==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-MAY-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 11-MAY-11 3RYW . COMPND 2 MOLECULE: FARNESYL PYROPHOSPHATE SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PLASMODIUM VIVAX; . AUTHOR J.H.NO,Y.-L.LIU,Y.ZHANG,E.OLDFIELD . 1427 13 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 55461.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1087 76.2 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 . 12 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 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 . 32 2.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 140 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 858 60.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 32 2.2 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 10 2 0 0 1 4 7 4 3 13 0 0 0 0 0 4 4 0 0 0 8 0 4 0 4 0 0 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 . 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 0 0 0 0 ANTIPARALLEL 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 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 34 A L 0 0 82 0, 0.0 4,-0.3 0, 0.0 56,-0.1 0.000 360.0 360.0 360.0 -55.5 25.9 -15.4 11.4 2 35 A A > + 0 0 71 2,-0.1 4,-1.0 3,-0.1 3,-0.1 0.490 360.0 73.8-102.1 -31.5 22.1 -15.0 12.1 3 36 A F H > S+ 0 0 67 1,-0.2 4,-0.9 2,-0.2 3,-0.3 0.846 89.2 64.2 -31.1 -45.5 22.9 -16.8 15.2 4 37 A F H >4 S+ 0 0 3 1,-0.2 3,-1.4 2,-0.2 4,-0.4 0.939 96.3 46.9 -61.9 -62.1 24.5 -13.5 16.3 5 38 A R H 34 S+ 0 0 102 -4,-0.3 3,-0.4 1,-0.3 -1,-0.2 0.763 114.7 50.4 -58.0 -23.7 21.5 -11.1 16.5 6 39 A N H 3< S+ 0 0 116 -4,-1.0 4,-0.3 -3,-0.3 3,-0.3 0.645 98.1 65.0 -89.8 -15.6 19.4 -13.7 18.4 7 40 A M S > S+ 0 0 12 -3,-0.4 4,-2.4 -4,-0.4 3,-0.9 0.961 81.7 49.6 -54.1 -58.4 21.9 -10.9 22.4 9 42 A D H 3> S+ 0 0 78 -3,-0.3 4,-2.7 1,-0.3 5,-0.3 0.834 105.0 60.6 -52.2 -38.1 19.3 -11.7 25.2 10 43 A K H 3> S+ 0 0 50 -4,-0.3 4,-1.8 2,-0.2 -1,-0.3 0.915 112.3 35.6 -56.5 -47.4 21.4 -14.6 26.4 11 44 A Y H < S+ 0 0 23 -4,-1.4 3,-1.1 -3,-0.5 -1,-0.2 0.915 109.1 49.4 -59.6 -44.0 25.3 -11.7 38.0 19 52 A L H >< S+ 0 0 5 -4,-1.7 3,-1.6 1,-0.2 -2,-0.2 0.881 103.6 61.6 -61.2 -38.2 23.9 -8.4 39.2 20 53 A N H 3< S+ 0 0 69 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.603 94.0 61.4 -69.5 -13.6 20.9 -10.1 40.7 21 54 A E T << S+ 0 0 144 -3,-1.1 -1,-0.3 -4,-0.5 -2,-0.2 0.351 78.8 115.1 -95.9 7.4 22.9 -12.3 43.1 22 55 A Y S < S- 0 0 12 -3,-1.6 2,-1.9 1,-0.1 7,-0.1 -0.420 83.6-101.6 -71.7 154.8 24.3 -9.3 44.9 23 56 A S S S+ 0 0 61 -2,-0.1 2,-0.3 1258,-0.1 -1,-0.1 -0.556 74.3 131.5 -79.2 82.5 23.3 -8.8 48.6 24 57 A L - 0 0 13 -2,-1.9 1254,-0.1 -4,-0.2 5,-0.1 -0.970 64.3 -94.5-133.3 148.7 20.7 -6.1 48.1 25 58 A E > - 0 0 82 -2,-0.3 4,-2.0 1252,-0.1 3,-0.2 -0.191 42.7-112.7 -55.6 154.1 17.1 -5.7 49.3 26 59 A E H > S+ 0 0 89 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.822 112.5 54.3 -70.7 -33.4 14.5 -7.0 46.8 27 60 A E H > S+ 0 0 89 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.875 111.0 48.3 -65.5 -35.8 12.9 -3.7 45.8 28 61 A I H > S+ 0 0 5 -3,-0.2 4,-2.8 2,-0.2 -2,-0.2 0.907 106.4 55.4 -70.6 -43.4 16.4 -2.3 44.9 29 62 A K H X S+ 0 0 36 -4,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.859 108.1 50.5 -53.9 -39.7 17.3 -5.4 42.9 30 63 A E H X S+ 0 0 26 -4,-1.5 4,-1.9 2,-0.2 -1,-0.2 0.911 111.8 46.4 -67.8 -43.3 14.2 -4.9 40.8 31 64 A H H X S+ 0 0 3 -4,-1.6 4,-2.1 2,-0.2 -2,-0.2 0.900 109.9 53.2 -66.3 -44.8 15.0 -1.2 40.1 32 65 A I H X S+ 0 0 5 -4,-2.8 4,-2.8 1,-0.2 5,-0.3 0.927 109.2 51.0 -51.5 -48.7 18.6 -2.0 39.3 33 66 A S H X S+ 0 0 30 -4,-1.9 4,-2.0 1,-0.2 -2,-0.2 0.871 107.0 50.9 -62.3 -43.6 17.4 -4.5 36.7 34 67 A K H X S+ 0 0 46 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.965 115.8 44.4 -54.6 -51.3 15.0 -2.1 35.0 35 68 A Y H X S+ 0 0 1 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.921 115.4 43.3 -62.3 -52.8 17.8 0.4 34.6 36 69 A Y H X S+ 0 0 0 -4,-2.8 4,-1.8 1,-0.2 -1,-0.2 0.800 110.0 57.4 -73.2 -24.5 20.6 -1.8 33.5 37 70 A K H X S+ 0 0 69 -4,-2.0 4,-2.5 -5,-0.3 -1,-0.2 0.922 110.3 44.5 -66.1 -42.2 18.3 -3.6 31.1 38 71 A L H X S+ 0 0 42 -4,-1.9 4,-3.1 -5,-0.2 5,-0.3 0.902 108.8 57.6 -66.6 -39.9 17.5 -0.3 29.4 39 72 A L H X S+ 0 0 0 -4,-2.3 4,-1.1 1,-0.2 -1,-0.2 0.921 113.4 38.8 -56.6 -48.0 21.2 0.7 29.4 40 73 A F H X S+ 0 0 1 -4,-1.8 4,-2.6 2,-0.2 5,-0.5 0.966 118.7 46.7 -67.1 -51.4 22.1 -2.4 27.5 41 74 A D H X S+ 0 0 31 -4,-2.5 4,-0.9 1,-0.2 -2,-0.2 0.877 114.8 46.3 -60.8 -41.6 19.1 -2.4 25.1 42 75 A Y H < S+ 0 0 19 -4,-3.1 -1,-0.2 -5,-0.2 -2,-0.2 0.764 123.5 31.9 -72.6 -27.5 19.3 1.4 24.3 43 76 A N H < S+ 0 0 17 -4,-1.1 -2,-0.2 -3,-0.4 -1,-0.2 0.658 118.2 45.8-112.2 -19.8 23.1 1.4 23.7 44 77 A C H < S+ 0 0 0 -4,-2.6 3,-0.4 -5,-0.2 2,-0.2 0.739 103.6 68.9 -95.1 -26.9 24.1 -2.0 22.2 45 78 A L S < S+ 0 0 60 -4,-0.9 3,-0.1 -5,-0.5 4,-0.0 -0.501 77.9 45.9 -95.2 161.1 21.2 -2.3 19.7 46 79 A G S S+ 0 0 66 1,-0.3 -1,-0.2 -2,-0.2 2,-0.2 0.505 82.6 119.9 90.9 5.6 20.4 -0.4 16.5 47 80 A G S S- 0 0 21 -3,-0.4 -1,-0.3 1,-0.1 -3,-0.0 -0.496 77.3-113.5 -94.0 169.9 24.0 -0.5 15.1 48 81 A K - 0 0 114 -2,-0.2 312,-0.4 -3,-0.1 -1,-0.1 0.622 40.2-149.3 -75.2 -15.3 25.4 -2.0 11.9 49 82 A N > + 0 0 22 1,-0.1 4,-2.5 310,-0.1 3,-0.3 0.705 42.5 149.2 57.6 24.8 27.3 -4.5 14.1 50 83 A N H > + 0 0 13 1,-0.2 4,-1.5 2,-0.2 -1,-0.1 0.805 69.3 51.6 -60.9 -30.5 30.2 -4.8 11.6 51 84 A R H > S+ 0 0 30 2,-0.2 4,-1.0 1,-0.2 -1,-0.2 0.854 110.9 47.3 -76.3 -36.9 32.7 -5.5 14.4 52 85 A G H >> S+ 0 0 0 -3,-0.3 4,-1.8 2,-0.2 3,-0.8 0.953 111.7 49.7 -65.7 -50.5 30.7 -8.3 15.9 53 86 A I H 3X S+ 0 0 32 -4,-2.5 4,-3.1 1,-0.3 5,-0.3 0.854 105.0 60.0 -55.7 -38.2 30.0 -9.9 12.6 54 87 A L H 3X S+ 0 0 3 -4,-1.5 4,-2.0 -5,-0.2 -1,-0.3 0.827 103.6 49.9 -62.9 -34.7 33.8 -9.7 11.8 55 88 A V H < S+ 0 0 68 -4,-2.0 3,-0.9 1,-0.2 -2,-0.2 0.960 116.5 43.5 -65.7 -51.7 34.3 -19.7 10.9 61 94 A Y H 3< S+ 0 0 92 -4,-2.2 -1,-0.2 1,-0.3 284,-0.2 0.513 103.7 62.9 -82.2 -6.8 36.7 -19.2 8.0 62 95 A V H 3< S+ 0 0 25 -4,-1.1 -1,-0.3 -5,-0.2 -2,-0.2 0.754 108.1 55.4 -77.9 -25.3 39.9 -19.7 10.0 63 96 A K S << S- 0 0 79 -3,-0.9 2,-0.6 -4,-0.7 161,-0.0 -0.409 82.0-122.9 -99.3 168.7 38.6 -23.3 10.7 64 97 A N 0 0 99 1,-0.2 -3,-0.1 -2,-0.1 -4,-0.0 -0.982 360.0 360.0-103.6 109.0 37.4 -26.4 8.9 65 98 A R 0 0 98 -2,-0.6 -1,-0.2 -5,-0.1 3,-0.1 0.875 360.0 360.0 -52.2 360.0 34.0 -26.6 10.6 66 ! 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 67 100 A I 0 0 37 0, 0.0 2,-0.1 0, 0.0 -2,-0.1 0.000 360.0 360.0 360.0 104.4 32.1 -25.9 14.9 68 101 A N >> - 0 0 84 1,-0.1 4,-2.1 -3,-0.1 3,-0.9 -0.459 360.0-105.0 -82.6 162.5 29.5 -27.2 17.4 69 102 A S H 3> S+ 0 0 95 1,-0.3 4,-0.6 2,-0.2 -1,-0.1 0.597 121.0 59.4 -70.0 -8.4 26.9 -24.9 19.0 70 103 A S H 3> S+ 0 0 61 2,-0.2 4,-1.0 3,-0.1 -1,-0.3 0.818 107.4 45.3 -79.1 -36.1 28.9 -24.9 22.3 71 104 A E H <> S+ 0 0 54 -3,-0.9 4,-1.5 1,-0.2 -2,-0.2 0.855 109.3 56.2 -73.6 -35.9 31.9 -23.4 20.4 72 105 A W H X S+ 0 0 40 -4,-2.1 4,-2.8 1,-0.2 5,-0.2 0.808 99.1 62.0 -59.7 -32.4 29.6 -20.9 18.7 73 106 A E H X S+ 0 0 66 -4,-0.6 4,-1.3 1,-0.2 -1,-0.2 0.906 104.5 46.5 -64.7 -40.0 28.5 -19.7 22.1 74 107 A K H X S+ 0 0 39 -4,-1.0 4,-1.9 2,-0.2 -1,-0.2 0.884 113.1 50.6 -67.1 -37.8 32.0 -18.6 23.0 75 108 A A H X S+ 0 0 0 -4,-1.5 4,-1.8 1,-0.2 -2,-0.2 0.973 110.9 46.2 -64.9 -54.2 32.3 -16.9 19.5 76 109 A A H X S+ 0 0 0 -4,-2.8 4,-2.2 2,-0.2 -1,-0.2 0.769 108.3 58.8 -60.6 -27.9 29.1 -15.0 19.8 77 110 A C H X S+ 0 0 0 -4,-1.3 4,-2.3 -5,-0.2 3,-0.3 0.987 108.0 43.9 -62.8 -61.1 30.1 -13.9 23.4 78 111 A L H X S+ 0 0 0 -4,-1.9 4,-1.6 1,-0.2 -2,-0.2 0.803 112.1 56.9 -44.6 -37.5 33.3 -12.3 22.2 79 112 A A H X S+ 0 0 0 -4,-1.8 4,-1.5 2,-0.2 -1,-0.2 0.913 108.8 43.2 -69.3 -41.5 31.2 -10.8 19.3 80 113 A W H X S+ 0 0 3 -4,-2.2 4,-2.2 -3,-0.3 -2,-0.2 0.801 107.3 61.4 -74.6 -27.2 28.8 -9.1 21.7 81 114 A C H X S+ 0 0 0 -4,-2.3 4,-2.7 2,-0.2 -1,-0.2 0.917 104.7 48.4 -61.7 -43.9 31.6 -8.0 23.9 82 115 A I H X S+ 0 0 0 -4,-1.6 4,-2.7 2,-0.2 -2,-0.2 0.899 111.6 49.3 -60.8 -42.3 33.0 -6.0 21.0 83 116 A E H X S+ 0 0 2 -4,-1.5 4,-2.1 2,-0.2 -2,-0.2 0.832 111.8 49.1 -68.8 -29.1 29.5 -4.5 20.4 84 117 A I H X S+ 0 0 7 -4,-2.2 4,-2.8 2,-0.2 -2,-0.2 