==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 22-OCT-08 3EZH . COMPND 2 MOLECULE: NITRATE/NITRITE SENSOR PROTEIN NARX; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI K12; . AUTHOR J.CHEUNG,W.A.HENDRICKSON . 227 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11471.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 188 82.8 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 . 0 0.0 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 . 0 0.0 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 . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 23 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 156 68.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 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 0 0 0 2 0 0 2 2 0 2 0 0 0 0 0 1 1 0 0 0 0 0 0 1 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 . 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 42 A G > 0 0 57 0, 0.0 4,-2.2 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 -33.9 17.4 9.2 41.3 2 43 A S H > + 0 0 21 1,-0.2 4,-1.4 2,-0.2 102,-0.1 0.869 360.0 51.1 -53.8 -41.9 14.2 11.2 40.7 3 44 A A H > S+ 0 0 2 2,-0.2 4,-1.9 1,-0.2 3,-0.4 0.928 108.3 49.1 -62.7 -49.0 16.1 13.9 38.8 4 45 A H H > S+ 0 0 73 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.887 107.7 56.8 -59.1 -40.2 17.8 11.6 36.4 5 46 A A H X S+ 0 0 4 -4,-2.2 4,-2.8 2,-0.2 5,-0.3 0.872 104.1 50.9 -63.2 -35.3 14.6 9.9 35.6 6 47 A I H X S+ 0 0 1 -4,-1.4 4,-2.6 -3,-0.4 5,-0.2 0.922 113.0 48.6 -65.8 -42.0 12.9 13.2 34.6 7 48 A N H X S+ 0 0 13 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.951 114.5 43.5 -59.5 -52.0 15.9 13.8 32.2 8 49 A K H X S+ 0 0 45 -4,-3.0 4,-0.6 2,-0.2 -2,-0.2 0.919 115.5 47.0 -65.1 -42.5 15.7 10.3 30.8 9 50 A A H >< S+ 0 0 0 -4,-2.8 3,-1.2 -5,-0.2 4,-0.4 0.919 112.8 50.4 -65.2 -45.1 11.9 10.2 30.4 10 51 A G H >X S+ 0 0 3 -4,-2.6 3,-2.3 -5,-0.3 4,-1.0 0.901 100.4 65.4 -59.0 -36.8 11.9 13.7 28.8 11 52 A S H 3X S+ 0 0 8 -4,-2.2 4,-2.5 1,-0.3 -1,-0.2 0.753 85.3 71.2 -60.2 -22.5 14.6 12.5 26.4 12 53 A L H S+ 0 0 3 -3,-2.3 4,-1.8 -4,-0.4 5,-0.2 0.933 108.6 44.4 -70.5 -48.1 10.5 13.2 23.3 14 55 A X H X S+ 0 0 8 -4,-1.0 4,-2.6 1,-0.2 -2,-0.2 0.923 111.9 53.4 -59.7 -39.6 13.6 14.3 21.7 15 56 A Q H X S+ 0 0 3 -4,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.827 105.3 55.4 -67.6 -28.4 14.3 10.7 20.5 16 57 A S H X S+ 0 0 1 -4,-1.6 4,-1.8 2,-0.2 -1,-0.2 0.921 112.6 39.7 -65.2 -47.2 10.9 10.6 19.0 17 58 A Y H X S+ 0 0 16 -4,-1.8 4,-2.7 1,-0.2 -2,-0.2 0.781 110.2 60.4 -77.0 -27.3 11.4 13.7 16.8 18 59 A R H X S+ 0 0 44 -4,-2.6 4,-0.6 -5,-0.2 -1,-0.2 0.902 107.0 46.0 -64.0 -40.2 15.0 12.7 16.1 19 60 A L H >< S+ 0 0 2 -4,-1.8 3,-0.9 2,-0.2 4,-0.3 0.893 112.2 51.8 -67.3 -37.1 13.6 9.5 14.5 20 61 A L H >< S+ 0 0 3 -4,-1.8 3,-1.6 1,-0.3 -2,-0.2 0.934 105.9 54.3 -61.8 -44.9 11.0 11.6 12.6 21 62 A A H 3< S+ 0 0 10 -4,-2.7 -1,-0.3 1,-0.3 -2,-0.2 0.658 106.5 54.0 -61.7 -16.5 13.8 13.9 11.3 22 63 A A T << S+ 0 0 29 -3,-0.9 -1,-0.3 -4,-0.6 -2,-0.2 0.419 87.1 161.2 -98.6 1.3 15.6 10.8 9.9 23 64 A V < + 0 0 1 -3,-1.6 56,-0.2 -4,-0.3 54,-0.1 -0.464 54.6 52.4 -68.6 134.1 12.6 9.5 7.9 24 65 A P S S- 0 0 80 0, 0.0 -1,-0.1 0, 0.0 53,-0.1 0.336 95.7-144.0 -74.5 134.4 12.9 7.5 5.7 25 66 A L - 0 0 28 48,-0.5 2,-0.2 51,-0.4 -2,-0.1 -0.322 18.3-171.0 -71.4 146.2 14.8 5.3 8.0 26 67 A S > - 0 0 66 -4,-0.1 3,-2.9 -2,-0.1 4,-0.3 -0.768 45.7 -87.1-128.5 173.5 17.8 3.1 6.9 27 68 A E G > S+ 0 0 152 1,-0.3 3,-1.3 -2,-0.2 -2,-0.0 0.763 122.3 69.8 -53.6 -26.5 19.8 0.4 8.6 28 69 A K G 3 S+ 0 0 168 1,-0.2 -1,-0.3 2,-0.1 4,-0.1 0.606 92.3 57.9 -68.5 -13.5 22.0 3.1 9.9 29 70 A D G X> S+ 0 0 22 -3,-2.9 4,-1.7 1,-0.2 3,-1.2 0.458 74.2 96.7 -95.8 -4.3 19.2 4.2 12.3 30 71 A K H <> S+ 0 0 48 -3,-1.3 4,-2.8 -4,-0.3 5,-0.2 0.909 80.1 58.2 -53.2 -40.4 18.8 0.9 14.0 31 72 A P H 3> S+ 0 0 80 0, 0.0 4,-2.0 0, 0.0 -1,-0.3 0.846 103.1 52.9 -60.1 -32.2 21.0 2.2 16.9 32 73 A L H <> S+ 0 0 37 -3,-1.2 4,-2.2 2,-0.2 -2,-0.2 0.904 109.6 48.0 -70.0 -38.4 18.6 5.0 17.5 33 74 A I H X S+ 0 0 11 -4,-1.7 4,-2.6 2,-0.2 5,-0.2 0.939 112.8 48.0 -67.3 -42.0 15.7 2.6 17.8 34 75 A K H X S+ 0 0 117 -4,-2.8 4,-2.7 1,-0.2 -1,-0.2 0.912 110.4 51.9 -66.6 -34.7 17.6 0.4 20.2 35 76 A E H X S+ 0 0 74 -4,-2.0 4,-2.3 -5,-0.2 -1,-0.2 0.920 111.5 46.9 -63.7 -42.2 18.6 3.4 22.3 36 77 A X H X S+ 0 0 1 -4,-2.2 4,-2.9 1,-0.2 5,-0.2 0.911 111.3 52.0 -68.5 -35.5 15.0 4.5 22.5 37 78 A E H X S+ 0 0 46 -4,-2.6 4,-2.1 2,-0.2 -2,-0.2 0.954 108.5 51.0 -61.5 -48.1 14.0 0.9 23.4 38 79 A Q H < S+ 0 0 97 -4,-2.7 4,-0.4 -5,-0.2 -2,-0.2 0.936 114.8 43.0 -57.7 -45.6 16.6 0.8 26.2 39 80 A T H >< S+ 0 0 0 -4,-2.3 3,-1.1 1,-0.2 6,-0.3 0.948 113.7 49.4 -64.9 -52.3 15.4 4.1 27.6 40 81 A A H 3< S+ 0 0 8 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.796 119.6 36.3 -62.1 -28.9 11.6 3.4 27.3 41 82 A F T 3< S+ 0 0 67 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.265 86.9 133.5-110.3 13.6 11.8 -0.0 29.0 42 83 A S <> - 0 0 20 -3,-1.1 4,-2.0 -4,-0.4 3,-0.4 -0.244 64.0-127.7 -62.7 147.0 14.5 0.7 31.6 43 84 A A H > S+ 0 0 66 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.853 110.1 63.0 -62.7 -31.6 14.0 -0.4 35.2 44 85 A E H > S+ 0 0 54 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.882 104.8 43.0 -60.8 -42.3 14.7 3.2 36.1 45 86 A L H > S+ 0 0 0 -3,-0.4 4,-2.5 -6,-0.3 -1,-0.2 0.887 114.3 50.9 -72.3 -40.7 11.7 4.6 34.2 46 87 A T H X S+ 0 0 40 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.958 110.8 48.5 -63.0 -45.5 9.4 1.9 35.5 47 88 A R H X S+ 0 0 109 -4,-3.0 4,-2.4 1,-0.2 -1,-0.2 0.903 111.6 50.9 -61.3 -37.2 10.5 2.5 39.1 48 89 A A H