==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-APR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 13-JAN-11 2Y5J . COMPND 2 MOLECULE: DIHYDROPTEROATE SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BURKHOLDERIA CENOCEPACIA; . AUTHOR R.E.MORGAN,G.O.BATOT,J.M.DEMENT,V.A.RAO,T.C.EADSFORTH,W.N.HU . 269 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12262.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 184 68.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 32 11.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 9 3.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 18 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 83 30.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 2.6 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 1 0 0 1 1 0 0 0 2 0 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 1 3 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 0 PARALLEL BRIDGES PER LADDER . 1 1 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 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 3 A T 0 0 116 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 98.5 -8.3 -9.0 27.5 2 4 A F - 0 0 125 0, 0.0 240,-0.1 0, 0.0 0, 0.0 -0.834 360.0-130.0-122.3 159.5 -10.9 -8.0 24.9 3 5 A L - 0 0 76 -2,-0.3 14,-0.1 15,-0.0 2,-0.1 -0.973 11.6-133.6-121.3 120.2 -14.3 -9.7 25.0 4 6 A P - 0 0 13 0, 0.0 12,-0.6 0, 0.0 3,-0.1 -0.470 38.5 -97.2 -68.3 144.4 -15.9 -11.2 21.9 5 7 A A - 0 0 3 197,-0.6 239,-0.0 1,-0.1 198,-0.0 -0.166 46.3 -94.7 -60.1 149.1 -19.6 -10.3 21.4 6 8 A P - 0 0 54 0, 0.0 2,-0.5 0, 0.0 9,-0.2 -0.181 31.8-143.1 -67.8 159.3 -22.3 -12.7 22.7 7 9 A L E -A 14 0A 2 7,-2.6 7,-2.4 -3,-0.1 2,-0.5 -0.962 3.4-146.7-125.5 117.7 -23.9 -15.2 20.4 8 10 A Q E +A 13 0A 48 157,-2.6 112,-0.2 -2,-0.5 2,-0.2 -0.668 29.0 175.9 -69.8 123.3 -27.5 -16.1 20.7 9 11 A C E > -A 12 0A 0 3,-3.0 3,-1.6 -2,-0.5 2,-0.3 -0.560 45.3 -81.3-143.1 82.5 -27.4 -19.7 19.7 10 12 A G T 3 S+ 0 0 2 107,-2.5 -1,-0.2 1,-0.3 86,-0.1 -0.501 115.3 2.3 71.0-125.5 -30.6 -21.7 19.8 11 13 A R T 3 S+ 0 0 67 -2,-0.3 2,-0.4 83,-0.1 -1,-0.3 0.642 127.1 70.6 -63.5 -17.9 -31.3 -22.9 23.4 12 14 A F