==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIGASE 07-AUG-02 1MDF . COMPND 2 MOLECULE: 2,3-DIHYDROXYBENZOATE-AMP LIGASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS; . AUTHOR J.J.MAY,N.KESSLER,M.A.MARAHIEL,M.T.STUBBS . 536 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22204.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 377 70.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 47 8.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 68 12.7 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 . 6 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.7 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 . 46 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 53 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 137 25.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 1.9 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 2 1 2 1 1 3 2 3 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 2 2 5 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 PARALLEL BRIDGES PER LADDER . 5 3 1 2 3 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 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 1 0 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 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 0 172 0, 0.0 182,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 148.8 -13.7 41.3 30.7 2 2 A L > - 0 0 15 1,-0.1 3,-1.6 2,-0.1 2,-0.3 -0.303 360.0-108.0 -57.6 137.2 -12.7 39.5 33.9 3 3 A K T 3 S+ 0 0 159 1,-0.2 -1,-0.1 390,-0.0 3,-0.1 -0.539 106.3 29.1 -70.4 126.7 -9.9 41.3 35.7 4 4 A G T 3 S+ 0 0 19 1,-0.3 390,-0.8 -2,-0.3 2,-0.4 0.390 92.2 124.2 104.3 -0.7 -6.7 39.3 35.4 5 5 A F < - 0 0 32 -3,-1.6 -1,-0.3 388,-0.2 387,-0.1 -0.794 49.8-150.7 -99.0 131.9 -7.6 37.9 32.0 6 6 A T - 0 0 55 -2,-0.4 384,-0.5 385,-0.4 385,-0.2 -0.894 19.7-140.5-102.6 118.2 -5.3 38.3 29.0 7 7 A P - 0 0 59 0, 0.0 3,-0.1 0, 0.0 -1,-0.0 -0.176 17.8-106.9 -71.8 167.3 -7.2 38.3 25.7 8 8 A W - 0 0 19 1,-0.2 381,-0.0 2,-0.1 399,-0.0 -0.448 54.6 -82.4 -83.0 165.3 -6.2 36.6 22.4 9 9 A P > - 0 0 45 0, 0.0 4,-2.6 0, 0.0 5,-0.3 -0.338 35.4-117.0 -69.5 156.7 -5.0 39.1 19.7 10 10 A D H > S+ 0 0 150 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.876 114.2 48.0 -61.4 -39.3 -7.7 40.8 17.6 11 11 A E H > S+ 0 0 159 2,-0.2 4,-2.0 3,-0.2 -1,-0.2 0.938 116.1 42.1 -66.0 -51.6 -6.4 39.2 14.4 12 12 A L H > S+ 0 0 42 2,-0.2 4,-2.9 1,-0.2 3,-0.4 0.984 115.0 48.8 -60.2 -60.7 -6.2 35.7 15.8 13 13 A A H X S+ 0 0 8 -4,-2.6 