0.895 109.4 51.9 -72.3 -41.9 29.3 -3.7 24.1 85 118 A L H X S+ 0 0 0 -4,-2.7 4,-2.9 2,-0.2 5,-0.2 0.938 109.6 50.4 -54.3 -48.5 32.8 -2.1 23.9 86 119 A Q H X S+ 0 0 17 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.940 109.9 50.2 -56.1 -49.2 31.4 -0.1 20.9 87 120 A A H X S+ 0 0 2 -4,-2.1 4,-2.4 2,-0.2 5,-0.2 0.933 110.8 49.2 -53.1 -49.6 28.4 1.0 23.0 88 121 A A H X S+ 0 0 0 -4,-2.8 4,-2.2 1,-0.2 -2,-0.2 0.963 112.7 47.3 -58.6 -52.4 30.6 2.1 25.9 89 122 A F H X S+ 0 0 24 -4,-2.9 4,-3.1 1,-0.2 -1,-0.2 0.846 111.1 50.5 -57.1 -38.5 32.8 4.1 23.6 90 123 A L H X S+ 0 0 21 -4,-2.4 4,-2.6 -5,-0.2 -1,-0.2 0.909 108.2 51.8 -73.6 -36.9 29.9 5.8 21.8 91 124 A V H X S+ 0 0 7 -4,-2.4 4,-1.3 -5,-0.2 -2,-0.2 0.952 115.5 43.2 -58.6 -49.4 28.3 6.8 25.1 92 125 A A H >X S+ 0 0 14 -4,-2.2 4,-2.2 -5,-0.2 3,-0.6 0.937 112.0 52.7 -61.9 -47.5 31.6 8.4 26.2 93 126 A D H 3X S+ 0 0 29 -4,-3.1 4,-3.4 1,-0.3 -1,-0.2 0.885 105.7 55.3 -57.2 -41.0 32.3 10.0 22.7 94 127 A D H 3<>S+ 0 0 11 -4,-2.6 5,-2.7 1,-0.2 -1,-0.3 0.837 107.7 48.6 -65.6 -31.6 28.9 11.7 22.8 95 128 A I H X<5S+ 0 0 16 -4,-1.3 3,-0.7 -3,-0.6 -1,-0.2 0.945 116.8 42.9 -67.0 -47.0 29.7 13.3 26.1 96 129 A M H 3<5S+ 0 0 13 -4,-2.2 -2,-0.2 1,-0.2 -3,-0.2 0.895 120.0 40.3 -67.6 -42.4 33.1 14.5 24.9 97 130 A D T 3<5S- 0 0 19 -4,-3.4 -1,-0.2 -5,-0.2 -2,-0.2 0.323 109.2-120.1 -88.1 8.6 31.9 15.6 21.4 98 131 A K T < 5 - 0 0 140 -3,-0.7 -3,-0.2 -4,-0.2 -4,-0.1 0.949 45.5-165.7 48.5 54.8 28.6 17.2 22.9 99 132 A G < - 0 0 9 -5,-2.7 3,-0.1 -6,-0.1 -1,-0.1 -0.205 26.0-173.1 -70.8 161.0 26.5 14.8 20.7 100 133 A E + 0 0 104 1,-0.4 7,-2.1 166,-0.2 2,-0.4 0.705 68.3 25.0-112.7 -56.7 22.8 15.2 20.0 101 134 A M E +A 106 0A 34 5,-0.2 165,-0.5 165,-0.1 -1,-0.4 -0.893 57.1 178.7-122.1 140.0 21.7 12.2 18.1 102 135 A R E > S-A 105 0A 43 3,-3.5 3,-1.8 -2,-0.4 163,-0.2 -0.959 74.9 -8.5-147.9 132.9 23.1 8.7 17.9 103 136 A R T 3 S- 0 0 47 -2,-0.3 161,-0.2 160,-0.3 162,-0.1 0.904 129.8 -58.6 43.3 46.5 21.7 5.7 16.0 104 137 A N T 3 S+ 0 0 40 160,-2.1 326,-0.8 156,-0.2 327,-0.8 0.535 122.6 86.4 65.4 14.0 18.7 8.0 15.3 105 138 A K E < S-A 102 0A 37 -3,-1.8 -3,-3.5 159,-0.3 -1,-0.2 -0.868 89.7 -75.5-130.4 168.9 17.8 8.6 18.9 106 139 A Y E -A 101 0A 57 1152,-0.3 -5,-0.2 -2,-0.3 2,-0.1 -0.321 58.0 -98.2 -58.6 142.2 18.9 11.1 21.6 107 140 A C >> - 0 0 3 -7,-2.1 3,-1.9 1,-0.1 4,-0.8 -0.420 30.6-119.4 -62.4 140.6 22.3 10.4 23.2 108 141 A W G >4 S+ 0 0 4 1,-0.3 3,-1.5 2,-0.2 7,-0.5 0.883 110.6 57.6 -46.2 -54.2 22.1 8.6 26.5 109 142 A Y G 34 S+ 0 0 34 1,-0.3 -1,-0.3 -18,-0.2 6,-0.1 0.706 101.7 58.3 -58.5 -21.1 23.8 11.4 28.4 110 143 A L G <4 S+ 0 0 48 -3,-1.9 -1,-0.3 5,-0.1 -2,-0.2 0.771 77.5 105.0 -80.3 -26.9 21.1 13.9 27.3 111 144 A L S XX S- 0 0 0 -3,-1.5 4,-2.0 -4,-0.8 3,-1.3 -0.303 73.3-134.0 -54.0 137.3 18.1 11.9 28.7 112 145 A K T 34 S+ 0 0 51 1148,-2.4 1153,-0.2 1145,-0.3 -1,-0.1 0.747 104.0 54.6 -74.6 -24.2 16.9 13.7 31.9 113 146 A D T 34 S+ 0 0 22 1144,-0.3 -1,-0.3 1147,-0.3 -2,-0.1 0.455 121.4 33.2 -80.9 -2.8 16.6 10.5 34.0 114 147 A V T <> S+ 0 0 0 -3,-1.3 4,-1.0 -6,-0.2 -2,-0.2 0.713 79.2 166.2-111.4 -73.0 20.3 9.8 33.1 115 148 A E H X - 0 0 68 -4,-2.0 4,-2.4 -7,-0.5 3,-0.3 0.099 61.4 -66.0 68.1 170.5 22.4 13.0 32.7 116 149 A T H > S+ 0 0 47 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.890 130.6 62.4 -57.6 -42.3 26.2 13.1 32.5 117 150 A K H > S+ 0 0 66 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.915 114.0 34.7 -54.3 -44.5 26.6 11.9 36.2 118 151 A N H X S+ 0 0 2 -4,-1.0 4,-3.0 -3,-0.3 -1,-0.2 0.888 112.4 60.9 -74.3 -39.1 24.9 8.7 35.3 119 152 A A H X S+ 0 0 0 -4,-2.4 4,-1.7 1,-0.2 -2,-0.2 0.880 106.3 46.8 -55.5 -43.0 26.3 8.5 31.8 120 153 A V H X S+ 0 0 11 -4,-2.7 4,-1.6 2,-0.2 3,-0.3 0.949 113.4 47.3 -66.9 -48.6 29.9 8.4 33.1 121 154 A N H X S+ 0 0 11 -4,-1.3 4,-1.3 -5,-0.3 -2,-0.2 0.926 111.4 52.6 -57.1 -45.3 29.1 5.8 35.7 122 155 A D H X S+ 0 0 0 -4,-3.0 4,-2.4 1,-0.2 -1,-0.2 0.789 102.0 59.0 -65.6 -29.8 27.3 3.7 33.1 123 156 A V H X S+ 0 0 7 -4,-1.7 4,-2.8 -3,-0.3 -1,-0.2 0.971 106.9 47.0 -60.9 -52.8 30.2 3.8 30.7 124 157 A L H X S+ 0 0 23 -4,-1.6 4,-1.8 