X S+ 0 0 8 -4,-1.6 4,-2.2 -5,-0.2 -1,-0.2 0.930 109.3 49.2 -65.6 -44.5 9.9 6.2 38.6 49 90 A A H X>S+ 0 0 0 -4,-2.5 5,-2.6 2,-0.2 4,-0.7 0.875 110.8 51.7 -62.8 -38.1 6.4 5.7 37.2 50 91 A E H ><5S+ 0 0 115 -4,-2.5 3,-1.1 4,-0.2 -2,-0.2 0.972 112.0 45.2 -62.9 -48.1 5.6 3.4 40.2 51 92 A R H 3<5S+ 0 0 150 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.852 117.9 45.1 -63.8 -33.1 6.8 6.1 42.7 52 93 A D H 3<5S- 0 0 8 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.384 111.2-112.5 -97.9 7.1 4.9 8.8 40.8 53 94 A G T <<5S+ 0 0 58 -3,-1.1 -3,-0.2 -4,-0.7 -4,-0.1 0.835 86.4 109.7 70.9 31.6 1.6 7.1 40.2 54 95 A Q >< + 0 0 27 -5,-2.6 4,-2.6 -6,-0.1 5,-0.2 0.070 28.2 118.0-124.6 23.6 2.0 6.9 36.4 55 96 A L H > S+ 0 0 52 -6,-0.6 4,-2.8 1,-0.2 5,-0.2 0.926 78.2 50.1 -62.4 -41.8 2.5 3.2 35.7 56 97 A A H > S+ 0 0 70 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.917 112.1 48.7 -62.3 -40.6 -0.6 2.8 33.6 57 98 A Q H > S+ 0 0 98 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.922 111.5 48.3 -65.1 -45.2 0.3 5.8 31.5 58 99 A L H X S+ 0 0 3 -4,-2.6 4,-2.8 1,-0.2 5,-0.2 0.927 110.2 53.1 -60.7 -43.1 3.9 4.6 31.0 59 100 A Q H X S+ 0 0 101 -4,-2.8 4,-2.5 -5,-0.2 -1,-0.2 0.884 106.9 51.9 -60.2 -40.8 2.6 1.1 30.0 60 101 A G H X S+ 0 0 44 -4,-1.8 4,-2.2 2,-0.2 5,-0.3 0.902 110.7 47.8 -60.2 -44.5 0.3 2.6 27.3 61 102 A L H X S+ 0 0 22 -4,-1.9 4,-2.5 1,-0.2 -2,-0.2 0.945 112.8 49.1 -64.0 -46.4 3.2 4.6 25.8 62 103 A Q H X S+ 0 0 27 -4,-2.8 4,-2.0 1,-0.2 5,-0.2 0.903 111.1 48.9 -58.2 -43.9 5.4 1.5 25.8 63 104 A D H X S+ 0 0 99 -4,-2.5 4,-2.7 -5,-0.2 -1,-0.2 0.946 114.3 43.7 -63.6 -45.9 2.8 -0.7 24.2 64 105 A Y H X>S+ 0 0 96 -4,-2.2 5,-2.4 1,-0.2 4,-2.2 0.857 110.1 57.6 -69.8 -34.6 2.0 1.8 21.4 65 106 A W H <>S+ 0 0 7 -4,-2.5 5,-2.4 -5,-0.3 -1,-0.2 0.956 115.4 35.3 -60.4 -46.7 5.6 2.5 20.9 66 107 A R H <5S+ 0 0 111 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.879 126.2 37.7 -75.1 -37.9 6.4 -1.2 20.2 67 108 A N H <5S+ 0 0 106 -4,-2.7 -3,-0.2 -5,-0.2 -2,-0.2 0.609 134.8 1.5 -96.4 -9.9 3.2 -2.2 18.4 68 109 A E T X5S+ 0 0 61 -4,-2.2 4,-2.3 -5,-0.2 5,-0.2 0.527 120.6 53.0-136.9 -56.1 2.3 0.9 16.3 69 110 A L H > S+ 0 0 47 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.923 113.7 47.7 -59.3 -35.3 6.5 -0.2 12.9 72 113 A A H X S+ 0 0 7 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.897 111.4 49.5 -68.5 -41.9 4.9 3.0 11.3 73 114 A L H < S+ 0 0 2 -4,-2.6 -48,-0.5 -5,-0.2 -1,-0.2 0.908 111.8 48.1 -64.6 -39.3 8.2 4.8 11.5 74 115 A X H < S+ 0 0 104 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.713 115.1 46.6 -74.0 -21.5 10.1 1.9 9.9 75 116 A R H < S+ 0 0 169 -4,-1.4 -2,-0.2 -5,-0.2 -1,-0.2 0.751 87.2 112.1 -87.4 -28.5 7.4 1.7 7.1 76 117 A A < - 0 0 9 -4,-2.0 -51,-0.4 1,-0.2 3,-0.1 -0.211 41.4-175.2 -55.1 125.4 7.2 5.5 6.4 77 