4,-1.3 1,-0.3 5,-0.2 0.917 113.3 48.6 -45.7 -51.5 -9.5 35.8 17.7 14 14 A E H X S+ 0 0 103 -4,-2.0 4,-1.7 -5,-0.3 -1,-0.3 0.879 113.7 47.1 -57.8 -38.7 -11.2 37.2 14.5 15 15 A T H X S+ 0 0 61 -4,-2.0 4,-2.3 -3,-0.4 -1,-0.2 0.815 106.8 57.2 -73.0 -30.5 -9.5 34.4 12.5 16 16 A Y H <>S+ 0 0 6 -4,-2.9 6,-2.3 1,-0.2 5,-1.9 0.742 110.3 45.1 -71.6 -23.0 -10.5 31.8 15.1 17 17 A R H ><5S+ 0 0 119 -4,-1.3 3,-0.8 -5,-0.3 -2,-0.2 0.818 111.9 51.2 -87.6 -34.7 -14.1 32.8 14.6 18 18 A K H 3<5S+ 0 0 155 -4,-1.7 -2,-0.2 1,-0.2 -3,-0.2 0.872 109.9 49.2 -68.8 -40.0 -13.8 32.9 10.8 19 19 A N T 3<5S- 0 0 70 -4,-2.3 -1,-0.2 -5,-0.1 -2,-0.1 0.353 116.6-115.2 -81.9 5.7 -12.3 29.4 10.7 20 20 A G T < 5S+ 0 0 43 -3,-0.8 -3,-0.2 2,-0.2 3,-0.2 0.707 81.8 121.1 70.0 21.9 -15.1 28.1 12.9 21 21 A C S - 0 0 6 -2,-0.4 4,-2.4 153,-0.2 155,-0.1 -0.369 31.3-103.8 -93.8 175.9 -21.6 28.8 25.9 27 27 A F H > S+ 0 0 1 1,-0.2 4,-2.5 2,-0.2 5,-0.3 0.857 126.0 55.9 -67.3 -33.2 -21.6 25.8 28.1 28 28 A G H > S+ 0 0 8 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.878 109.0 46.9 -64.1 -35.6 -25.1 26.8 29.1 29 29 A D H > S+ 0 0 76 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.892 110.1 54.0 -71.2 -40.5 -26.0 26.8 25.4 30 30 A L H X S+ 0 0 7 -4,-2.4 4,-2.7 1,-0.2 5,-0.2 0.948 111.4 42.3 -59.4 -53.3 -24.3 23.4 24.9 31 31 A L H X S+ 0 0 4 -4,-2.5 4,-2.9 2,-0.2 5,-0.2 0.875 113.6 53.2 -63.5 -38.2 -26.2 21.6 27.7 32 32 A R H X S+ 0 0 109 -4,-1.6 4,-2.6 -5,-0.3 5,-0.2 0.975 113.1 43.5 -60.1 -54.1 -29.5 23.2 26.6 33 33 A D H X S+ 0 0 75 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.889 115.7 47.1 -58.2 -45.5 -29.1 22.1 23.1 34 34 A R H X>S+ 0 0 17 -4,-2.7 4,-4.5 -5,-0.2 5,-0.5 0.920 112.1 50.1 -66.7 -41.3 -27.9 18.6 24.0 35 35 A A H X5S+ 0 0 0 -4,-2.9 4,-2.2 1,-0.2 19,-0.2 0.922 113.6 45.9 -62.6 -41.6 -30.8 18.2 26.5 36 36 A A H <5S+ 0 0 65 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.873 121.1 39.8 -66.8 -37.3 -33.3 19.3 23.9 37 37 A K H <5S+ 0 0 136 -4,-2.3 -2,-0.2 -5,-0.2 -3,-0.2 0.929 129.6 26.4 -77.2 -47.7 -31.6 17.0 21.4 38 38 A Y H ><5S+ 0 0 33 -4,-4.5 3,-2.6 1,-0.2 -3,-0.2 0.581 78.7 166.2 -95.2 -13.6 -30.9 13.9 23.6 39 39 A G T 3< -Ab 49 255A 29 3,-2.4 3,-2.5 -2,-0.5 210,-0.1 -0.940 62.8 -54.6-138.2 112.9 -22.8 6.7 39.1 47 47 A G T 3 S- 0 0 44 208,-0.5 208,-0.0 -2,-0.4 -1,-0.0 -0.348 120.1 -19.2 58.4-129.7 -23.4 3.5 40.9 48 48 A N T 3 S+ 0 0 131 -3,-0.1 2,-0.3 -2,-0.1 -1,-0.3 0.340 122.7 93.6 -89.7 4.5 -27.0 2.4 40.6 49 49 A T E < -A 46 0A 63 -3,-2.5 -3,-2.4 2,-0.0 2,-0.3 -0.726 52.1-172.4-104.0 151.9 -28.0 6.0 39.8 50 50 A H E -A 45 0A 86 -2,-0.3 2,-0.4 -5,-0.2 -5,-0.2 -0.975 11.9-160.3-139.8 153.3 -28.5 7.7 36.4 51 51 A W E -A 44 0A 11 -7,-1.9 -8,-2.2 -2,-0.3 -7,-1.7 -0.948 16.0-144.4-137.5 111.8 -29.1 11.3 35.1 52 52 A S E > -A 42 0A 9 -2,-0.4 4,-2.0 -10,-0.3 3,-0.5 -0.340 30.9-109.5 -68.8 157.8 -30.5 11.9 31.6 53 53 A Y H > S+ 0 0 1 -12,-2.0 4,-2.7 1,-0.3 -18,-0.2 0.896 122.3 54.7 -54.0 -42.0 -29.2 15.0 29.7 54 54 A R H > S+ 0 0 123 -15,-2.6 4,-2.0 -19,-0.2 -1,-0.3 0.862 107.6 50.2 -60.2 -37.0 -32.7 16.6 30.2 55 55 A E H > S+ 0 0 68 -3,-0.5 4,-3.0 -16,-0.4 -1,-0.2 0.872 110.5 48.4 -69.6 -38.9 -32.4 16.0 34.0 56 56 A L H X S+ 0 0 0 -4,-2.0 4,-2.8 2,-0.2 5,-0.2 0.960 109.4 53.2 -64.7 -52.0 -28.9 17.6 34.1 57 57 A D H X S+ 0 0 14 -4,-2.7 4,-1.7 1,-0.2 -2,-0.2 0.908 114.9 42.2 -47.6 -50.1 -30.1 20.6 32.1 58 58 A T H X S+ 0 0 65 -4,-2.0 4,-2.7 2,-0.2 5,-0.3 0.956 112.3 49.7 -65.8 -54.3 -33.0 21.0 34.7 59 59 A R H X S+ 0 0 67 -4,-3.0 4,-2.8 1,-0.2 -1,-0.2 0.864 109.9 55.8 -54.4 -35.6 -31.0 20.4 37.9 60 60 A A H X S+ 0 0 0 -4,-2.8 4,-2.0 -5,-0.2 -1,-0.2 0.927 108.4 45.7 -62.1 -47.5 -28.5 22.9 36.6 61 61 A D H X S+ 0 0 23 -4,-1.7 4,-2.1 -5,-0.2 113,-0.3 0.922 114.6 47.4 -63.3 -45.3 -31.2 25.6 36.1 62 62 A R H X S+ 0 0 83 -4,-2.7 4,-2.0 1,-0.2 109,-1.1 0.943 111.8 50.1 -62.4 -44.5 -32.7 25.0 39.5 63 63 A L H X S+ 0 0 0 -4,-2.8 4,-2.5 -5,-0.3 -1,-0.2 0.853 107.6 55.4 -62.3 -33.4 -29.3 25.0 41.1 64 64 A A H X S+ 0 0 0 -4,-2.0 4,-3.2 2,-0.2 5,-0.2 0.926 105.1 51.7 -64.8 -45.1 -28.5 28.3 39.4 65 65 A A H X S+ 0 0 3 -4,-2.1 4,-2.9 106,-0.3 -2,-0.2 0.933 111.7 47.5 -56.7 -46.5 -31.6 29.9 40.8 66 66 A G H X S+ 0 0 4 -4,-2.0 4,-2.6 103,-0.7 -1,-0.2 0.909 112.5 48.4 -62.0 -44.4 -30.6 28.8 44.3 67 67 A F H X>S+ 0 0 0 -4,-2.5 5,-1.9 102,-0.3 4,-1.7 0.962 112.9 47.2 -61.5 -50.8 -27.0 30.0 43.8 68 68 A Q H ><5S+ 0 0 73 -4,-3.2 3,-0.8 1,-0.2 -2,-0.2 0.947 112.9 49.7 -54.5 -50.0 -28.2 33.4 42.5 69 69 A K H 3<5S+ 0 0 167 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.869 107.2 55.1 -56.1 -40.3 -30.6 33.6 45.4 70 70 A L H 3<5S- 0 0 54 -4,-2.6 -1,-0.3 -5,-0.2 -2,-0.2 0.800 128.7 -97.3 -65.1 -29.5 -27.8 32.8 47.8 71 71 A G T <<5S+ 0 0 42 -4,-1.7 2,-0.3 -3,-0.8 -3,-0.2 0.445 71.9 144.3 128.1 1.8 -25.8 35.7 46.4 72 72 A I < - 0 0 4 -5,-1.9 -1,-0.3 1,-0.0 2,-0.2 -0.575 31.1-164.2 -75.9 129.7 -23.4 34.4 43.8 73 73 A Q > - 0 0 133 -2,-0.3 3,-1.9 1,-0.1 2,-0.1 -0.627 30.5 -75.9-111.5 171.0 -23.0 36.8 