==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SYNTHASE 31-AUG-04 1W78 . COMPND 2 MOLECULE: FOLC BIFUNCTIONAL PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR M.MATHIEU,G.DEBOUSKER,S.VINCENT,F.VIVIANI,N.BAMAS-JACQUES, . 414 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16978.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 287 69.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 47 11.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 25 6.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 4 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 27 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 35 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 135 32.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.7 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 0 3 1 3 1 0 1 4 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 1 1 4 3 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 . 1 1 2 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 ANTIPARALLEL BRIDGES PER LADDER . 0 1 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 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 T 0 0 121 0, 0.0 10,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 119.2 -22.4 26.8 32.7 2 7 A P - 0 0 21 0, 0.0 2,-0.2 0, 0.0 106,-0.0 -0.169 360.0-152.0 -68.6 166.8 -20.1 27.6 35.6 3 8 A Q > - 0 0 131 4,-0.1 3,-1.7 105,-0.0 102,-0.1 -0.755 38.2 -84.3-130.9 177.8 -18.6 31.0 36.3 4 9 A A T 3 S+ 0 0 50 1,-0.3 98,-0.1 -2,-0.2 97,-0.1 0.824 128.2 51.8 -54.3 -34.4 -15.5 32.5 37.9 5 10 A A T 3 S+ 0 0 99 96,-0.1 -1,-0.3 97,-0.1 3,-0.1 0.633 86.8 106.7 -81.4 -12.8 -17.2 32.2 41.2 6 11 A S S < S- 0 0 25 -3,-1.7 95,-0.1 1,-0.1 5,-0.0 -0.266 82.2 -95.3 -64.9 151.7 -18.2 28.5 40.9 7 12 A P >> - 0 0 83 0, 0.0 4,-1.6 0, 0.0 3,-0.7 -0.324 31.3-117.4 -64.3 150.1 -16.3 25.9 42.9 8 13 A L H 3> S+ 0 0 21 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.895 114.8 62.0 -53.8 -40.1 -13.5 24.2 41.1 9 14 A A H 3> S+ 0 0 71 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.870 102.4 49.8 -55.8 -40.7 -15.4 20.9 41.5 10 15 A S H <> S+ 0 0 55 -3,-0.7 4,-1.9 2,-0.2 -1,-0.2 0.898 110.4 50.7 -65.4 -41.0 -18.3 22.3 39.4 11 16 A W H X S+ 0 0 0 -4,-1.6 4,-2.6 2,-0.2 5,-0.2 0.930 109.9 49.2 -62.3 -46.6 -15.8 23.4 36.7 12 17 A L H X S+ 0 0 24 -4,-2.8 4,-2.0 1,-0.2 -2,-0.2 0.893 110.3 50.2 -62.0 -38.3 -14.2 20.0 36.5 13 18 A S H < S+ 0 0 69 -4,-2.1 4,-0.4 -5,-0.2 -1,-0.2 0.883 112.3 49.1 -66.8 -36.6 -17.5 18.2 36.2 14 19 A Y H >X S+ 0 0 44 -4,-1.9 4,-1.2 1,-0.2 3,-0.9 0.884 111.3 48.2 -66.9 -44.2 -18.4 20.7 33.4 15 20 A L H 3< S+ 0 0 3 -4,-2.6 4,-0.5 1,-0.2 103,-0.2 0.826 103.0 63.0 -65.2 -36.0 -15.1 20.1 31.6 16 21 A E T 3< S+ 0 0 112 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.686 117.4 27.9 -65.1 -15.3 -15.6 16.4 31.9 17 22 A N T <4 S+ 0 0 124 -3,-0.9 -2,-0.2 -4,-0.4 -1,-0.2 0.506 91.7 95.2-124.1 -7.1 -18.7 16.7 29.7 18 23 A L S < S+ 0 0 37 -4,-1.2 99,-0.1 -3,-0.1 -3,-0.1 0.922 77.7 58.4 -52.4 -58.6 -18.3 19.8 27.5 19 24 A H S S- 0 0 24 -4,-0.5 99,-0.1 97,-0.3 98,-0.0 -0.386 82.0-123.6 -79.4 155.6 -17.0 18.1 24.3 20 25 A S S S+ 0 0 117 -2,-0.1 2,-0.3 1,-0.0 -1,-0.1 0.839 101.0 40.8 -63.7 -34.9 -18.6 15.3 22.2 21 26 A K S S- 0 0 94 1,-0.1 -2,-0.1 3,-0.0 3,-0.1 -0.911 76.8-137.0-116.2 143.4 -15.6 13.0 22.7 22 27 A T S S+ 0 0 108 -2,-0.3 96,-0.5 1,-0.2 2,-0.5 0.973 99.8 23.2 -60.7 -54.4 -13.5 12.6 25.9 23 28 A I + 0 0 75 94,-0.1 2,-0.3 95,-0.1 -1,-0.2 -0.956 68.1 169.5-113.5 128.8 -10.2 12.7 24.0 24 29 A D - 0 0 41 -2,-0.5 93,-0.2 -3,-0.1 2,-0.0 -0.771 22.2-152.8-139.6 85.5 -10.2 14.5 20.6 25 30 A L + 0 0 30 -2,-0.3 2,-0.2 124,-0.0 124,-0.2 -0.361 46.4 100.6 -63.6 142.0 -6.6 14.9 19.4 26 31 A G - 0 0 20 122,-1.9 4,-0.2 1,-0.1 -2,-0.1 -0.627 58.2-134.1 150.5 151.5 -6.0 17.8 17.0 27 32 A L S > S+ 0 0 43 -2,-0.2 4,-2.5 3,-0.1 5,-0.2 0.605 78.4 83.7-103.9 -21.7 -4.6 21.4 17.3 28 33 A E H > S+ 0 0 148 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.949 92.9 38.2 -50.7 -68.4 -7.1 23.6 15.4 29 34 A R H > S+ 0 0 58 1,-0.2 4,-1.8 2,-0.2 5,-0.2 0.944 121.2 46.7 -51.6 -53.8 -9.9 24.4 17.9 30 35 A V H > S+ 0 0 0 1,-0.2 4,-2.3 -4,-0.2 -1,-0.2 0.886 111.0 51.8 -60.5 -37.4 -7.5 24.7 20.8 31 36 A S H X S+ 0 0 33 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.877 106.6 54.3 -63.9 -42.5 -5.1 26.9 18.9 32 37 A L H X S+ 0 0 79 -4,-2.3 4,-1.8 -5,-0.2 -1,-0.2 0.896 111.6 43.3 -61.4 -40.0 -7.8 29.3 17.9 33 38 A V H X S+ 0 0 0 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.898 112.5 52.8 -72.5 -39.4 -8.9 29.8 21.5 34 39 A A H X>S+ 0 0 0 -4,-2.3 5,-1.8 1,-0.2 4,-1.3 0.893 107.6 54.1 -60.5 -38.7 -5.2 30.1 22.6 35 40 A A H <5S+ 0 0 60 -4,-2.5 3,-0.4 1,-0.2 -2,-0.2 0.928 109.0 46.6 -62.6 -44.8 -4.8 32.7 19.9 36 41 A R H <5S+ 0 0 146 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.903 114.9 47.2 -62.3 -41.0 -7.7 34.8 21.2 37 42 A L H <5S- 0 0 32 -4,-2.3 -1,-0.2 -5,-0.1 -2,-0.2 0.633 104.7-130.3 -76.2 -17.2 -6.3 34.4 24.8 38 43 A G T <5S+ 0 0 44 -4,-1.3 3,-0.2 -3,-0.4 -3,-0.2 0.863 70.1 124.6 69.1 36.8 -2.8 35.4 23.8 39 44 A V < + 0 0 1 -5,-1.8 -4,-0.1 1,-0.1 -5,-0.1 0.227 28.3 