E < -A 9 0A 34 -3,-1.6 -3,-3.0 84,-0.1 2,-0.7 -0.829 63.2-152.2-121.1 134.4 -28.2 -21.1 24.7 13 15 A E E -A 8 0A 154 -2,-0.4 2,-0.5 -5,-0.2 -5,-0.2 -0.930 33.5-158.4 -96.8 117.4 -27.2 -17.5 25.2 14 16 A L E -A 7 0A 18 -7,-2.4 -7,-2.6 -2,-0.7 2,-0.3 -0.850 13.4-174.9-112.3 135.8 -23.4 -17.9 24.8 15 17 A T - 0 0 71 -2,-0.5 3,-0.4 -9,-0.2 2,-0.3 -0.946 20.5-137.7-131.2 147.5 -21.0 -15.4 26.2 16 18 A F + 0 0 2 -12,-0.6 -2,-0.0 -2,-0.3 4,-0.0 -0.329 52.1 133.8-114.1 48.4 -17.3 -15.4 25.7 17 19 A E S S+ 0 0 111 -2,-0.3 -1,-0.2 1,-0.2 227,-0.0 0.824 96.6 18.9 -56.4 -38.4 -15.6 -14.6 29.0 18 20 A R S S- 0 0 113 -3,-0.4 -1,-0.2 226,-0.1 -3,-0.1 -0.982 102.9-105.7-123.0 147.6 -13.5 -17.6 27.9 19 21 A P - 0 0 10 0, 0.0 2,-0.2 0, 0.0 226,-0.2 -0.385 40.1-124.7 -71.8 156.5 -13.4 -18.8 24.4 20 22 A L E -b 245 0B 15 224,-2.3 226,-2.0 25,-0.0 2,-0.6 -0.646 9.1-127.6-105.6 158.1 -15.3 -22.0 23.8 21 23 A V E -b 246 0B 2 22,-0.3 24,-2.6 -2,-0.2 25,-1.4 -0.854 11.7-159.8-107.5 123.3 -14.4 -25.3 22.3 22 24 A M E -bc 247 46B 0 224,-2.6 226,-2.9 -2,-0.6 2,-0.3 -0.848 14.0-151.2 -95.8 108.3 -16.3 -26.9 19.4 23 25 A G E -bc 248 47B 0 23,-2.1 25,-3.2 -2,-0.8 2,-0.6 -0.588 10.9-134.0 -75.7 136.8 -15.6 -30.7 19.3 24 26 A I E - c 0 48B 12 224,-1.9 25,-0.1 -2,-0.3 227,-0.1 -0.832 20.8-173.4 -94.7 119.9 -15.9 -32.2 15.8 25 27 A L 0 0 7 23,-2.1 -1,-0.2 -2,-0.6 24,-0.2 0.992 360.0 360.0 -81.7 -64.1 -17.9 -35.5 16.0 26 28 A N 0 0 89 22,-0.6 -2,-0.1 6,-0.0 23,-0.1 0.970 360.0 360.0 -60.9 360.0 -17.7 -37.1 12.5 27 ! 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 28 42 A A > 0 0 99 0, 0.0 4,-1.4 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 131.1 -22.0 -46.1 12.8 29 43 A R H > + 0 0 163 2,-0.2 4,-0.6 1,-0.2 0, 0.0 0.754 360.0 41.4 -78.1 -31.0 -24.7 -44.4 14.9 30 44 A D H > S+ 0 0 105 2,-0.2 4,-1.8 1,-0.1 5,-0.3 0.838 106.4 64.1 -83.8 -39.7 -23.9 -45.7 18.4 31 45 A D H > S+ 0 0 72 1,-0.2 4,-1.1 2,-0.2 -2,-0.2 0.945 111.7 38.5 -37.3 -56.6 -20.1 -45.3 17.7 32 46 A A H X S+ 0 0 2 -4,-1.4 4,-0.7 1,-0.2 -1,-0.2 0.633 103.8 69.6 -82.0 -16.7 -21.0 -41.6 17.6 33 47 A L H >< S+ 0 0 58 -4,-0.6 3,-0.8 1,-0.2 4,-0.3 0.987 112.3 29.2 -59.7 -57.4 -23.5 -41.5 20.4 34 48 A R H 3X S+ 0 0 127 -4,-1.8 4,-1.9 1,-0.2 3,-0.5 0.655 105.9 73.2 -86.6 -14.0 -20.9 -42.1 23.1 35 49 A R H 3X S+ 0 0 89 -4,-1.1 4,-1.3 -5,-0.3 -1,-0.2 0.784 101.2 50.1 -56.8 -27.8 -18.1 -40.4 21.2 36 50 A A H S+ 0 0 94 -3,-0.5 4,-1.5 -4,-0.3 -2,-0.2 0.877 109.0 48.6 -79.9 -38.2 -20.3 -38.2 25.8 38 52 A R H X S+ 0 0 166 -4,-1.9 4,-3.3 2,-0.2 -2,-0.2 0.924 108.4 53.3 -56.4 -49.8 -16.5 -38.4 25.9 39 53 A M H <>S+ 0 0 25 -4,-1.3 5,-2.9 1,-0.3 4,-0.2 0.888 109.5 47.8 -59.0 -45.8 -16.2 -35.0 24.1 40 54 A I H ><5S+ 0 0 56 -4,-1.3 3,-1.0 3,-0.2 -1,-0.3 0.862 113.0 48.7 -58.1 -39.8 -18.4 -33.3 26.7 41 55 A A H 3<5S+ 0 0 83 -4,-1.5 -2,-0.2 1,-0.3 -1,-0.2 0.936 106.6 56.8 -70.8 -46.2 -16.4 -34.9 29.5 42 56 A E T 3<5S- 0 0 73 -4,-3.3 -1,-0.3 1,-0.1 -2,-0.2 0.473 132.5 -91.4 -54.9 -10.0 -13.1 -33.8 27.8 43 57 A G T < 5 + 0 0 24 -3,-1.0 -22,-0.3 1,-0.3 -3,-0.2 0.511 68.3 159.3 107.0 4.3 -14.4 -30.2 28.0 44 58 A A < - 0 0 6 -5,-2.9 -1,-0.3 -6,-0.2 -22,-0.2 -0.445 21.2-170.0 -56.2 131.7 -16.2 -29.7 24.7 45 59 A D S S+ 0 0 34 -24,-2.6 2,-0.3 1,-0.2 -23,-0.2 0.591 73.4 17.9-101.5 -15.2 -18.7 -26.8 25.0 46 60 A L E S-c 22 0B 0 -25,-1.4 -23,-2.1 29,-0.1 2,-0.4 -0.931 72.1-136.5-147.4 161.8 -20.4 -27.5 21.6 47 61 A L E -cd 23 77B 0 29,-1.7 31,-2.8 -2,-0.3 2,-0.8 -0.996 9.4-146.3-129.4 131.6 -20.6 -30.5 19.3 48 62 A D E -cd 24 78B 1 -25,-3.2 -23,-2.1 -2,-0.4 2,-1.0 -0.840 10.4-163.5-107.2 103.1 -20.2 -30.3 15.6 49 63 A I E d 0 79B 1 29,-2.4 31,-1.5 -2,-0.8 -25,-0.1 -0.708 360.0 360.0 -85.0 100.6 -22.4 -32.9 13.9 50 64 A G 0 0 42 -2,-1.0 31,-0.1 29,-0.2 29,-0.1 -0.760 360.0 360.0-106.1 360.0 -21.1 -33.1 10.3 51 ! 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 52 73 A P 0 0 183 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 156.3 -18.1 -37.0 -3.4 53 74 A P - 0 0 96 0, 0.0 0, 0.0 0, 0.0 0, 0.0 -0.537 360.0 -89.0-109.6-168.8 -21.1 -35.6 -1.3 54 75 A V - 0 0 47 -2,-0.2 0, 0.0 1,-0.1 0, 0.0 -0.830 21.1-107.8-123.8 144.7 -24.4 -37.2 -0.4 55 76 A P >> - 0 0 72 0, 0.0 4,-3.0 0, 0.0 3,-1.3 -0.268 34.7-124.3 -49.3 133.8 -28.1 -37.8 -1.3 56 77 A L H 3> S+ 0 0 79 1,-0.3 4,-2.8 