40.9 74 74 A Q T 3 S+ 0 0 77 1,-0.3 26,-0.2 -2,-0.2 25,-0.2 -0.440 120.1 20.1 -65.8 133.0 -21.7 36.8 37.4 75 75 A K T 3 S+ 0 0 106 24,-2.0 2,-0.3 1,-0.3 -1,-0.3 0.238 90.5 135.3 89.2 -9.6 -17.9 36.8 37.4 76 76 A D < - 0 0 39 -3,-1.9 25,-2.5 1,-0.1 2,-0.3 -0.525 53.5-130.0 -72.5 132.0 -17.7 35.5 41.0 77 77 A R E -i 101 0B 32 44,-0.4 47,-2.5 -2,-0.3 48,-0.6 -0.651 21.9-168.3 -84.1 137.0 -15.2 32.8 41.5 78 78 A V E -ij 102 125B 0 23,-3.2 25,-2.0 -2,-0.3 2,-0.7 -0.992 19.2-133.8-125.0 127.5 -16.3 29.6 43.3 79 79 A V E -ij 103 126B 0 46,-2.5 48,-3.1 -2,-0.4 2,-0.6 -0.744 23.1-166.0 -83.6 117.8 -13.8 27.0 44.5 80 80 A V E +ij 104 127B 1 23,-2.0 25,-1.4 -2,-0.7 2,-0.3 -0.916 18.5 164.4-110.0 109.8 -15.2 23.6 43.4 81 81 A Q + 0 0 1 46,-2.7 25,-0.1 -2,-0.6 23,-0.1 -0.661 21.7 144.7-123.7 75.4 -13.5 20.6 45.1 82 82 A L - 0 0 4 -2,-0.3 151,-0.2 23,-0.3 46,-0.1 -0.730 42.8-125.5-111.1 158.7 -15.7 17.6 44.5 83 83 A P - 0 0 5 0, 0.0 2,-2.0 0, 0.0 5,-0.2 -0.066 59.3 -62.0 -84.7-163.8 -14.9 13.9 43.9 84 84 A N S S+ 0 0 14 172,-0.2 2,-0.2 173,-0.2 144,-0.1 -0.512 92.6 128.8 -82.1 74.0 -16.2 11.9 40.8 85 85 A I S > S- 0 0 38 -2,-2.0 3,-0.6 1,-0.1 4,-0.5 -0.764 71.7-107.9-122.3 169.9 -19.9 12.3 41.7 86 86 A K T >> S+ 0 0 27 -2,-0.2 3,-1.3 1,-0.2 4,-1.1 0.880 110.2 68.2 -64.9 -41.2 -23.1 13.5 39.9 87 87 A E H 3> S+ 0 0 47 1,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.806 86.8 70.2 -48.9 -36.9 -23.3 16.8 41.8 88 88 A F H <> S+ 0 0 2 -3,-0.6 4,-2.2 1,-0.2 -1,-0.3 0.900 100.0 46.3 -49.3 -47.6 -20.1 18.0 40.1 89 89 A F H <> S+ 0 0 0 -3,-1.3 4,-2.2 -4,-0.5 5,-0.2 0.947 113.8 44.1 -65.0 -51.0 -21.8 18.3 36.7 90 90 A E H X S+ 0 0 1 -4,-1.1 4,-1.2 1,-0.2 -1,-0.2 0.843 113.7 55.4 -64.4 -31.7 -25.0 20.2 37.8 91 91 A V H X S+ 0 0 0 -4,-2.6 4,-2.3 -5,-0.2 -2,-0.2 0.955 110.5 40.2 -66.9 -51.4 -22.8 22.4 40.0 92 92 A I H X S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.910 116.1 50.1 -68.1 -39.0 -20.5 23.7 37.3 93 93 A F H X S+ 0 0 5 -4,-2.2 4,-1.5 -5,-0.2 -1,-0.2 0.789 110.2 51.8 -68.6 -24.7 -23.2 24.0 34.6 94 94 A A H X S+ 0 0 0 -4,-1.2 4,-1.2 -5,-0.2 6,-0.2 0.919 111.1 46.5 -73.9 -44.5 -25.2 26.0 37.2 95 95 A L H <>S+ 0 0 0 -4,-2.3 5,-1.9 1,-0.2 4,-0.3 0.856 108.6 58.2 -64.0 -33.2 -22.2 28.2 37.8 96 96 A F H ><5S+ 0 0 2 -4,-2.4 3,-0.8 1,-0.2 -1,-0.2 0.887 105.7 47.3 -64.0 -40.7 -21.9 28.5 34.0 97 97 A R H 3<5S+ 0 0 15 -4,-1.5 -1,-0.2 1,-0.3 -2,-0.2 0.716 110.5 52.7 -74.2 -21.2 -25.4 29.9 33.6 98 98 A L T 3<5S- 0 0 4 -4,-1.2 -1,-0.3 -3,-0.2 -2,-0.2 