1,-0.2 -2,-0.2 0.790 111.6 52.6 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4,-2.8 1,-0.2 5,-0.3 0.922 109.0 51.4 -50.9 -47.9 1.6 -13.5 38.2 394 66 B S H X S+ 0 0 35 -4,-1.9 4,-1.9 -5,-0.2 -1,-0.2 0.871 106.7 51.0 -62.3 -43.6 4.3 -13.0 35.5 395 67 B K H X S+ 0 0 109 -4,-1.8 4,-1.9 1,-0.2 -1,-0.2 0.969 115.3 44.8 -55.8 -51.2 3.9 -16.4 34.0 396 68 B Y H X S+ 0 0 5 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.904 114.5 44.3 -60.9 -53.3 0.2 -15.9 33.7 397 69 B Y H X S+ 0 0 0 -4,-2.8 4,-1.9 1,-0.2 -1,-0.2 0.798 109.6 56.9 -72.8 -24.8 0.1 -12.4 32.3 398 70 B K H X S+ 0 0 90 -4,-1.9 4,-2.5 -5,-0.3 -1,-0.2 0.912 110.4 45.1 -66.8 -41.6 2.9 -13.1 29.8 399 71 B L H X S+ 0 0 41 -4,-1.9 4,-3.1 -5,-0.2 5,-0.3 0.904 108.2 57.7 -67.1 -39.6 0.8 -15.9 28.4 400 72 B L H X S+ 0 0 0 -4,-2.3 4,-1.1 2,-0.2 -2,-0.2 0.930 113.6 38.9 -56.6 -47.0 -2.4 -13.7 28.4 401 73 B F H X S+ 0 0 1 -4,-1.9 4,-2.6 2,-0.2 5,-0.5 0.970 118.7 46.5 -67.2 -52.0 -0.6 -11.2 26.2 402 74 B D H X S+ 0 0 30 -4,-2.5 4,-0.9 1,-0.2 -2,-0.2 0.870 114.8 46.6 -60.2 -41.0 1.2 -13.7 24.0 403 75 B Y H < S+ 0 0 17 -4,-3.1 -1,-0.2 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111.9 50.0 -65.2 -49.9 -1.8 -1.8 13.8 414 86 B I H 3X S+ 0 0 27 -4,-2.4 4,-3.0 1,-0.2 5,-0.3 0.855 104.9 59.4 -56.5 -38.4 -0.2 -1.5 10.4 415 87 B L H 3X S+ 0 0 1 -4,-1.6 4,-2.0 -5,-0.2 -1,-0.2 0.834 103.9 50.3 -64.0 -32.6 -2.7 1.1 9.5 416 88 B V H < S+ 0 0 69 -4,-2.1 3,-1.0 1,-0.2 -2,-0.2 0.964 116.8 43.6 -65.9 -53.5 4.6 7.7 7.7 422 94 B Y H 3< S+ 0 0 85 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.536 104.4 61.2 -82.8 -5.5 2.7 8.9 4.7 423 95 B V H 3< S+ 0 0 26 -4,-1.3 -1,-0.3 -5,-0.3 -2,-0.2 0.730 109.5 53.4 -81.0 -21.9 1.0 11.9 6.4 424 96 B K S << S- 0 0 82 -3,-1.0 2,-0.6 -4,-0.6 162,-0.0 -0.439 83.4-121.8 -97.5 171.1 4.6 13.2 7.0 425 97 B N 0 0 101 1,-0.2 -3,-0.1 -2,-0.1 -4,-0.0 -0.983 360.0 360.0-105.5 109.0 7.7 14.0 5.0 426 98 B R 0 0 89 -2,-0.6 -1,-0.2 -5,-0.1 3,-0.0 0.890 360.0 360.0 -50.4 360.0 10.0 11.7 6.9 427 ! 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 0.0 428 100 B I 0 0 37 0, 0.0 2,-0.1 0, 0.0 -2,-0.1 0.000 360.0 360.0 360.0 105.2 11.0 10.4 11.5 429 101 B 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-1,-0.2 0.890 113.4 50.6 -67.7 -36.5 55.0 -7.6 43.5 1154 108 D A H X S+ 0 0 0 -4,-1.6 4,-1.8 1,-0.2 -2,-0.2 0.970 110.4 46.6 -64.9 -54.7 53.3 -6.6 46.8 1155 109 D A H X S+ 0 0 0 -4,-2.8 4,-2.1 2,-0.2 -1,-0.2 0.768 108.4 59.1 -59.8 -27.2 54.0 -2.9 46.4 1156 110 D C H X S+ 0 0 0 -4,-1.3 4,-2.2 -5,-0.2 3,-0.3 0.987 107.0 44.3 -64.6 -60.9 52.7 -3.1 42.8 1157 111 D L H X S+ 0 0 0 -4,-1.9 4,-1.6 1,-0.2 -2,-0.2 0.807 112.3 56.9 -43.9 -37.2 49.3 -4.4 44.0 1158 112 D A H X S+ 0 0 0 -4,-1.8 4,-1.4 1,-0.2 -1,-0.2 0.911 109.0 42.8 -69.0 -42.4 49.4 -1.7 46.7 1159 113 D W H X S+ 0 0 4 -4,-2.1 4,-2.2 -3,-0.3 -2,-0.2 0.792 106.9 61.8 -74.2 -27.9 49.8 1.1 44.2 1160 114 D C H X S+ 0 0 0 -4,-2.2 4,-2.8 2,-0.2 -1,-0.2 0.915 104.7 48.6 -61.7 -42.8 47.2 -0.4 41.9 1161 115 D I H X S+ 0 0 0 -4,-1.6 4,-2.7 2,-0.2 -2,-0.2 0.892 111.7 48.8 -60.7 -42.4 44.7 0.0 44.8 1162 116 D E H X S+ 0 0 2 -4,-1.4 4,-2.0 2,-0.2 -2,-0.2 0.824 111.7 49.3 -69.4 -29.3 45.9 3.6 45.2 1163 117 D I H X S+ 0 0 5 -4,-2.2 4,-2.8 2,-0.2 -2,-0.2 0.893 109.6 52.2 -72.3 -41.8 45.5 4.2 41.4 1164 118 D L H X S+ 0 0 0 -4,-2.8 4,-3.0 2,-0.2 5,-0.2 0.942 109.4 49.6 -54.2 -49.1 42.0 2.6 41.6 1165 119 D Q H X S+ 0 0 18 -4,-2.7 4,-2.4 2,-0.2 -2,-0.2 0.934 110.4 50.6 -55.6 -49.0 41.3 5.1 44.4 1166 120 D A H X S+ 0 0 1 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.941 110.7 48.7 -54.4 -48.5 42.6 7.9 42.2 1167 121 D A H X S+ 0 0 2 -4,-2.8 4,-2.2 1,-0.2 -2,-0.2 0.965 113.3 47.4 -58.4 -53.5 40.4 6.8 39.3 1168 122 D F H X S+ 0 0 35 -4,-3.0 4,-3.2 1,-0.2 -1,-0.2 0.840 111.1 50.3 -56.0 -40.5 37.3 6.6 41.5 1169 123 D L H X S+ 0 0 23 -4,-2.4 4,-2.5 -5,-0.2 -1,-0.2 0.890 107.8 52.0 -71.4 -38.7 37.9 10.0 43.1 1170 124 D V H X S+ 0 0 4 -4,-2.2 4,-1.2 -5,-0.2 -2,-0.2 0.960 116.0 43.3 -59.5 -47.0 38.3 11.7 39.7 1171 125 D A H >X S+ 0 0 15 -4,-2.2 4,-2.2 -5,-0.2 3,-0.6 0.937 111.7 52.4 -60.3 -51.9 35.0 10.2 38.7 1172 126 D D H 3X S+ 0 0 28 -4,-3.2 4,-3.3 1,-0.2 -1,-0.2 0.873 105.9 55.5 -54.9 -41.8 33.2 10.9 42.0 1173 127 D D H 3<>S+ 0 0 11 -4,-2.5 5,-2.7 2,-0.2 -1,-0.2 0.840 107.6 48.4 -66.0 -30.6 34.2 14.5 41.8 1174 128 D I H X<5S+ 0 0 15 -4,-1.2 3,-0.8 -3,-0.6 -2,-0.2 0.946 117.2 43.0 -67.1 -46.6 32.6 14.9 38.3 1175 129 D M H 3<5S+ 0 0 14 -4,-2.2 -2,-0.2 1,-0.2 -3,-0.2 0.883 119.5 40.4 -68.0 -43.4 29.4 13.2 39.6 1176 130 D D T 3<5S- 0 0 18 -4,-3.3 -1,-0.2 -5,-0.2 -2,-0.2 0.306 108.8-119.7 -88.6 9.0 29.2 15.0 43.0 1177 131 D K T < 5 - 0 0 142 -3,-0.8 -3,-0.2 -4,-0.2 -4,-0.1 0.946 45.4-165.0 47.2 56.7 30.3 18.4 41.4 1178 132 D G < - 0 0 9 -5,-2.7 3,-0.1 -6,-0.1 -1,-0.1 -0.192 25.3-173.1 -70.2 159.7 33.3 18.6 43.7 1179 133 D E + 0 0 114 1,-0.4 7,-2.2 166,-0.2 2,-0.4 0.707 68.4 23.8-111.4 -56.6 35.4 21.7 44.2 1180 134 D M E +D 1185 0D 62 5,-0.2 165,-0.5 165,-0.1 -1,-0.4 -0.891 57.6 178.8-122.8 140.2 38.4 20.6 46.2 1181 135 D R E > S-D 1184 0D 42 3,-3.5 3,-1.8 -2,-0.4 163,-0.2 -0.963 74.9 -7.9-148.1 133.1 40.2 17.3 46.7 1182 136 D R T 3 S- 0 0 50 -2,-0.3 161,-0.1 160,-0.3 162,-0.1 0.902 130.0 -58.7 42.5 47.0 43.2 16.5 48.7 1183 137 D N T 3 S+ 0 0 94 160,-2.1 2,-0.3 1,-0.2 -1,-0.3 0.519 122.3 86.0 66.1 13.0 43.5 20.3 49.2 1184 138 D K E < S-D 1181 0D 66 -3,-1.8 -3,-3.5 159,-0.3 -1,-0.2 -0.858 89.9 -74.9-130.1 169.2 43.7 21.2 45.5 1185 139 D Y E -D 1180 0D 80 -2,-0.3 -5,-0.2 -1006,-0.2 2,-0.1 -0.333 58.2 -98.2 -57.6 142.1 41.2 21.9 42.8 1186 140 D C >> - 0 0 2 -7,-2.2 3,-1.8 1,-0.1 4,-0.8 -0.380 30.2-119.3 -63.0 141.1 39.5 18.8 41.3 1187 141 D W G >4 S+ 0 0 4 1,-0.3 3,-1.5 2,-0.2 7,-0.5 0.893 110.6 57.3 -48.2 -52.8 41.0 17.5 38.1 1188 142 D Y G 34 S+ 0 0 32 1,-0.3 -1,-0.3 -18,-0.2 6,-0.1 0.709 101.8 58.2 -59.6 -19.7 37.9 18.0 36.0 1189 143 D L G <4 S+ 0 0 47 -3,-1.8 -1,-0.3 5,-0.1 -2,-0.2 0.769 77.6 105.1 -80.4 -27.0 37.8 21.7 36.9 1190 144 D L S XX S- 0 0 0 -3,-1.5 4,-2.1 -4,-0.8 3,-1.2 -0.313 72.8-135.2 -54.8 137.6 41.2 22.6 35.5 1191 145 D K T 34 S+ 0 0 62 -1010,-3.0 -1005,-0.2 1,-0.3 -1,-0.1 0.747 103.4 55.8 -75.7 -23.6 40.8 24.4 32.2 1192 146 D D T 34 S+ 0 0 23 -1014,-0.4 -1,-0.3 -1011,-0.4 -2,-0.1 0.540 121.9 31.5 -76.8 -7.9 43.5 22.4 30.4 1193 147 D V T <> S+ 0 0 0 -3,-1.2 4,-1.1 -6,-0.2 -2,-0.2 0.759 79.4 166.9-110.9 -72.8 41.5 19.3 31.4 1194 148 D E H X - 0 0 63 -4,-2.1 4,-2.5 -7,-0.5 3,-0.3 0.087 61.4 -65.5 68.1 170.0 37.7 19.9 31.6 1195 149 D T H > S+ 0 0 45 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.886 130.7 62.5 -57.4 -42.9 35.1 17.0 31.9 1196 150 D K H > S+ 0 0 52 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.915 113.8 34.5 -54.4 -44.5 35.8 15.7 28.4 1197 151 D N H X S+ 0 0 0 -4,-1.1 4,-2.9 -3,-0.3 -1,-0.2 0.895 112.5 60.9 -75.6 -39.3 39.4 14.9 29.4 1198 152 D A H X S+ 0 0 0 -4,-2.5 4,-1.6 1,-0.2 -2,-0.2 0.888 106.6 47.1 -55.3 -42.2 38.5 14.0 33.0 1199 153 D V H X S+ 0 0 13 -4,-2.8 4,-1.6 2,-0.2 3,-0.3 0.944 112.9 47.1 -65.1 -48.6 36.3 11.2 31.7 1200 154 D N H X S+ 0 0 12 -4,-1.3 4,-1.3 -5,-0.3 -2,-0.2 0.926 111.4 53.4 -58.0 -44.3 38.8 9.8 29.3 1201 155 D D H X S+ 0 0 0 -4,-2.9 4,-2.5 1,-0.2 -1,-0.2 0.778 101.4 58.9 -65.5 -31.0 41.5 10.0 32.0 1202 156 D V H X S+ 0 0 12 -4,-1.6 4,-2.6 -3,-0.3 -1,-0.2 0.972 106.5 47.1 -61.5 -52.0 39.5 7.9 34.4 1203 157 D L H X S+ 0 0 18 -4,-1.6 4,-1.8 1,-0.2 -2,-0.2 0.787 112.0 52.7 -60.4 -29.8 39.3 5.0 32.0 1204 158 D L H X S+ 0 0 0 -4,-1.3 4,-2.3 2,-0.2 -1,-0.2 0.934 109.6 45.9 -70.9 -49.1 43.0 5.4 31.4 1205 159 D L H X S+ 0 0 0 -4,-2.5 4,-1.4 1,-0.2 -2,-0.2 0.944 112.9 52.5 -56.7 -45.2 43.9 5.2 35.1 1206 160 D Y H X S+ 0 0 4 -4,-2.6 4,-0.7 1,-0.2 3,-0.3 0.921 112.2 43.5 -60.2 -44.9 41.6 2.3 35.5 1207 161 D N H X S+ 0 0 0 -4,-1.8 4,-1.8 1,-0.2 3,-0.3 0.792 101.1 68.5 -73.6 -26.0 43.3 0.4 32.7 1208 162 D S H X S+ 0 0 0 -4,-2.3 4,-3.1 1,-0.2 5,-0.2 0.907 92.2 64.2 -56.2 -40.5 46.8 1.3 33.8 1209 163 D I H X S+ 0 0 0 -4,-1.4 4,-2.7 -3,-0.3 -1,-0.2 0.915 105.2 41.7 -44.4 -55.3 46.0 -1.0 36.9 1210 164 D Y H X S+ 0 0 8 -4,-0.7 4,-2.0 -3,-0.3 -1,-0.2 0.839 112.1 53.8 -72.6 -34.7 45.8 -4.1 34.8 1211 165 D K H X S+ 