118 A Q S S+ 0 0 174 1,-0.2 2,-0.3 -53,-0.1 -1,-0.2 0.524 77.1 19.2 -95.2 -9.7 8.5 6.7 3.0 78 119 A N S > S- 0 0 71 1,-0.1 3,-0.8 0, 0.0 4,-0.2 -0.980 80.8-110.2-154.9 157.3 8.0 10.3 4.0 79 120 A R G >> S+ 0 0 58 -2,-0.3 4,-1.6 -56,-0.2 3,-1.6 0.815 108.5 66.7 -60.3 -30.9 7.5 12.4 7.2 80 121 A E G 34 S+ 0 0 166 1,-0.3 4,-0.5 2,-0.2 -1,-0.2 0.813 90.8 62.1 -63.3 -33.1 3.8 13.2 6.5 81 122 A T G <4 S+ 0 0 86 -3,-0.8 -1,-0.3 1,-0.2 -2,-0.2 0.630 122.5 19.0 -73.2 -7.1 2.8 9.6 6.9 82 123 A V T <> S+ 0 0 5 -3,-1.6 4,-2.2 -4,-0.2 -2,-0.2 0.462 92.3 98.7-138.4 0.6 3.9 9.6 10.5 83 124 A S H X S+ 0 0 50 -4,-1.6 4,-2.2 1,-0.2 5,-0.2 0.845 87.9 48.1 -65.8 -31.0 4.2 13.2 11.8 84 125 A A H > S+ 0 0 79 -4,-0.5 4,-2.1 2,-0.2 -1,-0.2 0.888 109.2 53.8 -74.3 -35.5 0.8 13.2 13.5 85 126 A D H > S+ 0 0 32 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.929 113.0 44.7 -61.6 -45.3 1.6 9.9 15.3 86 127 A V H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 5,-0.2 0.913 109.2 53.7 -68.8 -41.0 4.9 11.4 16.6 87 128 A S H X S+ 0 0 54 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.932 112.1 46.0 -61.0 -41.5 3.4 14.7 17.7 88 129 A Q H X S+ 0 0 129 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.895 108.7 55.0 -70.7 -32.1 0.8 13.0 19.8 89 130 A F H X S+ 0 0 19 -4,-1.8 4,-2.2 1,-0.2 -1,-0.2 0.893 108.3 49.0 -63.9 -43.3 3.3 10.6 21.2 90 131 A V H X S+ 0 0 4 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.855 109.2 53.2 -64.4 -33.8 5.4 13.5 22.4 91 132 A A H X S+ 0 0 33 -4,-1.9 4,-1.8 -5,-0.2 -2,-0.2 0.925 109.4 48.4 -66.9 -40.1 2.2 15.1 23.9 92 133 A G H X S+ 0 0 19 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.892 111.4 50.1 -63.1 -40.1 1.6 11.8 25.8 93 134 A L H X S+ 0 0 2 -4,-2.2 4,-2.9 1,-0.2 5,-0.2 0.878 105.1 58.1 -63.6 -36.3 5.2 11.8 27.0 94 135 A D H X S+ 0 0 59 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.901 106.4 48.8 -59.5 -42.1 4.7 15.5 28.1 95 136 A Q H X S+ 0 0 147 -4,-1.8 4,-1.6 2,-0.2 -1,-0.2 0.911 111.9 48.9 -66.4 -36.3 1.8 14.3 30.4 96 137 A L H X S+ 0 0 1 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.940 113.6 44.5 -66.8 -47.7 4.0 11.5 31.8 97 138 A V H X S+ 0 0 0 -4,-2.9 4,-1.9 1,-0.2 -1,-0.2 0.887 112.3 53.0 -65.2 -38.6 7.0 13.8 32.5 98 139 A S H X S+ 0 0 64 -4,-2.4 4,-2.2 -5,-0.2 -1,-0.2 0.823 109.2 50.6 -62.4 -34.9 4.6 16.5 34.0 99 140 A G H X S+ 0 0 10 -4,-1.6 4,-1.7 2,-0.2 5,-0.3 0.919 108.0 50.4 -69.3 -45.1 3.2 13.7 36.2 100 141 A F H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 5,-0.2 0.859 110.4 56.0 -58.5 -35.6 6.8 12.8 37.3 101 142 A D H X S+ 0 0 13 -4,-1.9 4,-2.8 -5,-0.2 5,-0.3 0.955 104.6 46.2 -61.9 -56.5 7.1 16.5 38.0 102 143 A R H X S+ 0 0 160 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.959 119.7 40.0 -53.1 -56.1 4.3 17.1 40.4 103 144 A T H X S+ 0 0 24 -4,-1.7 