2,-0.2 5,-0.3 0.929 114.3 61.4 -52.2 -48.0 -30.5 -35.8 0.8 57 78 A D H 3> S+ 0 0 139 1,-0.2 4,-0.8 2,-0.2 -1,-0.3 0.800 114.9 34.1 -37.4 -45.0 -32.2 -39.2 1.6 58 79 A E H <> S+ 0 0 100 -3,-1.3 4,-2.0 2,-0.2 5,-0.3 0.885 111.5 56.2 -84.0 -53.2 -28.8 -40.2 3.2 59 80 A E H X S+ 0 0 19 -4,-3.0 4,-1.3 1,-0.2 5,-0.2 0.897 112.7 48.0 -50.4 -37.3 -27.5 -37.0 4.6 60 81 A L H X S+ 0 0 44 -4,-2.8 4,-1.9 -5,-0.3 -1,-0.2 0.868 106.7 53.6 -72.3 -38.7 -30.8 -36.8 6.6 61 82 A A H < S+ 0 0 48 -4,-0.8 -1,-0.2 -5,-0.3 -2,-0.2 0.852 115.4 41.7 -60.4 -37.2 -30.7 -40.4 7.8 62 83 A R H < S+ 0 0 96 -4,-2.0 4,-0.3 2,-0.1 -1,-0.2 0.701 123.1 34.3 -90.6 -20.3 -27.3 -39.9 9.3 63 84 A V H X S+ 0 0 5 -4,-1.3 4,-1.7 -5,-0.3 -3,-0.2 0.857 106.8 59.3-103.0 -45.6 -27.7 -36.4 10.8 64 85 A I H X S+ 0 0 28 -4,-1.9 4,-1.4 -5,-0.2 5,-0.2 0.847 104.3 49.7 -61.0 -40.1 -31.3 -36.0 12.1 65 86 A P H > S+ 0 0 53 0, 0.0 4,-4.1 0, 0.0 -1,-0.2 0.908 107.2 57.0 -61.9 -45.9 -31.2 -39.0 14.6 66 87 A L H > S+ 0 0 10 -4,-0.3 4,-1.7 1,-0.2 -2,-0.2 0.877 104.5 51.5 -49.3 -45.7 -28.0 -37.6 16.0 67 88 A V H X S+ 0 0 0 -4,-1.7 4,-0.8 2,-0.2 -1,-0.2 0.889 116.6 39.5 -60.8 -38.7 -29.7 -34.3 16.8 68 89 A E H < S+ 0 0 112 -4,-1.4 -2,-0.2 1,-0.2 3,-0.2 0.867 113.7 55.8 -79.5 -38.4 -32.6 -36.0 18.6 69 90 A A H < S+ 0 0 51 -4,-4.1 -2,-0.2 1,-0.2 -1,-0.2 0.808 119.7 30.7 -56.9 -32.5 -30.1 -38.5 20.2 70 91 A L H >< S+ 0 0 0 -4,-1.7 3,-0.8 -5,-0.2 5,-0.4 0.375 89.5 98.1-112.8 -3.3 -28.0 -35.7 21.7 71 92 A R G >< S+ 0 0 103 -4,-0.8 3,-1.0 1,-0.2 -1,-0.1 0.844 82.5 53.9 -51.6 -36.9 -30.7 -33.0 22.3 72 93 A P G 3 S+ 0 0 105 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.705 86.2 76.9 -86.5 -14.7 -31.0 -33.9 26.0 73 94 A L G < S- 0 0 72 -3,-0.8 -2,-0.1 2,-0.1 -3,-0.1 0.645 96.9-136.6 -54.8 -20.4 -27.3 -33.7 26.9 74 95 A N < + 0 0 103 -3,-1.0 -3,-0.1 -4,-0.4 -1,-0.1 0.864 57.5 125.8 58.4 42.7 -28.0 -29.9 26.8 75 96 A V S S- 0 0 12 -5,-0.4 -1,-0.2 -4,-0.1 -29,-0.1 -0.995 74.5 -84.7-119.5 141.6 -24.9 -28.6 25.0 76 97 A P - 0 0 9 0, 0.0 -29,-1.7 0, 0.0 2,-0.5 -0.097 45.2-154.0 -41.6 127.2 -25.1 -26.4 21.9 77 98 A L E -d 47 0B 0 -31,-0.2 19,-2.0 17,-0.1 20,-1.1 -0.953 