==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-APR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/TRANSFERASE INHIBITOR 24-FEB-12 4DWB . COMPND 2 MOLECULE: FARNESYL PYROPHOSPHATE SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: TRYPANOSOMA CRUZI; . AUTHOR S.ARIPIRALA,L.M.AMZEL,S.B.GABELLI . 361 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17289.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 286 79.2 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 . 5 1.4 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 . 1 0.3 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 . 3 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 229 63.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 2.8 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 2 0 0 1 0 0 2 1 0 1 0 2 1 0 0 0 0 0 0 3 1 1 0 0 0 0 1 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 . 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 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 0 179 0, 0.0 4,-1.5 0, 0.0 3,-0.5 0.000 360.0 360.0 360.0 142.2 -10.0 3.0 172.3 2 2 A A H 3> + 0 0 59 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.804 360.0 58.0 -64.3 -31.6 -12.6 4.2 169.8 3 3 A S H 3> S+ 0 0 10 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.855 103.7 51.5 -70.4 -33.2 -11.9 7.9 170.6 4 4 A M H <> S+ 0 0 70 -3,-0.5 4,-2.5 2,-0.2 -1,-0.2 0.835 108.5 51.7 -73.9 -35.8 -8.3 7.6 169.7 5 5 A E H X S+ 0 0 125 -4,-1.5 4,-1.5 2,-0.2 -2,-0.2 0.917 110.3 48.2 -64.1 -43.8 -9.2 6.0 166.3 6 6 A R H X S+ 0 0 136 -4,-2.1 4,-1.3 2,-0.2 -2,-0.2 0.883 111.4 52.0 -60.0 -39.3 -11.7 8.9 165.6 7 7 A F H X S+ 0 0 1 -4,-2.0 4,-1.4 1,-0.2 3,-0.4 0.927 109.8 49.0 -62.6 -44.7 -8.8 11.3 166.6 8 8 A L H X S+ 0 0 33 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.759 103.2 60.7 -65.1 -28.2 -6.5 9.5 164.2 9 9 A S H X S+ 0 0 65 -4,-1.5 4,-2.0 2,-0.2 -1,-0.2 0.843 102.3 51.7 -67.8 -34.1 -9.2 9.8 161.5 10 10 A V H X S+ 0 0 6 -4,-1.3 4,-2.2 -3,-0.4 -2,-0.2 0.894 106.6 55.8 -67.7 -35.7 -9.0 13.7 161.8 11 11 A Y H X S+ 0 0 2 -4,-1.4 4,-3.2 2,-0.2 5,-0.2 0.910 106.7 48.7 -60.2 -46.5 -5.2 13.3 161.3 12 12 A D H X S+ 0 0 92 -4,-1.9 4,-2.9 1,-0.2 -1,-0.2 0.912 111.6 49.6 -59.7 -43.3 -5.7 11.4 158.0 13 13 A E H X S+ 