4,-2.4 1,-0.2 -1,-0.2 0.905 116.7 49.4 -61.6 -46.2 5.1 14.1 42.5 104 145 A T H X S+ 0 0 0 -4,-2.4 4,-1.8 -5,-0.3 -1,-0.2 0.901 108.4 50.5 -62.5 -45.0 8.8 14.5 42.4 105 146 A E H X S+ 0 0 36 -4,-2.8 4,-2.5 -5,-0.2 5,-0.2 0.951 112.9 49.7 -59.8 -44.1 8.9 18.2 43.4 106 147 A X H X S+ 0 0 98 -4,-1.9 4,-1.8 -5,-0.3 -2,-0.2 0.909 106.6 52.6 -58.6 -48.9 6.6 17.3 46.3 107 148 A R H < S+ 0 0 83 -4,-2.4 -1,-0.2 1,-0.2 4,-0.2 0.839 112.9 46.9 -59.1 -32.9 8.7 14.4 47.5 108 149 A I H >< S+ 0 0 55 -4,-1.8 3,-1.0 -3,-0.2 4,-0.2 0.938 112.8 46.3 -76.0 -46.0 11.8 16.7 47.5 109 150 A E H 3< S+ 0 0 142 -4,-2.5 3,-0.2 1,-0.2 -2,-0.2 0.697 118.7 42.3 -70.9 -19.1 10.1 19.6 49.3 110 151 A T T 3X S+ 0 0 52 -4,-1.8 4,-1.5 -5,-0.2 -1,-0.2 0.321 75.9 110.3-107.5 5.0 8.6 17.4 52.0 111 152 A A T <4 S+ 0 0 68 -3,-1.0 -1,-0.1 -4,-0.2 -2,-0.1 0.772 78.6 60.6 -49.2 -27.0 11.6 15.2 52.5 112 153 A A T 4 S+ 0 0 74 -4,-0.2 2,-5.4 -3,-0.2 0, 0.0 -0.076 101.1 38.6 -80.4-166.3 11.7 17.0 55.8 113 154 A A T 4 0 0 109 1,-0.3 -2,-0.1 -2,-0.1 -1,-0.1 -0.072 360.0 360.0 57.9 -58.0 8.5 16.3 57.8 114 155 A L < 0 0 169 -2,-5.4 -1,-0.3 -4,-1.5 -2,-0.1 0.165 360.0 360.0 -79.4 360.0 8.6 12.7 56.6 115 !* 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 0.0 116 42 B G > 0 0 58 0, 0.0 4,-1.2 0, 0.0 47,-0.1 0.000 360.0 360.0 360.0-165.9 11.4 23.9 41.2 117 43 B S H > + 0 0 25 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.899 360.0 53.7 -74.7 -45.7 14.3 21.9 40.0 118 44 B A H > S+ 0 0 2 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.889 110.7 49.5 -58.1 -39.4 12.4 18.8 38.7 119 45 B H H > S+ 0 0 56 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.863 107.7 52.4 -68.5 -38.3 10.4 21.2 36.6 120 46 B A H X S+ 0 0 3 -4,-1.2 4,-2.8 2,-0.2 5,-0.4 0.855 106.2 54.1 -67.0 -32.9 13.5 23.0 35.2 121 47 B I H X S+ 0 0 1 -4,-2.0 4,-1.7 2,-0.2 -1,-0.2 0.906 111.6 46.8 -67.0 -36.9 14.9 19.6 34.1 122 48 B N H X S+ 0 0 5 -4,-1.5 4,-2.0 -5,-0.2 -2,-0.2 0.961 116.1 43.4 -66.5 -49.7 11.6 19.0 32.2 123 49 B K H X S+ 0 0 70 -4,-2.7 4,-0.8 2,-0.2 -2,-0.2 0.920 116.2 45.1 -67.6 -44.2 11.6 22.5 30.6 124 50 B A H >X S+ 0 0 0 -4,-2.8 3,-1.0 1,-0.2 4,-0.5 0.931 112.7 53.9 -64.5 -41.1 15.3 22.6 29.7 125 51 B G H >X S+ 0 0 2 -4,-1.7 3,-2.0 -5,-0.4 4,-1.0 0.900 98.6 63.9 -59.7 -38.5 14.9 19.0 28.4 126 52 B S H 3X S+ 0 0 5 -4,-2.0 4,-2.8 1,-0.3 -1,-0.3 0.781 88.0 68.3 -59.9 -27.3 12.1 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0 11 -3,-2.5 4,-1.4 1,-0.2 3,-1.0 0.496 74.6 98.1 -92.0 -3.8 6.1 27.2 11.7 145 71 B K H <> S+ 0 0 103 -3,-1.7 4,-2.2 -4,-0.3 5,-0.2 0.855 79.6 58.1 -53.6 -33.8 6.6 30.7 13.2 146 72 B P H 3> S+ 0 0 85 0, 0.0 4,-2.5 0, 0.0 -1,-0.3 0.885 100.4 57.2 -65.4 -33.6 4.7 29.5 16.3 147 73 B L H <> S+ 0 0 35 -3,-1.0 4,-2.2 2,-0.2 5,-0.2 0.932 107.9 48.0 -59.6 -43.5 7.4 