0.441 111.5-122.9 -89.6 -2.0 -24.8 32.4 36.4 99 99 A G T < 5 + 0 0 8 -3,-0.8 -24,-2.0 1,-0.3 -3,-0.2 0.617 65.4 148.6 68.4 7.4 -21.6 33.4 34.6 100 100 A A < - 0 0 1 -5,-1.9 -1,-0.3 -6,-0.2 -23,-0.2 -0.511 46.6-124.7 -76.2 144.4 -20.0 32.4 37.9 101 101 A L E -i 77 0B 7 -25,-2.5 -23,-3.2 -2,-0.2 85,-0.2 -0.811 16.0-148.5-102.6 116.6 -16.5 31.1 37.6 102 102 A P E -i 78 0B 0 0, 0.0 85,-3.1 0, 0.0 2,-0.5 -0.400 2.6-150.6 -74.9 151.9 -15.5 27.7 39.0 103 103 A V E -ik 79 187B 0 -25,-2.0 -23,-2.0 83,-0.2 2,-1.6 -0.926 19.4-139.5-124.8 101.3 -11.9 27.1 40.3 104 104 A F E +i 80 0B 1 83,-1.7 85,-0.2 -2,-0.5 -23,-0.2 -0.443 29.7 173.6 -69.5 85.0 -11.3 23.4 39.8 105 105 A A - 0 0 0 -2,-1.6 -23,-0.3 -25,-1.4 -2,-0.0 -0.477 28.2-120.2 -84.7 160.0 -9.5 22.2 42.9 106 106 A L > - 0 0 10 -2,-0.1 3,-2.6 -25,-0.1 411,-0.1 -0.766 18.6-115.0-104.7 150.1 -8.7 18.5 43.3 107 107 A P T 3 S+ 0 0 13 0, 0.0 25,-0.1 0, 0.0 -1,-0.1 0.587 113.7 64.7 -57.0 -8.1 -9.9 16.2 46.1 108 108 A S T 3 S+ 0 0 54 2,-0.0 2,-0.2 408,-0.0 409,-0.0 0.482 79.5 104.6 -94.2 -3.1 -6.2 15.8 47.1 109 109 A H < - 0 0 22 -3,-2.6 2,-0.1 1,-0.1 -4,-0.0 -0.562 53.2-164.1 -81.2 140.2 -5.8 19.5 48.1 110 110 A R > - 0 0 87 -2,-0.2 4,-2.9 34,-0.0 5,-0.3 -0.245 40.6 -66.8-110.7-162.1 -5.7 20.5 51.7 111 111 A S H > S+ 0 0 27 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.918 127.5 51.1 -54.4 -50.2 -6.1 23.6 53.9 112 112 A S H > S+ 0 0 83 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.894 117.1 39.6 -55.4 -44.9 -2.9 25.3 52.6 113 113 A E H > S+ 0 0 75 2,-0.2 4,-1.9 1,-0.1 -1,-0.2 0.850 117.1 47.5 -76.8 -36.7 -3.9 24.9 49.0 114 114 A I H X S+ 0 0 0 -4,-2.9 4,-3.1 2,-0.2 5,-0.3 0.924 109.7 53.2 -70.5 -44.3 -7.6 25.6 49.3 115 115 A T H X S+ 0 0 8 -4,-2.9 4,-3.0 -5,-0.3 5,-0.2 0.926 109.5 49.5 -56.4 -45.9 -7.0 28.8 51.4 116 116 A Y H X S+ 0 0 62 -4,-1.4 4,-3.2 -5,-0.3 5,-0.4 0.946 111.8 49.0 -56.8 -50.2 -4.6 30.1 48.7 117 117 A F H X S+ 0 0 2 -4,-1.9 4,-2.5 1,-0.2 6,-0.4 0.937 115.2 42.5 -56.1 -52.4 -7.3 29.3 46.0 118 118 A C H <>S+ 0 0 4 -4,-3.1 5,-1.3 2,-0.2 4,-0.5 0.894 120.1 44.0 -64.4 -39.0 -10.1 31.1 47.9 119 119 A E H ><5S+ 0 0 118 -4,-3.0 3,-1.2 -5,-0.3 -2,-0.2 0.998 117.9 41.9 -67.0 -63.8 -7.8 34.0 48.8 120 120 A F H 3<5S+ 0 0 52 -4,-3.2 -3,-0.2 1,-0.3 -2,-0.2 0.843 124.0 37.5 -51.1 -43.6 -6.1 34.4 45.5 121 121 A A T 3<5S- 0 0 0 -4,-2.5 -44,-0.4 -5,-0.4 -1,-0.3 0.505 104.6-131.8 -89.5 -4.2 -9.3 34.0 43.5 122 122 A E T < 5 - 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