0 0 13 -4,-1.8 4,-2.3 2,-0.2 -1,-0.2 0.968 112.2 46.3 -57.4 -50.9 48.7 -3.2 32.5 1212 166 D L H X S+ 0 0 1 -4,-3.1 4,-2.0 1,-0.2 5,-0.2 0.941 110.1 52.7 -57.3 -47.6 50.8 -2.8 35.8 1213 167 D I H X S+ 0 0 0 -4,-2.7 4,-1.8 1,-0.2 -1,-0.2 0.879 109.9 49.8 -58.3 -36.9 49.5 -6.1 37.2 1214 168 D E H X S+ 0 0 38 -4,-2.0 4,-1.2 2,-0.2 -1,-0.2 0.920 107.5 53.8 -66.1 -44.1 50.5 -7.9 34.0 1215 169 D I H < S+ 0 0 45 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.927 122.8 26.1 -57.0 -42.8 54.0 -6.4 34.1 1216 170 D Y H < S+ 0 0 57 -4,-2.0 -1,-0.2 -5,-0.1 -2,-0.2 0.515 133.3 26.6-105.8 -7.8 54.7 -7.6 37.6 1217 171 D L H >< S+ 0 0 4 -4,-1.8 3,-1.1 -5,-0.2 6,-0.2 0.203 75.2 115.3-140.2 15.0 52.5 -10.7 38.2 1218 172 D R T 3< S+ 0 0 132 -4,-1.2 6,-0.1 1,-0.2 -3,-0.1 0.903 87.7 43.1 -53.9 -39.6 51.9 -12.3 34.7 1219 173 D N T 3 S+ 0 0 147 -5,-0.2 -1,-0.2 4,-0.1 2,-0.1 0.440 91.3 102.0 -93.2 -3.5 53.8 -15.4 35.8 1220 174 D E S < S- 0 0 42 -3,-1.1 3,-0.4 1,-0.1 4,-0.2 -0.406 75.5-128.2 -73.9 157.5 52.4 -15.7 39.4 1221 175 D S S S+ 0 0 131 1,-0.2 3,-0.4 2,-0.1 4,-0.3 0.792 107.1 56.6 -80.7 -27.3 49.7 -18.4 39.8 1222 176 D C S > S+ 0 0 15 1,-0.2 4,-3.4 2,-0.1 3,-0.5 0.504 77.0 103.9 -79.4 -6.4 47.2 -16.0 41.5 1223 177 D Y H > S+ 0 0 14 -3,-0.4 4,-2.5 -6,-0.2 5,-0.3 0.876 80.8 44.9 -41.0 -57.8 47.4 -13.6 38.4 1224 178 D V H > S+ 0 0 52 -3,-0.4 4,-1.6 -4,-0.2 -1,-0.2 0.855 117.6 45.2 -62.2 -35.2 44.0 -14.7 37.0 1225 179 D D H > S+ 0 0 71 -3,-0.5 4,-2.1 -4,-0.3 -2,-0.2 0.886 110.2 53.4 -76.7 -40.9 42.3 -14.5 40.4 1226 180 D V H X S+ 0 0 0 -4,-3.4 4,-2.1 2,-0.2 3,-0.3 0.954 112.4 43.8 -59.3 -49.5 43.9 -11.2 41.4 1227 181 D I H X S+ 0 0 7 -4,-2.5 4,-2.2 -5,-0.3 -1,-0.2 0.897 111.3 56.6 -66.1 -32.3 42.6 -9.5 38.2 1228 182 D A H X S+ 0 0 15 -4,-1.6 4,-1.9 -5,-0.3 -1,-0.2 0.848 107.2 49.4 -61.8 -34.0 39.3 -11.3 38.8 1229 183 D T H X S+ 0 0 22 -4,-2.1 4,-2.4 -3,-0.3 5,-0.2 0.899 109.4 48.8 -73.2 -42.2 39.1 -9.6 42.3 1230 184 D F H X S+ 0 0 0 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.928 113.2 50.3 -59.8 -43.0 39.9 -6.1 41.0 1231 185 D R H X S+ 0 0 19 -4,-2.2 4,-1.7 -5,-0.2 -2,-0.2 0.911 113.3 42.2 -63.9 -43.3 37.2 -6.6 38.4 1232 186 D D H X S+ 0 0 35 -4,-1.9 4,-1.6 2,-0.2 -1,-0.2 0.823 113.5 52.2 -78.3 -29.7 34.5 -7.8 40.8 1233 187 D A H X S+ 0 0 5 -4,-2.4 4,-2.2 2,-0.2 57,-0.2 0.910 109.3 51.2 -65.5 -42.7 35.3 -5.2 43.4 1234 188 D T H X S+ 0 0 0 -4,-2.2 4,-2.4 -5,-0.2 -2,-0.2 0.915 107.6 52.6 -61.4 -42.2 35.0 -2.5 40.8 1235 189 D L H X S+ 0 0 0 -4,-1.7 4,-2.2 1,-0.2 5,-0.2 0.903 109.2 48.8 -62.2 -41.7 31.6 -3.8 39.6 1236 190 D K H X S+ 0 0 31 -4,-1.6 4,-2.7 1,-0.2 -1,-0.2 0.927 110.8 51.0 -63.9 -40.6 30.3 -3.7 43.1 1237 191 D T H X S+ 0 0 7 -4,-2.2 4,-2.4 1,-0.2 5,-0.2 0.899 107.5 53.6 -64.0 -38.1 31.6 -0.1 43.5 1238 192 D I H X S+ 0 0 6 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.925 111.5 43.6 -62.7 -46.6 29.9 0.9 40.3 1239 193 D I H X S+ 0 0 1 -4,-2.2 4,-2.2 1,-0.2 5,-0.2 0.902 110.2 59.9 -65.5 -38.4 26.5 -0.4 41.4 1240 194 D G H X S+ 0 0 0 -4,-2.7 4,-2.3 45,-0.4 46,-0.3 0.927 108.5 40.9 -48.3 -56.2 27.3 1.3 44.7 1241 195 D Q H X S+ 0 0 24 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.835 108.4 63.1 -64.1 -35.2 27.6 4.7 43.2 1242 196 D H H X S+ 0 0 0 -4,-2.0 4,-1.2 -5,-0.2 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22.6 12.2 49.3 1354 311 D L + 0 0 5 -110,-0.3 2,-0.3 -2,-0.3 -1,-0.0 -0.700 49.1 171.7 -72.6 107.8 21.2 9.5 51.6 1355 312 D T > - 0 0 4 -2,-0.9 4,-1.9 1,-0.1 3,-0.4 -0.832 45.6-113.0-122.9 160.8 23.6 10.0 54.5 1356 313 D W H > S+ 0 0 5 -2,-0.3 4,-2.6 1,-0.3 5,-0.2 0.906 115.4 53.6 -63.3 -42.2 23.7 8.6 58.0 1357 314 D P H > S+ 0 0 2 0, 0.0 4,-2.1 0, 0.0 -1,-0.3 0.842 107.0 53.7 -61.6 -32.6 22.9 11.9 59.7 1358 315 D L H > S+ 0 0 0 -3,-0.4 4,-1.9 2,-0.2 -2,-0.2 0.946 111.3 45.1 -64.2 -46.1 19.8 12.3 57.5 1359 316 D I H X S+ 0 0 1 -4,-1.9 4,-1.5 1,-0.2 -1,-0.2 0.889 113.4 48.5 -67.6 -40.2 18.6 8.9 58.6 1360 317 D K H X S+ 0 0 46 -4,-2.6 4,-1.1 1,-0.2 -1,-0.2 0.910 111.3 50.1 -66.4 -44.4 19.2 9.4 62.2 1361 318 D T H X S+ 0 0 0 -4,-2.1 4,-2.4 -5,-0.2 3,-0.2 0.864 