26.8 16.9 148 74 B I H X S+ 0 0 35 -4,-1.4 4,-2.2 1,-0.2 -1,-0.2 0.927 112.1 47.3 -65.2 -46.9 10.1 29.4 16.9 149 75 B K H X S+ 0 0 137 -4,-2.2 4,-2.9 1,-0.2 -1,-0.2 0.910 110.4 53.5 -62.4 -37.7 8.3 31.7 19.3 150 76 B E H X S+ 0 0 87 -4,-2.5 4,-2.3 -5,-0.2 -2,-0.2 0.920 109.4 47.3 -64.0 -38.9 7.6 28.8 21.6 151 77 B X H X S+ 0 0 2 -4,-2.2 4,-2.9 2,-0.2 5,-0.2 0.911 111.6 52.0 -68.7 -36.6 11.3 27.8 21.7 152 78 B E H X S+ 0 0 94 -4,-2.2 4,-2.0 -5,-0.2 -2,-0.2 0.946 109.0 50.4 -62.0 -46.1 12.2 31.4 22.4 153 79 B Q H < S+ 0 0 113 -4,-2.9 4,-0.4 1,-0.2 -2,-0.2 0.924 115.1 42.9 -59.9 -42.7 9.7 31.5 25.3 154 80 B T H >< S+ 0 0 5 -4,-2.3 3,-1.1 -5,-0.2 6,-0.3 0.950 113.0 50.9 -66.3 -51.1 11.1 28.4 26.8 155 81 B A H 3< S+ 0 0 7 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.805 120.4 33.8 -59.0 -33.1 14.8 29.3 26.2 156 82 B F T 3< S+ 0 0 72 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.275 87.1 137.2-108.3 12.5 14.5 32.7 27.9 157 83 B S <> - 0 0 15 -3,-1.1 4,-1.9 -4,-0.4 5,-0.2 -0.114 63.4-123.3 -60.7 151.5 11.9 31.9 30.5 158 84 B A H > S+ 0 0 59 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.869 110.1 58.7 -63.3 -34.9 12.3 33.3 34.0 159 85 B E H > S+ 0 0 97 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.897 107.6 41.7 -61.6 -48.5 12.2 29.7 35.3 160 86 B L H > S+ 0 0 0 -6,-0.3 4,-2.6 2,-0.2 5,-0.2 0.877 114.0 53.7 -67.9 -39.4 15.1 28.3 33.4 161 87 B T H X S+ 0 0 34 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.959 111.8 44.0 -60.5 -49.7 17.2 31.5 34.1 162 88 B R H X S+ 0 0 129 -4,-2.5 4,-2.7 1,-0.2 5,-0.2 0.911 113.9 50.9 -62.9 -40.2 16.6 31.2 37.8 163 89 B A H X S+ 0 0 13 -4,-2.1 4,-2.0 -5,-0.2 -1,-0.2 0.911 111.1 47.8 -63.2 -39.4 17.3 27.5 37.8 164 90 B A H X>S+ 0 0 0 -4,-2.6 5,-2.4 2,-0.2 4,-0.9 0.909 111.5 51.5 -68.1 -40.1 20.5 28.0 35.9 165 91 B E H ><5S+ 0 0 96 -4,-2.6 3,-0.7 4,-0.2 -2,-0.2 0.940 112.1 45.7 -59.5 -48.7 21.6 30.8 38.3 166 92 B R H 3<5S+ 0 0 188 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.882 117.0 44.8 -64.2 -33.8 21.0 28.6 41.3 167 93 B D H 3<5S- 0 0 20 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.442 111.8-110.3 -94.0 2.1 22.8 25.6 39.7 168 94 B G T <<5S+ 0 0 57 -4,-0.9 -3,-0.2 -3,-0.7 4,-0.1 0.744 89.0 110.0 77.5 25.0 25.8 27.3 38.4 169 95 B Q >< + 0 0 20 -5,-2.4 4,-2.7 -6,-0.2 -4,-0.2 0.081 33.9 110.2-115.7 17.6 24.8 26.9 34.7 170 96 B L H > S+ 0 0 48 -6,-0.7 4,-3.1 1,-0.2 5,-0.2 0.941 79.0 49.3 -65.3 -41.8 24.0 30.5 33.8 171 97 B A H > S+ 0 0 72 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.899 113.0 49.2 -61.3 -39.7 27.1 31.0 31.4 172 98 B Q H > S+ 0 0 94 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.958 112.1 47.2 -64.8 -48.2 26.2 27.7 29.7 173 99 B L H X S+ 0 0 4 -4,-2.7 4,-2.9 1,-0.2 5,-0.2 0.960 111.7 51.2 -57.8 -48.7 22.5 28.8 29.3 174 