105.9-112.0 13.1 -1.3 32.3 25.6 40 45 A L S S+ 0 0 61 -6,-0.4 115,-0.6 1,-0.3 -1,-0.1 0.713 87.1 40.6 -67.0 -22.9 0.6 30.6 22.8 41 46 A K S S+ 0 0 119 -3,-0.2 -1,-0.3 113,-0.1 113,-0.0 -0.759 73.1 177.7-123.6 82.0 4.0 31.8 24.1 42 47 A P + 0 0 2 0, 0.0 93,-0.4 0, 0.0 92,-0.1 0.670 66.6 1.6 -64.6 -17.5 3.5 31.2 27.9 43 48 A A S S- 0 0 5 95,-0.1 93,-0.2 91,-0.1 94,-0.1 -0.949 79.8-101.0-159.3 163.2 7.0 32.3 28.9 44 49 A P S S+ 0 0 93 0, 0.0 2,-0.4 0, 0.0 93,-0.1 0.709 113.6 36.3 -65.9 -18.6 10.2 33.5 27.1 45 50 A F E S-a 137 0A 33 91,-0.9 93,-2.4 90,-0.1 2,-0.4 -0.991 72.7-175.3-138.0 128.1 11.6 30.0 27.4 46 51 A V E -a 138 0A 2 -2,-0.4 111,-2.5 91,-0.2 112,-1.5 -0.982 12.7-164.5-128.7 132.7 9.6 26.8 27.1 47 52 A F E -ab 139 158A 0 91,-2.4 93,-3.4 -2,-0.4 2,-0.5 -0.947 11.6-163.3-107.4 132.8 10.6 23.1 27.5 48 53 A T E -ab 140 159A 2 110,-2.2 112,-2.3 -2,-0.5 2,-0.6 -0.974 6.3-158.1-120.1 126.5 8.0 20.6 26.1 49 54 A V E +ab 141 160A 0 91,-3.3 93,-3.0 -2,-0.5 2,-0.2 -0.929 16.4 168.5-118.2 113.7 8.4 17.1 27.3 50 55 A A E + b 0 161A 0 110,-3.4 112,-2.7 -2,-0.6 2,-0.2 -0.700 16.4 114.0-111.8 168.1 7.0 14.1 25.4 51 56 A G - 0 0 0 94,-0.4 113,-0.2 110,-0.3 94,-0.2 -0.697 66.3 -98.0 145.7 159.6 7.6 10.3 25.8 52 57 A T S S- 0 0 3 111,-2.4 2,-0.3 1,-0.3 -1,-0.1 0.976 105.7 -0.3 -67.7 -53.4 5.9 7.0 26.8 53 58 A N S S+ 0 0 28 1,-0.1 -1,-0.3 -3,-0.1 -3,-0.0 -0.962 115.4 47.3-134.8 153.4 7.2 7.1 30.4 54 59 A G > + 0 0 17 -2,-0.3 4,-1.9 -3,-0.1 5,-0.2 0.418 67.3 117.9 99.6 1.6 9.3 9.5 32.3 55 60 A K H > S+ 0 0 21 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.969 75.1 48.6 -65.0 -53.5 7.6 12.8 31.4 56 61 A G H > S+ 0 0 8 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.897 117.0 41.4 -53.3 -48.5 6.5 13.8 34.9 57 62 A T H > S+ 0 0 3 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.835 111.9 53.9 -74.3 -33.1 9.9 13.2 36.5 58 63 A T H X S+ 0 0 0 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.944 112.2 46.8 -64.2 -44.3 11.9 14.7 33.7 59 64 A C H X S+ 0 0 0 -4,-2.8 4,-2.8 1,-0.2 -2,-0.2 0.920 110.4 52.2 -61.8 -42.5 9.7 17.8 34.1 60 65 A R H X S+ 0 0 47 -4,-2.2 4,-2.6 -5,-0.2 -1,-0.2 0.894 109.2 50.6 -61.2 -38.2 10.2 17.7 37.9 61 66 A T H X S+ 0 0 1 -4,-2.1 4,-2.5 2,-0.2 5,-0.3 0.923 110.9 47.3 -66.2 -44.6 14.0 17.6 37.4 62 67 A L H X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 5,-0.2 0.927 113.3 49.4 -62.2 -43.9 14.0 20.5 35.1 63 68 A E H X S+ 0 0 6 -4,-2.8 4,-2.4 2,-0.2 5,-0.2 0.928 111.0 49.9 -59.4 -47.7 11.8 22.4 37.6 64 69 A S H X S+ 0 0 11 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.934 