109.2 53.0 -60.6 -36.8 17.6 12.8 62.3 1362 319 D F H < S+ 0 0 15 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.838 107.3 51.0 -70.2 -33.2 14.5 11.3 60.6 1363 320 D E H < S+ 0 0 112 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.748 121.5 33.4 -69.4 -26.9 14.2 8.6 63.2 1364 321 D L H < S+ 0 0 76 -4,-1.1 -2,-0.2 -3,-0.2 -1,-0.2 0.694 99.4 91.5-103.4 -25.0 14.4 11.2 66.0 1365 322 D C S < S- 0 0 13 -4,-2.4 2,-0.1 -5,-0.1 5,-0.0 -0.208 70.3-104.4 -89.3 168.4 12.7 14.3 64.7 1366 323 D S >> - 0 0 50 1,-0.1 4,-1.6 4,-0.0 3,-1.3 -0.390 33.5-108.4 -82.4 159.8 9.1 15.8 64.8 1367 324 D E H 3> S+ 0 0 46 1,-0.3 4,-1.9 2,-0.2 5,-0.2 0.852 119.5 57.2 -59.6 -40.4 6.7 15.9 61.9 1368 325 D P H 3> S+ 0 0 90 0, 0.0 4,-1.0 0, 0.0 -1,-0.3 0.741 109.4 47.8 -58.0 -25.3 7.1 19.7 61.5 1369 326 D D H <> S+ 0 0 19 -3,-1.3 4,-1.7 2,-0.2 -2,-0.2 0.745 104.3 57.3 -90.5 -26.6 10.9 19.0 61.1 1370 327 D K H X S+ 0 0 44 -4,-1.6 4,-2.7 2,-0.2 5,-0.2 0.893 109.3 47.3 -64.6 -40.3 10.4 16.2 58.5 1371 328 D I H X S+ 0 0 92 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.914 111.5 51.4 -62.6 -41.1 8.5 18.8 56.4 1372 329 D K H X S+ 0 0 95 -4,-1.0 4,-1.2 1,-0.2 -2,-0.2 0.807 111.2 48.6 -65.9 -31.4 11.4 21.2 57.1 1373 330 D I H X S+ 0 0 0 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.933 110.6 48.5 -72.2 -49.5 13.8 18.6 56.0 1374 331 D V H < S+ 0 0 34 -4,-2.7 -105,-0.3 1,-0.2 -2,-0.2 0.856 112.0 50.3 -61.4 -36.9 12.0 17.7 52.7 1375 332 D K H < S+ 0 0 50 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.879 121.6 31.1 -68.4 -36.4 11.7 21.4 51.8 1376 333 D N H >< S+ 0 0 30 -4,-1.2 3,-0.9 -5,-0.2 5,-0.2 0.602 94.1 98.5-103.6 -14.0 15.4 22.2 52.3 1377 334 D Y T 3< S+ 0 0 2 -4,-2.2 -108,-0.2 1,-0.2 -27,-0.1 -0.513 86.2 18.0 -81.0 143.8 17.3 19.0 51.5 1378 335 D G T 3 S+ 0 0 2 -29,-1.3 2,-0.5 1,-0.3 -1,-0.2 0.547 90.2 126.5 80.8 7.0 19.0 18.5 48.1 1379 336 D K < - 0 0 72 -3,-0.9 2,-2.3 2,-0.1 -1,-0.3 -0.871 62.8-134.0-101.7 129.7 18.9 22.3 47.2 1380 337 D N + 0 0 114 -2,-0.5 2,-0.4 -30,-0.1 -30,-0.1 -0.352 69.1 114.1 -80.4 62.5 22.2 23.8 46.2 1381 338 D N >> - 0 0 65 -2,-2.3 4,-2.2 -5,-0.2 3,-1.0 -0.962 65.1-141.3-147.6 117.3 21.6 26.8 48.4 1382 339 D L H 3> S+ 0 0 139 -2,-0.4 4,-2.4 1,-0.3 5,-0.2 0.801 102.7 52.6 -51.8 -40.2 23.6 27.8 51.5 1383 340 D A H 3> S+ 0 0 60 1,-0.2 4,-1.5 2,-0.2 -1,-0.3 0.879 111.0 47.3 -68.2 -37.6 20.5 29.0 53.4 1384 341 D C H <> S+ 0 0 16 -3,-1.0 4,-1.6 2,-0.2 -2,-0.2 0.897 111.2 50.7 -66.1 -42.5 18.7 25.6 52.8 1385 342 D V H X S+ 0 0 24 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.906 107.2 54.7 -63.4 -39.8 21.8 23.7 53.8 1386 343 D K H X S+ 0 0 157 -4,-2.4 4,-2.4 -5,-0.2 5,-0.2 0.868 102.8 56.8 -62.7 -37.5 22.1 25.7 57.0 1387 344 D V H X S+ 0 0 37 -4,-1.5 4,-2.0 2,-0.2 -1,-0.2 0.952 112.3 41.3 -56.3 -46.2 18.5 24.8 57.9 1388 345 D I H X S+ 0 0 0 -4,-1.6 4,-1.9 1,-0.2 -2,-0.2 0.890 112.7 53.2 -72.7 -38.9 19.4 21.1 57.8 1389 346 D D H X S+ 0 0 32 -4,-2.6 4,-1.6 2,-0.2 -1,-0.2 0.895 108.7 51.4 -60.6 -39.2 22.8 21.6 59.5 1390 347 D S H X S+ 0 0 61 -4,-2.4 4,-3.4 1,-0.2 -2,-0.2 0.919 106.2 52.8 -71.4 -40.2 21.0 23.3 62.4 1391 348 D L H X S+ 0 0 3 -4,-2.0 4,-2.7 1,-0.2 -1,-0.2 0.908 107.2 54.0 -51.9 -42.9 18.5 20.5 62.7 1392 349 D Y H <>S+ 0 0 1 -4,-1.9 5,-2.0 2,-0.2 6,-0.4 0.855 111.5 44.4 -63.2 -34.9 21.6 18.2 63.0 1393 350 D E H ><5S+ 0 0 73 -4,-1.6 3,-1.8 3,-0.2 -2,-0.2 0.942 112.9 52.3 -67.3 -49.9 22.9 20.4 65.8 1394 351 D Q H 3<5S+ 0 0 124 -4,-3.4 -2,-0.2 1,-0.3 -3,-0.2 0.889 108.6 48.6 -55.9 -43.9 19.4 20.5 67.4 1395 352 D Y T 3<5S- 0 0 47 -4,-2.7 -1,-0.3 -5,-0.2 -2,-0.1 0.200 111.0-120.0 -90.8 18.7 19.0 16.7 67.4 1396 353 D K T X>5 + 0 0 40 -3,-1.8 4,-1.7 1,-0.1 3,-0.5 0.833 50.7 164.1 57.8 40.4 22.5 16.2 69.0 1397 354 D I H 3>< + 0 0 2 -5,-2.0 4,-2.3 1,-0.2 5,-0.1 0.818 68.6 62.9 -64.7 -32.7 23.7 14.2 66.0 1398 355 D R H 3> S+ 0 0 133 -6,-0.4 4,-2.1 1,-0.2 -1,-0.2 0.920 106.2 45.7 -53.9 -47.2 27.4 14.6 67.1 1399 356 D K H <> S+ 0 0 152 -3,-0.5 4,-2.0 1,-0.2 -2,-0.2 0.876 110.4 53.7 -64.7 -39.1 26.6 12.7 70.3 1400 357 D H H X S+ 0 0 51 -4,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.843 108.0 50.3 -66.0 -34.4 24.7 10.1 68.4 1401 358 D Y H X S+ 0 0 5 -4,-2.3 4,-3.0 2,-0.2 5,-0.3 0.981 106.0 54.1 -64.2 -56.6 27.7 9.5 66.2 1402 359 D E H X S+ 0 0 93 -4,-2.1 4,-1.5 1,-0.3 -2,-0.2 0.895 110.8 49.2 -40.2 -48.4 30.1 9.1 69.2 1403 360 D S H X S+ 0 0 79 -4,-2.0 4,-1.8 2,-0.2 -1,-0.3 0.908 111.1 47.3 -61.8 -45.7 27.7 6.5 70.4 1404 361 D Y H X S+ 0 0 29 -4,-1.9 4,-2.5 -3,-0.3 5,-0.3 0.940 108.5 54.9 -60.9 -48.9 27.6 4.6 67.1 1405 362 D E H X S+ 0 0 51 -4,-3.0 4,-1.7 1,-0.2 -1,-0.2 0.840 108.7 49.9 -52.3 -37.7 31.4 4.7 66.7 1406 363 D K H X S+ 0 0 164 -4,-1.5 4,-1.3 -5,-0.3 -1,-0.2 0.938 113.7 42.7 -70.7 -48.7 31.7 3.0 70.1 1407 364 D A H X S+ 0 0 63 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.849 115.9 47.7 -66.5 -37.6 29.2 0.1 69.5 1408 365 D Q H X S+ 0 0 20 -4,-2.5 4,-3.2 2,-0.2 -1,-0.2 0.903 105.3 57.3 -75.5 -42.4 30.4 -0.6 66.0 1409 366 D K H X S+ 0 0 45 -4,-1.7 4,-2.5 -5,-0.3 -1,-0.2 0.882 110.7 47.2 -51.2 -40.1 34.1 -0.7 66.9 1410 367 D A H X S+ 0 0 59 -4,-1.3 4,-2.4 2,-0.2 -2,-0.2 0.940 109.7 50.4 -67.1 -50.6 33.0 -3.4 69.4 1411 368 D K H X S+ 0 0 45 -4,-2.3 4,-1.5 1,-0.2 -2,-0.2 0.902 114.1 48.8 -54.6 -38.5 30.9 -5.3 66.7 1412 369 D I H X S+ 0 0 0 -4,-3.2 4,-2.1 2,-0.2 3,-0.4 0.951 109.5 47.4 -67.6 -54.9 34.0 -5.1 64.5 1413 370 D L H X S+ 0 0 55 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.852 109.2 57.5 -54.3 -36.5 36.6 -6.3 67.1 1414 371 D S H < S+ 0 0 83 -4,-2.4 4,-0.3 1,-0.2 -1,-0.2 0.914 108.6 45.0 -61.1 -41.7 34.2 -9.2 67.9 1415 372 D A H >< S+ 0 0 27 -4,-1.5 3,-1.0 -3,-0.4 -2,-0.2 0.860 110.1 54.6 -68.9 -38.6 34.3 -10.3 64.2 1416 373 D I H >< S+ 0 0 0 -4,-2.1 3,-1.8 1,-0.2 4,-0.3 0.906 102.2 57.4 -62.0 -42.0 38.1 -10.0 64.0 1417 374 D N T 3< S+ 0 0 75 -4,-2.1 -1,-0.2 1,-0.3 3,-0.2 0.564 98.1 62.3 -70.5 -7.6 38.5 -12.3 67.0 1418 375 D E T < S+ 0 0 109 -3,-1.0 -1,-0.3 -4,-0.3 -2,-0.2 0.412 83.5 79.5 -93.2 -0.7 36.6 -15.0 65.2 1419 376 D L S < S- 0 0 11 -3,-1.8 -1,-0.2 -4,-0.2 -2,-0.2 0.810 81.0-151.2 -71.3 -34.3 39.2 -15.3 62.4 1420 377 D H + 0 0 139 -4,-0.3 2,-0.3 -3,-0.2 -3,-0.1 0.933 59.0 114.5 55.5 49.6 41.5 -17.4 64.5 1421 378 D H > - 0 0 55 -5,-0.3 4,-2.5 1,-0.1 5,-0.2 -0.785 52.9-159.9-146.7 104.3 44.5 -16.0 62.6 1422 379 D E H > S+ 0 0 173 -2,-0.3 4,-1.6 1,-0.2 5,-0.1 0.731 86.2 51.8 -63.3 -28.9 46.8 -14.0 64.8 1423 380 D G H > S+ 0 0 15 2,-0.2 4,-2.4 -283,-0.2 -1,-0.2 0.950 113.2 41.0 -72.5 -53.6 48.6 -12.1 61.9 1424 381 D I H > S+ 0 0 0 1,-0.2 4,-3.1 2,-0.2 5,-0.3 0.933 113.5 56.9 -58.6 -44.3 45.5 -10.8 60.1 1425 382 D E H X S+ 0 0 22 -4,-2.5 4,-2.3 1,-0.2 5,-0.2 0.897 107.8 47.4 -54.1 -44.3 43.9 -10.1 63.5 1426 383 D Y H X S+ 0 0 119 -4,-1.6 4,-2.9 -5,-0.2 -1,-0.2 0.964 113.2 47.7 -60.9 -52.3 46.9 -7.8 64.3 1427 384 D V H X S+ 0 0 0 -4,-2.4 4,-2.9 1,-0.2 -2,-0.2 0.920 113.7 47.2 -59.0 -45.1 46.8 -6.0 61.0 1428 385 D L H X S+ 0 0 0 -4,-3.1 4,-2.6 2,-0.2 -1,-0.2 0.892 113.1 47.6 -66.6 -40.5 43.0 -5.4 61.2 1429 386 D K H X S+ 0 0 85 -4,-2.3 4,-1.3 -5,-0.3 -1,-0.2 0.925 113.9 48.8 -62.9 -41.5 43.2 -4.2 64.8 1430 387 D Y H X S+ 0 0 78 -4,-2.9 4,-1.8 -5,-0.2 3,-0.3 0.918 112.2 48.3 -63.4 -43.9 46.1 -1.9 63.8 1431 388 D L H X S+ 0 0 8 -4,-2.9 4,-0.9 1,-0.2 -2,-0.2 0.919 104.7 59.5 -60.0 -47.2 44.1 -0.7 60.8 1432 389 D L H < S+ 0 0 4 -4,-2.6 3,-0.3 1,-0.2 -1,-0.2 0.838 107.8 47.5 -53.8 -33.5 41.0 -0.0 63.0 1433 390 D E H < S+ 0 0 127 -4,-1.3 3,-0.5 -3,-0.3 4,-0.4 0.933 117.9 36.3 -75.8 -47.0 43.1 2.4 65.0 1434 391 D I H < S+ 0 0 23 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.293 83.3 110.1 -90.0 11.6 44.7 4.5 62.3 1435 392 D L S < S+ 0 0 3 -4,-0.9 -1,-0.2 -3,-0.3 -2,-0.1 0.812 91.2 27.4 -58.5 -32.2 41.7 4.4 60.0 1436 393 D F S S+ 0 0 63 -3,-0.5 -1,-0.2 -4,-0.2 -2,-0.1 0.759 130.4 37.2-103.0 -31.0 41.0 8.1 60.6 1437 394 D T S S- 0 0 85 -4,-0.4 2,-0.3 1,-0.2 -2,-0.1 0.949 90.8-163.2 -78.1 -73.6 44.5 9.5 61.3 1438 395 D G 0 0 11 -4,-0.2 -1,-0.2 -7,-0.1 -2,-0.1 -0.890 360.0 360.0 125.8-158.0 46.8 7.4 59.0 1439 396 D V 0 0 97 -312,-0.5 -311,-0.1 -2,-0.3 -1,-0.0 0.618 360.0 360.0 53.1 360.0 50.5 6.6 58.7