10.5-162.1-115.3 127.1 -25.4 -28.8 18.9 78 99 A S E -de 48 97B 0 -31,-2.8 -29,-2.4 -2,-0.5 2,-0.5 -0.852 8.6-143.9-120.9 145.2 -24.1 -27.4 15.6 79 100 A I E -de 49 98B 1 18,-2.9 20,-3.7 -2,-0.3 2,-1.0 -0.927 1.0-155.5-113.8 128.7 -24.8 -28.5 12.0 80 101 A D E + e 0 99B 51 -31,-1.5 2,-0.3 -2,-0.5 20,-0.2 -0.795 51.1 117.8 -99.6 91.0 -22.2 -28.5 9.3 81 102 A T - 0 0 6 18,-1.6 -2,-0.1 -2,-1.0 21,-0.1 -0.983 46.9-169.3-155.2 152.1 -24.3 -28.2 6.2 82 103 A Y + 0 0 40 -2,-0.3 24,-0.2 18,-0.1 27,-0.1 0.376 64.2 105.1-116.3 -13.7 -25.0 -25.9 3.2 83 104 A K >> - 0 0 41 1,-0.1 4,-2.3 25,-0.0 3,-1.1 -0.659 63.0-149.9 -71.5 105.2 -28.1 -27.7 2.0 84 105 A P H 3> S+ 0 0 27 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.801 97.8 56.1 -39.7 -44.0 -31.3 -25.8 2.9 85 106 A A H 3> S+ 0 0 41 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.872 110.0 46.8 -59.7 -41.2 -33.3 -29.0 3.2 86 107 A V H <> S+ 0 0 0 -3,-1.1 4,-2.4 2,-0.2 -1,-0.2 0.903 113.6 47.9 -63.5 -43.5 -30.8 -30.2 5.7 87 108 A M H X S+ 0 0 0 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.897 111.4 50.4 -65.0 -41.1 -30.9 -26.9 7.6 88 109 A R H X S+ 0 0 136 -4,-2.7 4,-1.2 -5,-0.2 -1,-0.2 0.908 115.7 42.0 -60.7 -48.9 -34.7 -26.9 7.6 89 110 A A H X S+ 0 0 30 -4,-2.0 4,-2.4 -5,-0.2 -2,-0.2 0.915 112.5 51.9 -65.5 -48.8 -34.9 -30.4 9.0 90 111 A A H <>S+ 0 0 0 -4,-2.4 5,-1.3 1,-0.3 -2,-0.2 0.891 108.2 51.8 -63.8 -38.8 -32.1 -30.0 11.6 91 112 A L H ><5S+ 0 0 40 -4,-2.0 3,-1.4 -5,-0.2 -1,-0.3 0.892 109.1 51.0 -64.4 -35.9 -33.6 -26.9 13.0 92 113 A A H 3<5S+ 0 0 89 -4,-1.2 -2,-0.2 1,-0.3 -1,-0.2 0.890 105.8 54.4 -70.7 -36.4 -37.0 -28.6 13.4 93 114 A A T 3<5S- 0 0 19 -4,-2.4 -1,-0.3 -5,-0.1 -2,-0.2 0.450 130.3 -98.5 -73.6 5.3 -35.3 -31.5 15.2 94 115 A G T < 5 + 0 0 15 -3,-1.4 2,-0.3 1,-0.2 -3,-0.2 0.895 60.7 165.3 75.7 48.7 -33.9 -28.8 17.6 95 116 A A < - 0 0 7 -5,-1.3 -1,-0.2 -8,-0.1 -17,-0.2 -0.690 27.1-149.0 -85.0 150.8 -30.3 -28.1 16.4 96 117 A D + 0 0 4 -19,-2.0 23,-3.4 -2,-0.3 2,-0.3 0.599 68.8 21.6 -98.8 -15.5 -28.8 -24.9 18.0 97 118 A L E -ef 78 119B 0 -20,-1.1 -18,-2.9 21,-0.3 2,-0.5 -0.975 61.2-141.5-159.1 136.1 -26.5 -23.5 15.3 98 119 