100 B Q H X S+ 0 0 92 -4,-3.1 4,-2.3 1,-0.2 -1,-0.2 0.882 108.8 51.2 -56.1 -39.2 23.6 32.2 28.0 175 101 B G H X S+ 0 0 37 -4,-2.1 4,-2.3 -5,-0.2 -1,-0.2 0.893 111.3 47.2 -65.1 -39.7 25.9 30.6 25.4 176 102 B L H X S+ 0 0 26 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.891 111.0 52.2 -70.6 -38.0 23.1 28.3 24.2 177 103 B Q H X S+ 0 0 20 -4,-2.9 4,-2.1 -5,-0.2 5,-0.2 0.919 110.9 47.0 -61.7 -44.4 20.8 31.2 24.0 178 104 B D H X S+ 0 0 78 -4,-2.3 4,-2.8 -5,-0.2 5,-0.3 0.909 113.0 48.5 -64.7 -40.1 23.2 33.3 22.0 179 105 B Y H X>S+ 0 0 90 -4,-2.3 5,-2.7 2,-0.2 4,-2.4 0.888 109.4 53.2 -65.8 -40.4 23.9 30.3 19.6 180 106 B W H <>S+ 0 0 15 -4,-2.5 5,-2.6 3,-0.2 -2,-0.2 0.942 117.2 37.8 -59.2 -47.0 20.2 29.7 19.2 181 107 B R H <5S+ 0 0 118 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.898 125.2 35.2 -73.2 -43.8 19.6 33.3 18.2 182 108 B N H <5S+ 0 0 105 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.2 0.719 135.2 6.2 -90.1 -17.4 22.7 34.0 16.1 183 109 B E T X5S+ 0 0 58 -4,-2.4 4,-1.8 -5,-0.3 -3,-0.2 0.698 119.5 49.3-129.7 -50.5 23.3 30.7 14.4 184 110 B L H > S+ 0 0 35 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.933 113.4 46.9 -55.6 -41.6 19.0 31.5 11.0 187 113 B A H X S+ 0 0 10 -4,-1.8 4,-0.8 1,-0.2 -2,-0.2 0.897 111.5 48.4 -67.7 -40.1 20.4 28.2 9.7 188 114 B L H < S+ 0 0 1 -4,-2.4 -48,-0.5 1,-0.2 3,-0.3 0.878 110.2 54.3 -68.1 -35.9 17.1 26.3 10.2 189 115 B X H < S+ 0 0 112 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.836 111.7 42.2 -70.1 -32.5 15.2 29.1 8.4 190 116 B R H < S+ 0 0 173 -4,-1.7 -1,-0.2 -5,-0.2 2,-0.2 0.620 87.8 111.8 -92.6 -5.7 17.4 29.1 5.3 191 117 B A < - 0 0 7 -4,-0.8 -51,-0.3 -3,-0.3 3,-0.1 -0.453 41.4-174.4 -69.3 132.2 17.7 25.3 4.9 192 118 B Q S S+ 0 0 164 1,-0.2 2,-0.3 -2,-0.2 -1,-0.2 0.724 77.3 27.2 -89.9 -32.1 15.9 23.8 1.9 193 119 B N S > S- 0 0 61 1,-0.1 3,-1.1 -54,-0.0 4,-0.3 -0.967 78.3-120.9-130.9 154.3 16.8 20.2 3.0 194 120 B R G >> S+ 0 0 55 -2,-0.3 4,-2.0 -56,-0.3 3,-1.7 0.840 103.3 72.3 -59.8 -35.5 17.4 18.6 6.4 195 121 B E G 34 S+ 0 0 161 1,-0.3 4,-0.4 2,-0.2 -1,-0.2 0.769 91.0 55.7 -56.0 -31.3 21.0 17.5 5.4 196 122 B T G <4 S+ 0 0 104 -3,-1.1 -1,-0.3 1,-0.2 -2,-0.2 0.663 124.2 21.0 -78.4 -12.0 22.5 21.0 5.4 197 123 B V T <> S+ 0 0 4 -3,-1.7 4,-2.1 -4,-0.3 -2,-0.2 0.408 93.4 96.2-135.6 -2.8 21.5 21.7 9.1 198 124 B S H X S+ 0 0 44 -4,-2.0 4,-2.2 1,-0.2 5,-0.2 0.907 87.5 49.4 -61.5 -42.1 20.9 18.3 10.7 199 125 B A H > S+ 0 0 79 -4,-0.4 4,-2.2 2,-0.2 -1,-0.2 0.910 109.7 52.7 -63.1 -37.1 24.4 18.0 12.2 200 126 B D H > S+ 0 0 27 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.897 109.4 50.1 -62.9 -42.6 24.1 21.6 13.6 201 127 B V H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.949 110.4 47.6 -63.3 -43.6 20.8 20.6 15.3 202 128 B S H X S+ 0 0 49 -4,-2.2 4,-1.7 