,-0.2 0.918 123.8 37.7 -63.3 -44.6 5.2 23.5 61.6 128 147 A N H <5S- 0 0 1 -4,-1.8 -1,-0.2 -5,-0.4 -2,-0.2 0.659 138.1 -4.9 -87.8 -18.9 5.9 26.9 62.9 129 148 A A T X5S+ 0 0 0 -4,-1.6 4,-2.0 -5,-0.2 -3,-0.2 0.577 123.2 49.4-139.4 -56.3 9.8 26.8 63.2 130 149 A I H > S+ 0 0 4 0, 0.0 4,-2.7 0, 0.0 -1,-0.2 0.864 108.4 54.0 -53.9 -39.6 10.7 26.2 58.0 133 152 A Y H X S+ 0 0 1 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.964 112.9 39.3 -58.1 -54.6 14.3 25.8 59.2 134 153 A F H X S+ 0 0 0 -4,-2.1 4,-3.0 2,-0.2 -1,-0.2 0.828 114.0 55.9 -68.1 -34.2 15.0 22.6 57.2 135 154 A L H X S+ 0 0 1 -4,-3.3 4,-2.9 -5,-0.2 5,-0.2 0.970 109.3 46.3 -61.4 -50.3 13.0 24.0 54.2 136 155 A I H X S+ 0 0 0 -4,-2.7 4,-3.5 2,-0.2 5,-0.2 0.925 112.3 50.7 -58.8 -47.2 15.2 27.0 54.1 137 156 A K H X S+ 0 0 29 -4,-2.7 4,-3.3 2,-0.2 -1,-0.2 0.965 113.1 45.6 -52.0 -56.2 18.3 24.9 54.4 138 157 A A H X S+ 0 0 8 -4,-3.0 4,-2.1 1,-0.2 -2,-0.2 0.920 115.0 47.2 -51.1 -51.2 17.1 22.7 51.5 139 158 A F H X S+ 0 0 0 -4,-2.9 4,-1.9 1,-0.2 -1,-0.2 0.930 113.4 49.4 -57.1 -47.1 16.1 25.7 49.4 140 159 A A H X S+ 0 0 0 -4,-3.5 4,-2.6 -5,-0.2 -2,-0.2 0.910 108.6 52.6 -62.1 -45.3 19.5 27.3 50.3 141 160 A H H X S+ 0 0 57 -4,-3.3 4,-2.2 -5,-0.2 -1,-0.2 0.892 107.1 51.8 -56.3 -43.7 21.4 24.2 49.3 142 161 A R H < S+ 0 0 106 -4,-2.1 4,-0.3 2,-0.2 -1,-0.2 0.908 111.4 46.4 -64.5 -44.5 19.7 24.0 45.9 143 162 A V H >< S+ 0 0 0 -4,-1.9 3,-1.5 2,-0.2 -1,-0.2 0.934 113.1 49.4 -58.8 -50.8 20.6 27.6 45.0 144 163 A A H 3< S+ 0 0 44 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.839 109.6 52.7 -59.2 -34.9 24.2 27.1 46.2 145 164 A G T 3< S+ 0 0 65 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.512 93.3 89.4 -80.0 -5.6 24.4 23.9 44.1 146 165 A T S < S- 0 0 27 -3,-1.5 5,-0.1 -4,-0.3 2,-0.0 -0.820 90.4-111.4 -91.1 128.2 23.2 25.8 41.0 147 166 A P >> - 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