A I E -ef 79 120B 0 21,-2.9 23,-3.3 -2,-0.3 2,-0.6 -0.910 10.9-162.6-108.4 129.0 -26.0 -23.8 11.6 99 120 A N E -ef 80 121B 4 -20,-3.7 -18,-1.6 -2,-0.5 2,-0.6 -0.934 13.8-177.4-111.1 109.3 -22.4 -23.9 10.2 100 121 A D E > - f 0 122B 0 21,-2.1 3,-2.2 -2,-0.6 23,-1.7 -0.877 25.5-169.2-127.4 106.0 -22.4 -23.1 6.5 101 122 A I T 3 S+ 0 0 31 -2,-0.6 -1,-0.1 1,-0.3 -19,-0.1 0.790 92.5 61.0 -51.5 -28.3 -19.3 -23.2 4.3 102 123 A W T 3 S- 0 0 6 -3,-0.1 -1,-0.3 22,-0.1 3,-0.2 0.592 108.4-121.2 -90.9 -4.2 -21.4 -21.6 1.6 103 124 A G < - 0 0 0 -3,-2.2 19,-0.1 1,-0.2 -2,-0.1 0.791 66.3 -64.4 79.6 24.0 -22.3 -18.4 3.5 104 125 A F S S+ 0 0 4 17,-0.1 6,-0.4 -4,-0.1 -1,-0.2 0.892 105.9 128.8 57.1 42.1 -26.0 -19.1 3.3 105 126 A R + 0 0 63 -3,-0.2 -2,-0.1 4,-0.1 3,-0.1 0.660 28.9 103.5 -99.1 -23.1 -25.7 -18.7 -0.5 106 127 A Q S > S- 0 0 23 -24,-0.2 3,-2.4 1,-0.1 4,-0.4 -0.444 93.4 -87.5 -61.1 140.7 -27.4 -21.8 -1.8 107 128 A P T 3 S+ 0 0 121 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.264 115.0 14.8 -57.6 127.8 -30.9 -20.9 -3.0 108 129 A G T 3> S+ 0 0 42 -4,-0.1 4,-2.9 -3,-0.1 5,-0.2 0.239 91.2 113.7 90.5 -12.0 -33.3 -21.0 -0.1 109 130 A A H <> S+ 0 0 0 -3,-2.4 4,-0.9 1,-0.2 -4,-0.1 0.926 79.0 45.9 -63.2 -48.0 -30.7 -21.2 2.7 110 131 A I H >> S+ 0 0 35 -6,-0.4 4,-0.9 -4,-0.4 3,-0.8 0.911 113.2 50.5 -62.1 -41.5 -31.6 -17.8 4.1 111 132 A D H 34 S+ 0 0 74 1,-0.2 3,-0.5 2,-0.2 4,-0.3 0.888 105.9 56.9 -63.2 -41.7 -35.3 -18.6 4.0 112 133 A A H 3< S+ 0 0 12 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.747 119.7 27.9 -60.8 -20.9 -34.7 -22.0 5.8 113 134 A V H << S+ 0 0 0 -4,-0.9 -1,-0.2 -3,-0.8 -2,-0.2 0.420 86.8 97.2-124.3 3.6 -33.0 -20.3 8.8 114 135 A R S < S+ 0 0 89 -4,-0.9 2,-0.2 -3,-0.5 -3,-0.1 0.691 77.7 74.5 -73.2 -15.1 -34.5 -16.7 9.2 115 136 A D S S+ 0 0 108 -4,-0.3 3,-0.4 -3,-0.1 46,-0.0 -0.521 85.6 11.6 -93.1 159.7 -36.9 -18.0 11.8 116 137 A G S S- 0 0 61 -2,-0.2 -3,-0.0 1,-0.2 -25,-0.0 -0.246 92.9 -66.6 82.6-162.4 -36.3 -18.9 15.4 117 138 A N S S+ 0 0 84 45,-0.1 -107,-2.5 2,-0.0 -1,-0.2 0.304 74.7 139.3-112.8 2.3 -33.4 -18.4 17.7 118 139 A S - 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