114.3 42.6 -59.9 -48.5 14.0 21.6 40.5 65 70 A I H X S+ 0 0 0 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.939 114.8 49.8 -66.7 -45.7 17.3 22.7 38.8 66 71 A L H <>S+ 0 0 0 -4,-2.6 5,-2.5 -5,-0.3 -1,-0.2 0.865 110.5 49.9 -63.0 -35.9 15.8 25.9 37.2 67 72 A M H ><5S+ 0 0 52 -4,-2.4 3,-1.8 -5,-0.2 -1,-0.2 0.904 109.2 51.5 -67.4 -42.3 14.3 27.0 40.6 68 73 A A H 3<5S+ 0 0 49 -4,-2.0 -2,-0.2 1,-0.3 -1,-0.2 0.866 106.7 56.0 -60.2 -34.4 17.7 26.4 42.2 69 74 A A T 3<5S- 0 0 31 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.415 122.3-110.5 -79.4 2.3 19.1 28.6 39.4 70 75 A G T < 5 + 0 0 62 -3,-1.8 -3,-0.2 1,-0.3 2,-0.2 0.541 69.2 141.5 82.8 9.2 16.7 31.3 40.4 71 76 A Y < - 0 0 43 -5,-2.5 2,-0.7 1,-0.0 -1,-0.3 -0.522 58.0-119.7 -79.6 150.4 14.4 31.2 37.4 72 77 A K - 0 0 117 -2,-0.2 65,-2.4 62,-0.1 64,-2.1 -0.838 45.9-169.9 -90.0 115.5 10.6 31.7 38.0 73 78 A V E -c 137 0A 0 -2,-0.7 18,-2.9 63,-0.2 19,-0.4 -0.925 21.9-164.6-119.4 139.8 9.3 28.4 36.6 74 79 A G E -cD 138 90A 0 63,-2.4 65,-2.7 -2,-0.4 2,-0.4 -0.918 9.2-161.5-118.0 143.6 5.9 27.0 35.8 75 80 A V E -cD 139 89A 0 14,-2.7 14,-2.5 -2,-0.4 2,-0.5 -0.982 7.4-162.9-129.7 126.9 5.2 23.3 35.3 76 81 A Y E +cD 140 88A 0 63,-2.9 65,-1.7 -2,-0.4 2,-0.3 -0.909 25.0 170.9-103.7 123.5 2.1 21.7 33.5 77 82 A S - 0 0 17 10,-2.2 66,-0.1 -2,-0.5 -2,-0.0 -0.921 17.0-119.4-133.4 160.2 1.8 18.0 34.4 78 83 A S + 0 0 11 -2,-0.3 2,-0.2 64,-0.1 -22,-0.1 -0.966 66.6 13.4-161.7 150.3 -0.7 15.2 33.9 79 84 A P S S- 0 0 59 0, 0.0 2,-0.3 0, 0.0 -1,-0.0 0.668 73.6-132.7 -81.9-162.9 -2.5 13.3 35.1 80 85 A H - 0 0 49 -2,-0.2 4,-0.1 1,-0.1 319,-0.0 -0.813 3.5-145.1-111.7 154.9 -2.9 14.1 38.8 81 86 A L S S- 0 0 24 -2,-0.3 -1,-0.1 2,-0.2 322,-0.1 0.957 86.0 -19.8 -78.5 -59.4 -2.7 11.7 41.8 82 87 A V S S+ 0 0 57 1,-0.3 2,-0.4 321,-0.0 -2,-0.1 0.744 126.2 39.2-117.7 -51.5 -5.2 13.2 44.2 83 88 A R > - 0 0 111 1,-0.1 3,-1.9 0, 0.0 -1,-0.3 -0.909 63.5-137.0-114.6 138.1 -6.1 16.8 43.4 84 89 A Y G > S+ 0 0 10 -2,-0.4 3,-2.4 1,-0.3 4,-0.2 0.831 100.8 69.6 -52.8 -38.0 -6.5 18.5 40.0 85 90 A T G > S+ 0 0 1 1,-0.3 3,-1.3 2,-0.2 10,-0.4 0.665 80.0 78.4 -60.0 -15.1 -4.5 21.5 41.2 86 91 A E G < S+ 0 0 48 -3,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.753 79.2 73.6 -62.4 -25.4 -1.4 19.3 41.2 87 92 A R G < S+ 0 0 23 -3,-2.4 -10,-2.2 -4,-0.2 2,-0.5 0.650 95.5 48.6 -66.4 -17.1 -1.4 19.8 37.4 88 93 A V E < +D 76 0A 0 -3,-1.3 7,-0.6 -12,-0.2 2,-0.4 -0.932 65.9 175.6-130.7 111.7 -0.2 23.4 37.5 89 94 A R E -DE 75 94A 13 -14,-2.5 -14,-2.7 -2,-0.5 2,-0.4 -0.906 10.9-172.1-113.8 143.0 2.8 