0 0 85 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.895 114.4 45.5 -59.4 -37.8 -8.1 14.0 156.9 14 14 A V H X S+ 0 0 0 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.907 112.5 48.9 -77.0 -40.6 -5.5 16.7 157.8 15 15 A Q H X S+ 0 0 18 -4,-3.2 4,-2.3 2,-0.2 5,-0.3 0.948 112.2 49.8 -63.0 -45.8 -2.6 14.9 156.3 16 16 A A H X S+ 0 0 46 -4,-2.9 4,-1.8 -5,-0.2 5,-0.2 0.909 110.7 49.2 -63.6 -37.7 -4.6 14.4 153.1 17 17 A F H X S+ 0 0 45 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.944 113.6 48.3 -62.7 -41.1 -5.6 18.2 153.0 18 18 A L H X S+ 0 0 1 -4,-2.5 4,-1.7 1,-0.2 -2,-0.2 0.853 113.6 42.6 -68.9 -40.9 -1.9 19.2 153.5 19 19 A L H X S+ 0 0 21 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.838 112.6 53.0 -76.3 -35.8 -0.3 17.0 150.9 20 20 A D H X S+ 0 0 92 -4,-1.8 4,-2.4 -5,-0.3 5,-0.2 0.858 108.9 52.0 -68.2 -34.6 -3.0 17.7 148.3 21 21 A Q H X>S+ 0 0 39 -4,-1.9 4,-2.6 -5,-0.2 5,-0.8 0.913 107.7 50.8 -63.6 -45.4 -2.3 21.4 148.9 22 22 A L H X5S+ 0 0 30 -4,-1.7 6,-2.2 3,-0.2 4,-0.8 0.875 114.2 45.9 -63.0 -34.5 1.4 20.8 148.4 23 23 A Q H <5S+ 0 0 130 -4,-2.1 4,-0.2 4,-0.2 -2,-0.2 0.906 122.0 33.3 -72.3 -43.0 0.6 19.0 145.0 24 24 A S H <5S+ 0 0 86 -4,-2.4 -2,-0.2 2,-0.1 -3,-0.2 0.713 135.7 21.6 -87.0 -25.8 -2.0 21.5 143.7 25 25 A K H <5S+ 0 0 149 -4,-2.6 -3,-0.2 -5,-0.2 -2,-0.1 0.611 125.7 44.2-116.8 -19.4 -0.4 24.8 145.1 26 26 A Y S <> - 0 0 50 1,-0.1 4,-2.2 -2,-0.1 3,-0.7 -0.644 24.6-105.4 -93.3 159.3 6.2 15.9 143.1 30 30 A P H 3> S+ 0 0 103 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.793 115.6 54.9 -56.0 -31.2 5.1 12.5 144.4 31 31 A N H 3> S+ 0 0 125 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.912 113.9 40.3 -70.9 -38.9 8.5 11.4 145.7 32 32 A R H <> S+ 0 0 163 -3,-0.7 4,-1.9 2,-0.2 -1,-0.2 0.728 113.1 55.9 -78.1 -26.4 8.8 14.5 147.9 33 33 A A H X S+ 0 0 22 -4,-2.2 4,-1.6 2,-0.2 -2,-0.2 0.902 110.4 46.3 -64.4 -42.0 5.1 14.2 148.8 34 34 A R H X S+ 0 0 136 -4,-2.3 4,-2.3 -5,-0.2 5,-0.3 0.923 109.2 52.9 -68.2 -43.7 6.0 10.7 149.9 35 35 A Y H X S+ 0 0 63 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.905 112.1 45.8 -62.8 -38.7 9.0 11.8 151.9 36 36 A L H X S+ 0 0 19 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.763 109.4 54.9 -72.3 -26.7 6.9 14.4 153.8 37 37 