1,-0.2 -2,-0.2 0.865 111.9 52.9 -65.5 -33.7 22.3 17.4 16.9 203 129 B Q H X S+ 0 0 130 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.919 107.5 48.5 -66.6 -47.3 25.2 19.5 18.1 204 130 B F H X S+ 0 0 13 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.899 110.1 53.9 -58.1 -42.3 23.0 22.1 19.8 205 131 B V H X S+ 0 0 4 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.834 104.9 53.3 -62.5 -35.2 21.1 19.2 21.4 206 132 B A H X S+ 0 0 39 -4,-1.7 4,-1.8 2,-0.2 -1,-0.2 0.919 108.5 50.7 -66.8 -38.4 24.3 17.8 22.8 207 133 B G H X S+ 0 0 26 -4,-2.0 4,-1.4 1,-0.2 -2,-0.2 0.919 111.4 47.4 -61.7 -45.5 25.0 21.3 24.3 208 134 B L H X S+ 0 0 2 -4,-2.3 4,-3.0 2,-0.2 5,-0.2 0.871 104.0 62.1 -60.0 -37.5 21.5 21.2 25.8 209 135 B D H X S+ 0 0 55 -4,-2.4 4,-3.2 1,-0.2 5,-0.2 0.909 104.2 49.2 -54.0 -44.1 22.2 17.7 27.1 210 136 B Q H X S+ 0 0 128 -4,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.909 109.6 50.6 -64.3 -35.0 25.0 19.2 29.2 211 137 B L H X S+ 0 0 1 -4,-1.4 4,-2.2 2,-0.2 -2,-0.2 0.956 115.1 43.6 -65.8 -49.9 22.7 21.9 30.5 212 138 B V H X S+ 0 0 0 -4,-3.0 4,-2.9 1,-0.2 -2,-0.2 0.916 111.4 52.4 -61.1 -43.8 20.1 19.3 31.5 213 139 B S H X S+ 0 0 33 -4,-3.2 4,-3.3 -5,-0.2 5,-0.3 0.885 109.0 53.5 -59.7 -36.3 22.7 17.0 33.0 214 140 B G H X S+ 0 0 2 -4,-2.1 4,-2.7 -5,-0.2 5,-0.3 0.955 111.2 43.0 -61.0 -53.5 23.9 20.0 35.0 215 141 B F H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.907 116.5 50.2 -55.8 -45.9 20.4 20.7 36.5 216 142 B D H X S+ 0 0 11 -4,-2.9 4,-2.5 -5,-0.2 -2,-0.2 0.977 113.7 42.2 -62.0 -56.7 19.9 17.0 37.0 217 143 B R H X S+ 0 0 145 -4,-3.3 4,-2.9 1,-0.2 -2,-0.2 0.869 115.1 49.8 -62.6 -35.5 23.2 16.4 38.9 218 144 B T H X S+ 0 0 25 -4,-2.7 4,-1.8 -5,-0.3 -1,-0.2 0.898 110.7 50.0 -71.1 -36.9 23.0 19.5 41.0 219 145 B T H X S+ 0 0 6 -4,-2.2 4,-1.9 -5,-0.3 -2,-0.2 0.931 113.1 46.7 -64.5 -43.5 19.5 18.7 42.0 220 146 B E H X S+ 0 0 53 -4,-2.5 4,-2.7 1,-0.2 5,-0.3 0.930 109.1 53.9 -61.3 -48.7 20.6 15.2 42.9 221 147 B X H X S+ 0 0 102 -4,-2.9 4,-1.7 1,-0.3 -1,-0.2 0.841 106.9 52.3 -57.1 -33.3 23.6 16.5 44.8 222 148 B R H X S+ 0 0 126 -4,-1.8 4,-2.3 2,-0.2 -1,-0.3 0.921 109.5 51.0 -67.2 -43.6 21.2 18.7 46.8 223 149 B I H X S+ 0 0 53 -4,-1.9 4,-2.5 1,-0.2 -2,-0.2 0.949 111.6 45.4 -55.4 -56.0 19.2 15.6 47.6 224 150 B E H X S+ 0 0 121 -4,-2.7 4,-2.7 2,-0.2 -1,-0.2 0.791 108.5 56.5 -62.4 -31.8 22.2 13.7 48.8 225 151 B T H < S+ 0 0 91 -4,-1.7 -1,-0.2 -5,-0.3 -2,-0.2 0.958 108.7 47.2 -67.5 -43.1 23.5 16.6 50.9 226 152 B A H < S+ 0 0 85 -4,-2.3 -2,-0.2 2,-0.2 -1,-0.2 0.941 112.8 51.3 -60.0 -44.9 20.1 16.6 52.7 227 153 B A H < 0 0 85 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.957 360.0 360.0 -53.9 -59.4 20.4 12.8 53.1 228 154 B A < 0 0 119 -4,-2.7 -1,-0.2 -5,-0.1 -2,-0.2 0.767 360.0 360.0 -56.3 360.0 23.9 12.9 54.6