24.4 39.6 90 95 A V E > S-DE 74 93A 24 3,-2.6 3,-1.8 -2,-0.4 -16,-0.2 -0.996 84.8 -8.3-130.1 122.2 4.4 27.9 39.8 91 96 A Q T 3 S- 0 0 82 -18,-2.9 -17,-0.1 -2,-0.4 -1,-0.1 0.879 131.5 -57.3 55.6 39.4 7.7 28.0 41.8 92 97 A G T 3 S+ 0 0 25 -19,-0.4 2,-0.3 1,-0.2 -1,-0.3 0.551 118.2 106.0 72.0 9.1 7.0 24.4 42.9 93 98 A Q E < S-E 90 0A 140 -3,-1.8 -3,-2.6 1,-0.0 -1,-0.2 -0.914 70.7-116.9-123.7 149.3 3.6 25.3 44.4 94 99 A E E -E 89 0A 83 -2,-0.3 -5,-0.2 -5,-0.2 -8,-0.1 -0.355 34.2-120.2 -74.3 159.6 0.1 24.8 43.4 95 100 A L - 0 0 34 -7,-0.6 -7,-0.1 -10,-0.4 -1,-0.1 -0.681 37.2 -81.8-101.1 156.7 -2.1 27.8 42.6 96 101 A P >> - 0 0 70 0, 0.0 4,-1.5 0, 0.0 3,-1.1 -0.230 34.0-123.4 -56.7 144.2 -5.2 28.8 44.5 97 102 A E H 3> S+ 0 0 78 1,-0.3 4,-2.3 2,-0.2 5,-0.2 0.839 113.2 58.0 -56.9 -36.6 -8.4 27.1 43.3 98 103 A S H 3> S+ 0 0 83 2,-0.2 4,-1.7 1,-0.2 -1,-0.3 0.729 100.7 56.4 -69.8 -22.4 -9.9 30.5 42.6 99 104 A A H <> S+ 0 0 27 -3,-1.1 4,-2.3 2,-0.2 -1,-0.2 0.900 109.1 47.9 -72.6 -41.9 -7.1 31.3 40.2 100 105 A H H X S+ 0 0 0 -4,-1.5 4,-2.4 2,-0.2 -2,-0.2 0.933 112.5 46.1 -62.6 -48.1 -8.0 28.1 38.3 101 106 A T H X S+ 0 0 7 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.893 112.2 51.9 -66.0 -34.6 -11.8 28.9 38.2 102 107 A A H X S+ 0 0 34 -4,-1.7 4,-2.1 2,-0.2 -1,-0.2 0.929 110.0 49.5 -64.4 -45.4 -11.0 32.4 37.1 103 108 A S H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.913 110.0 50.5 -59.8 -42.4 -8.8 31.0 34.3 104 109 A F H X S+ 0 0 0 -4,-2.4 4,-2.8 1,-0.2 -2,-0.2 0.913 108.1 53.0 -63.2 -41.6 -11.6 28.6 33.3 105 110 A A H X S+ 0 0 25 -4,-2.5 4,-1.9 2,-0.2 -1,-0.2 0.893 108.7 50.5 -59.6 -40.5 -14.1 31.6 33.2 106 111 A E H X S+ 0 0 89 -4,-2.1 4,-2.7 1,-0.2 -2,-0.2 0.933 112.2 46.5 -63.9 -45.0 -11.7 33.4 30.8 107 112 A I H X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.902 108.4 56.7 -64.3 -39.4 -11.4 30.4 28.5 108 113 A E H < S+ 0 0 33 -4,-2.8 4,-0.5 2,-0.2 -1,-0.2 0.899 113.0 39.4 -60.8 -40.5 -15.2 30.0 28.6 109 114 A S H >< S+ 0 0 84 -4,-1.9 3,-1.0 1,-0.2 -2,-0.2 0.945 116.2 51.4 -74.7 -44.1 -15.8 33.5 27.3 110 115 A A H 3< S+ 0 0 21 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.797 100.6 62.3 -63.4 -31.4 -12.8 33.4 24.9 111 116 A R T >< S+ 0 0 28 -4,-2.5 3,-3.0 1,-0.2 -1,-0.2 0.734 74.4 178.5 -70.3 -19.1 -13.8 30.1 23.2 112 117 A G T < S- 0 0 39 -3,-1.0 -1,-0.2 -4,-0.5 -2,-0.1 -0.351 73.8 -17.7 54.7-118.4 -17.1 31.5 21.9 113 118 A D T 3 S+ 0 0 168 -2,-0.2 2,-0.5 -3,-0.1 -1,-0.3 0.338 106.6 116.4-101.0 8.1 -18.6 28.6 20.0 114 119 A I < - 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