A R H X S+ 0 0 89 -4,-1.6 4,-2.8 2,-0.2 -2,-0.2 0.924 112.3 42.8 -70.4 -41.0 4.0 12.0 154.4 38 38 A I H X S+ 0 0 52 -4,-2.3 4,-3.4 2,-0.2 5,-0.3 0.899 113.3 52.8 -69.9 -38.5 6.5 9.5 156.1 39 39 A M H X S+ 0 0 0 -4,-1.9 4,-2.2 -5,-0.3 5,-0.2 0.963 111.6 46.3 -63.5 -48.2 8.2 12.4 157.9 40 40 A M H X S+ 0 0 0 -4,-2.1 4,-2.1 2,-0.2 5,-0.3 0.926 116.3 45.0 -53.0 -52.2 4.8 13.5 159.2 41 41 A D H X S+ 0 0 48 -4,-2.8 4,-1.9 1,-0.2 -2,-0.2 0.927 114.6 47.7 -60.5 -47.3 3.8 9.9 160.2 42 42 A T H < S+ 0 0 28 -4,-3.4 -1,-0.2 1,-0.2 -2,-0.2 0.826 120.7 36.2 -66.3 -33.1 7.2 9.1 161.8 43 43 A T H < S+ 0 0 11 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.701 124.8 35.8 -95.9 -23.5 7.3 12.4 163.8 44 44 A C H < S+ 0 0 0 -4,-2.1 3,-0.2 -5,-0.2 -3,-0.2 0.715 109.5 56.8-101.2 -24.1 3.6 12.8 164.8 45 45 A L S < S+ 0 0 38 -4,-1.9 3,-0.1 -5,-0.3 4,-0.0 -0.521 78.2 57.6-111.1 166.2 2.2 9.3 165.4 46 46 A G S S+ 0 0 56 1,-0.3 -1,-0.1 -2,-0.2 -4,-0.1 0.010 84.2 99.1 100.5 -31.9 3.4 6.5 167.7 47 47 A G S S- 0 0 23 -3,-0.2 -1,-0.3 1,-0.1 -3,-0.0 0.114 90.2 -97.7 -71.8-168.3 3.0 8.5 171.0 48 48 A K - 0 0 131 -3,-0.1 -1,-0.1 0, 0.0 5,-0.1 0.592 40.2-133.7 -86.0 -14.9 0.1 8.5 173.4 49 49 A Y > + 0 0 15 3,-0.1 4,-3.1 4,-0.0 5,-0.3 0.713 53.9 149.0 62.6 24.9 -1.7 11.6 172.0 50 50 A F H > + 0 0 32 2,-0.2 4,-1.4 1,-0.2 38,-0.0 0.931 68.7 42.9 -51.7 -57.7 -2.1 12.8 175.5 51 51 A R H > S+ 0 0 21 2,-0.2 4,-1.1 1,-0.2 3,-0.4 0.960 117.8 45.1 -51.7 -56.7 -1.9 16.5 174.6 52 52 A G H >> S+ 0 0 0 1,-0.2 4,-1.0 2,-0.2 3,-0.6 0.916 114.5 49.1 -56.8 -43.0 -4.2 16.2 171.5 53 53 A M H 3X S+ 0 0 43 -4,-3.1 4,-2.5 1,-0.3 -1,-0.2 0.677 100.0 65.0 -72.7 -24.5 -6.7 14.0 173.3 54 54 A T H 3X S+ 0 0 8 -4,-1.4 4,-2.7 -3,-0.4 -1,-0.3 0.906 98.1 54.3 -64.5 -38.8 -6.9 16.3 176.2 55 55 A V H X S+ 0 0 16 -4,-2.2 3,-0.7 1,-0.2 4,-0.7 0.932 110.8 45.7 -55.9 -55.2 -17.1 17.8 179.1 62 62 A F H >< S+ 0 0 23 -4,-1.8 3,-1.0 1,-0.2 4,-0.4 0.888 108.7 56.3 -54.6 -39.9 -18.7 21.0 177.9 63 63 A L H 3< S+ 0 0 23 -4,-2.5 3,-0.2 1,-0.2 -1,-0.2 0.723 101.6 59.0 -69.4 -20.3 -20.8 19.1 175.3 64 64 A A H << S+ 0 0 88 -4,-1.3 -1,-0.2 -3,-0.7 -2,-0.2 0.708 116.1 32.1 -75.9 -24.4 -22.3 16.9 178.1 65 65 A V S << S+ 0 0 91 -3,-1.0 2,-0.4 -4,-0.7 -1,-0.2 0.275 108.6 80.8-112.4 5.7 -23.7 19.9 180.0 66 66 A T S S- 0 0 53 -4,-0.4 2,-0.5 -3,-0.2 0, 0.0 -0.948 74.9-119.4-131.4 134.4 -24.5 22.2 177.1 67 67 A Q + 0 0 174 -2,-0.4 2,-0.3 -3,-0.0 -3,-0.1 -0.609 48.8 144.0 -77.1 121.8 -27.4 22.6 174.6 68 68 A H - 0 0 47 -2,-0.5 2,-0.1 -5,-0.1 -2,-0.0 -0.973 50.0-106.7-145.6 151.2 -26.3 22.1 170.9 69 69 A D > - 0 0 115 -2,-0.3 4,-1.4 1,-0.1 3,-0.5 -0.463 42.7-106.9 -59.8 154.2 -27.7 20.7 167.7 70 70 A E H >> S+ 0 0 137 1,-0.2 4,-2.3 2,-0.2 3,-1.2 0.926 120.6 55.2 -48.2 -54.0 -26.0 17.4 166.6 71 71 A A H 3> S+ 0 0 63 1,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.799 106.2 50.8 -52.7 -38.3 -24.2 19.3 163.8 72 72 A T H 3> S+ 0 0 32 -3,-0.5 4,-2.7 2,-0.2 -1,-0.3 0.772 108.3 53.3 -68.7 -29.0 -22.7 21.7 166.2 73 73 A K H S+ 0 0 6 -4,-2.4 5,-1.3 2,-0.2 4,-0.4 0.820 109.8 49.1 -64.0 -33.9 16.8 15.3 169.5 100 100 A I H ><5S+ 0 0 38 -4,-1.2 3,-0.9 1,-0.2 -2,-0.2 0.972 118.6 42.3 -61.3 -48.1 19.3 17.0 167.2 101 101 A M H 3<5S+ 0 0 91 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.675 113.2 48.2 -73.0 -27.3 20.2 19.3 170.2 102 102 A D T 3<5S- 0 0 23 -4,-2.1 -1,-0.2 -5,-0.1 -3,-0.1 0.453 107.2-120.1 -96.7 2.2 20.3 16.8 173.0 103 103 A G T < 5 + 0 0 52 -3,-0.9 -3,-0.2 -4,-0.4 -4,-0.1 0.718 53.8 174.7 65.0 28.0 22.5 14.4 171.0 104 104 A S < - 0 0 13 -5,-1.3 -1,-0.2 -6,-0.2 8,-0.1 -0.148 30.3-168.1 -78.6 153.5 19.8 11.7 171.3 105 105 A V + 0 0 62 160,-0.3 7,-1.7 1,-0.3 2,-0.3 0.844 65.1 22.5-105.2 -38.9 19.6 8.3 169.6 106 106 A M E +A 111 0A 60 5,-0.3 2,-0.3 159,-0.2 -1,-0.3 -0.911 50.4 175.9-130.9 154.4 16.1 6.8 170.1 107 107 A R E > S-A 110 0A 50 3,-3.5 3,-2.1 -2,-0.3 157,-0.2 -0.943 71.3 -1.2-154.4 141.6 12.5 7.9 170.7 108 108 A R T 3 S- 0 0 74 154,-0.3 156,-0.2 1,-0.3 155,-0.1 0.844 131.0 -54.0 50.7 36.9 9.1 6.1 170.9 109 109 A G T 3 S+ 0 0 49 154,-2.6 -1,-0.3 1,-0.2 155,-0.1 0.430 124.8 81.8 84.1 3.6 10.9 2.8 170.1 110 110 A K E < S-A 107 0A 102 -3,-2.1 -3,-3.5 153,-0.4 -1,-0.2 -0.855 89.5 -80.8-135.6 162.1 12.6 4.1 166.9 111 111 A P E -A 106 0A 53 0, 0.0 -5,-0.3 0, 0.0 5,-0.1 -0.401 59.0 -94.3 -64.0 144.7 15.6 6.1 165.9 112 112 A C >> - 0 0 3 -7,-1.7 3,-2.0 1,-0.1 4,-0.5 -0.261 41.9-106.0 -50.9 142.7 15.2 9.9 166.2 113 113 A W G >4 S+ 0 0 15 1,-0.3 3,-2.0 2,-0.2 7,-0.3 0.878 118.6 54.6 -40.4 -56.6 14.1 11.4 162.9 114 114 A Y G 34 S+ 0 0 44 1,-0.3 6,-0.8 -18,-0.2 -1,-0.3 0.722 102.9 60.0 -58.1 -18.9 17.5 13.0 162.0 115 115 A R G <4 S+ 0 0 113 -3,-2.0 -1,-0.3 5,-0.1 -2,-0.2 0.541 73.6 112.3 -89.5 -9.1 19.2 9.6 162.5 116 116 A F S XX S- 0 0 50 -3,-2.0 3,-2.1 -4,-0.5 4,-1.1 -0.450 79.1-121.5 -57.9 136.6 17.1 7.9 159.7 117 117 A P T 34 S+ 0 0 131 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.868 109.1 45.5 -60.6 -38.3 19.7 7.1 156.9 118 118 A G T 34 S+ 0 0 64 1,-0.1 -2,-0.1 2,-0.0 -3,-0.1 0.262 114.0 51.6 -83.7 14.2 17.9 9.1 154.2 119 119 A V T <> S+ 0 0 6 -3,-2.1 4,-1.2 -6,-0.1 -5,-0.1 0.814 70.6 174.4-109.8 -67.5 17.3 12.2 156.5 120 120 A T H X - 0 0 68 -4,-1.1 4,-2.3 -6,-0.8 3,-0.2 0.318 57.0 -74.6 70.9 161.0 20.4 13.6 158.3 121 121 A T H > S+ 0 0 58 1,-0.2 4,-2.2 2,-0.2 5,-0.3 0.906 128.7 65.4 -52.0 -41.9 20.6 16.7 160.5 122 122 A Q H > S+ 0 0 157 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.898 111.2 28.9 -50.0 -59.2 20.5 18.7 157.3 123 123 A C H X S+ 0 0 47 -4,-1.2 4,-2.7 -3,-0.2 3,-0.3 0.857 115.2 61.0 -69.2 -37.8 17.0 17.7 156.2 124 124 A A H X S+ 0 0 0 -4,-2.3 4,-3.1 1,-0.3 5,-0.2 0.822 97.3 57.7 -68.6 -35.0 15.6 17.2 159.7 125 125 A I H X S+ 0 0 73 -4,-2.2 4,-1.5 -5,-0.2 -1,-0.3 0.932 114.4 39.4 -55.1 -45.9 16.2 20.7 160.9 126 126 A N H X S+ 0 0 88 -4,-0.9 4,-2.4 -3,-0.3 -2,-0.2 0.871 111.5 57.5 -74.7 -38.1 14.1 21.9 158.0 127 127 A D H X S+ 0 0 7 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.890 106.4 50.8 -53.4 -43.6 11.6 19.1 158.4 128 128 A G H X S+ 0 0 0 -4,-3.1 4,-1.5 2,-0.2 -1,-0.2 0.886 108.2 51.5 -60.6 -41.8 11.1 20.3 162.0 129 129 A I H X S+ 0 0 89 -4,-1.5 4,-2.0 1,-0.2 -2,-0.2 0.893 107.8 52.1 -62.2 -42.5 10.4 23.8 160.7 130 130 A I H X S+ 0 0 43 -4,-2.4 4,-2.9 2,-0.2 -2,-0.2 0.910 102.2 62.0 -54.3 -43.6 7.8 22.4 158.3 131 131 A L H X S+ 0 0 0 -4,-2.0 4,-0.9 1,-0.2 -2,-0.2 0.909 107.4 42.3 -55.3 -47.9 6.1 20.6 161.2 132 132 A K H X S+ 0 0 47 -4,-1.5 4,-1.1 2,-0.2 3,-0.3 0.870 109.9 56.0 -67.1 -42.3 5.3 23.9 162.9 133 133 A S H >X S+ 0 0 68 -4,-2.0 4,-2.3 1,-0.2 3,-1.4 0.942 101.5 59.8 -48.1 -47.7 4.3 25.7 159.7 134 134 A W H 3X S+ 0 0 10 -4,-2.9 4,-2.7 1,-0.3 -1,-0.2 0.829 97.8 59.8 -58.1 -31.9 1.7 22.9 159.2 135 135 A T H 3X S+ 0 0 0 -4,-0.9 4,-1.6 -3,-0.3 -1,-0.3 0.839 107.7 43.9 -62.8 -33.8 0.2 23.9 162.5 136 136 A Q H < S+ 0 0 0 -4,-2.3 3,-2.3 -5,-0.5 6,-0.3 0.253 75.7 129.8-105.5 15.6 -10.7 27.7 161.8 144 144 A A T 3 S+ 0 0 58 -3,-0.3 -1,-0.2 1,-0.3 -2,-0.1 0.812 85.0 20.9 -31.4 -55.4 -11.1 30.3 158.9 145 145 A D T 3 S+ 0 0 130 -3,-0.2 -1,-0.3 4,-0.1 -2,-0.1 -0.005 90.4 123.9-118.6 34.7 -14.3 31.7 160.2 146 146 A R X - 0 0 53 -3,-2.3 3,-2.2 1,-0.1 4,-0.3 -0.749 62.4-132.3 -90.7 137.9 -14.5 30.7 163.9 147 147 A P T 3 S+ 0 0 106 0, 0.0 4,-0.3 0, 0.0 3,-0.3 0.767 107.3 57.2 -62.5 -18.1 -15.0 33.5 166.4 148 148 A F T 3> S+ 0 0 5 1,-0.2 4,-3.1 2,-0.1 5,-0.3 0.565 75.3 103.6 -88.2 -4.4 -12.1 32.0 168.4 149 149 A L H <> S+ 0 0 21 -3,-2.2 4,-2.5 -6,-0.3 -1,-0.2 0.830 83.4 41.6 -42.3 -54.7 -9.5 32.2 165.5 150 150 A K H > S+ 0 0 170 -3,-0.3 4,-2.6 -4,-0.3 -1,-0.2 0.920 116.2 47.3 -67.7 -48.0 -7.5 35.2 166.8 151 151 A D H > S+ 0 0 95 -4,-0.3 4,-2.4 1,-0.2 5,-0.2 0.907 113.0 50.7 -57.8 -42.2 -7.5 34.2 170.4 152 152 A L H X S+ 0 0 0 -4,-3.1 4,-2.7 2,-0.2 -2,-0.2 0.943 112.4 46.0 -64.8 -43.6 -6.5 30.6 169.5 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50.7 -56.6 -40.7 -11.7 22.4 194.4 338 338 A Q H >< S+ 0 0 108 -4,-1.5 3,-1.0 1,-0.2 4,-0.5 0.850 106.8 53.3 -69.5 -34.0 -11.2 26.1 193.5 339 339 A L H 3X S+ 0 0 2 -4,-2.1 4,-2.5 1,-0.2 3,-0.3 0.768 96.0 71.7 -69.1 -30.0 -12.1 25.4 189.8 340 340 A K T 3< S+ 0 0 93 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.746 84.6 68.7 -52.9 -23.8 -15.3 23.8 191.0 341 341 A V T <4 S+ 0 0 110 -3,-1.0 -1,-0.2 -4,-0.3 -2,-0.2 0.971 120.2 12.0 -67.4 -52.5 -16.7 27.2 192.0 342 342 A K T 4 S+ 0 0 127 -4,-0.5 -2,-0.2 -3,-0.3 -1,-0.2 0.810 141.2 29.5 -92.0 -33.1 -17.1 28.7 188.5 343 343 A S X + 0 0 6 -4,-2.5 4,-1.9 -5,-0.1 -1,-0.2 -0.755 50.4 165.7-137.2 87.1 -16.6 25.5 186.5 344 344 A P H > S+ 0 0 86 0, 0.0 4,-1.5 0, 0.0 -1,-0.1 0.894 84.9 52.7 -67.4 -35.9 -17.5 22.0 187.9 345 345 A T H > S+ 0 0 36 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.905 111.4 44.2 -63.1 -45.5 -17.3 20.4 184.4 346 346 A F H > S+ 0 0 0 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.872 107.6 60.8 -67.8 -39.5 -13.8 21.7 183.7 347 347 A A H X S+ 0 0 1 -4,-1.9 4,-2.0 -8,-0.3 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