==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 10-FEB-03 1NXH . COMPND 2 MOLECULE: MTH396 PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: METHANOTHERMOBACTER . AUTHOR R.KHAYAT,A.SAVCHENKO,A.EDWARDS,C.AROWSMITH,L.TONG,NORTHEAST . 242 3 2 0 2 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13412.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 199 82.2 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 . 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 . 7 2.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 11.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 143 59.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 6.2 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 2 0 2 0 0 0 2 2 4 0 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0 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 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 3 A E > 0 0 216 0, 0.0 2,-2.3 0, 0.0 3,-0.7 0.000 360.0 360.0 360.0 -7.7 52.5 5.8 12.9 2 4 A G T 3> + 0 0 26 1,-0.2 4,-1.1 2,-0.1 3,-0.2 0.003 360.0 131.6 -69.0 38.3 52.8 9.0 10.9 3 5 A E H 3> + 0 0 105 -2,-2.3 4,-1.4 1,-0.2 3,-0.4 0.921 56.5 65.5 -56.9 -49.2 54.4 10.3 14.1 4 6 A L H X> S+ 0 0 107 -3,-0.7 4,-2.9 1,-0.2 3,-1.2 0.887 98.7 51.8 -39.4 -60.2 57.3 11.9 12.2 5 7 A X H 3> S+ 0 0 102 1,-0.3 4,-2.4 2,-0.2 5,-0.4 0.900 104.2 56.6 -44.4 -54.2 55.1 14.4 10.4 6 8 A R H 3X S+ 0 0 126 -4,-1.1 4,-1.4 -3,-0.4 -1,-0.3 0.821 114.9 41.1 -47.8 -36.0 53.6 15.6 13.7 7 9 A L H < S+ 0 0 30 -4,-0.8 3,-2.3 -3,-0.3 6,-0.3 0.926 110.9 50.9 -66.2 -47.2 58.3 24.7 12.6 13 15 A L H 3< S+ 0 0 0 -4,-2.7 6,-0.3 1,-0.3 -1,-0.2 0.897 110.6 51.5 -58.1 -35.7 55.7 26.1 14.9 14 16 A E T 3< S+ 0 0 111 -4,-1.5 -1,-0.3 -5,-0.3 -2,-0.2 0.422 88.5 118.2 -79.9 3.3 58.4 25.9 17.6 15 17 A S S <> S- 0 0 36 -3,-2.3 4,-1.5 1,-0.1 5,-0.1 -0.139 71.2-127.6 -60.5 165.5 60.6 27.8 15.2 16 18 A Y H > S+ 0 0 175 2,-0.2 4,-2.8 3,-0.1 5,-0.3 0.951 106.0 50.9 -81.8 -55.7 61.7 31.2 16.4 17 19 A R H > S+ 0 0 132 1,-0.2 4,-1.6 2,-0.2 5,-0.2 0.827 115.6 46.5 -51.0 -33.9 60.6 33.4 13.5 18 20 A W H >>S+ 0 0 4 -6,-0.3 4,-3.6 2,-0.2 5,-0.7 0.986 110.3 49.0 -71.5 -61.7 57.2 31.7 13.8 19 21 A Q H <>S+ 0 0 41 -4,-1.5 5,-1.5 -6,-0.3 -2,-0.2 0.840 119.8 39.8 -45.8 -41.1 56.7 32.0 17.5 20 22 A E H <5S+ 0 0 72 -4,-2.8 -1,-0.2 4,-0.2 -2,-0.2 0.809 126.0 31.9 -82.7 -32.0 57.7 35.7 17.4 21 23 A D H <5S+ 0 0 54 -4,-1.6 -2,-0.2 -5,-0.3 -3,-0.2 0.624 135.2 3.3-101.9 -16.0 56.0 36.7 14.1 22 24 A V T X5S+ 0 0 2 -4,-3.6 4,-2.5 -5,-0.2 -3,-0.2 0.621 120.4 46.9-132.5 -70.0 52.9 34.5 14.1 23 25 A V T 44 S+ 0 0 63 0, 0.0 2,-3.8 0, 0.0 3,-0.6 0.846 91.5 75.3 -43.6 -45.3 51.5 37.9 17.9 26 28 A L T 3< + 0 0 6 -4,-2.5 3,-0.3 1,-0.3 11,-0.1 -0.166 59.1 117.5 -68.0 50.0 48.1 36.3 16.9 27 29 A S T >> + 0 0 54 -2,-3.8 3,-0.7 1,-0.2 4,-0.6 0.367 39.3 102.9 -93.8 -2.5 47.2 36.9 20.6 28 30 A R T <4 + 0 0 129 -3,-0.6 -1,-0.2 1,-0.3 -2,-0.1 0.420 67.5 68.2 -63.0 1.0 44.5 39.2 19.3 29 31 A E T >4 S- 0 0 3 -3,-0.3 3,-1.1 165,-0.0 -1,-0.3 -0.207 134.0 -85.6-112.2 41.9 41.9 36.5 19.9 30 32 A L G X4 - 0 0 130 -3,-0.7 3,-0.8 1,-0.3 -2,-0.2 0.757 66.7-117.0 57.4 12.5 42.1 36.6 23.7 31 33 A E G 3< - 0 0 11 -4,-0.6 6,-0.4 1,-0.3 -1,-0.3 0.484 21.9-125.1 27.6 17.7 44.7 34.3 22.0 32 34 A I G < >S- 0 0 39 -3,-1.1 5,-0.6 -5,-0.1 4,-0.4 0.734 70.6 -55.4 14.1 58.7 43.1 31.3 23.7 33 35 A D T X>5 - 0 0 113 -3,-0.8 3,-1.4 3,-0.1 4,-1.0 0.874 57.2-111.1 44.2 111.5 46.5 30.7 25.1 34 36 A V H 3>5S+ 0 0 39 1,-0.3 4,-2.6 2,-0.2 5,-0.3 0.818 114.4 70.4 -27.7 -54.8 49.2 30.3 22.4 35 37 A E H 3>5S+ 0 0 138 1,-0.2 4,-1.3 2,-0.2 -1,-0.3 0.872 102.3 41.6 -33.3 -63.8 49.4 26.7 23.3 36 38 A E H X>5S+ 0 0 82 -3,-1.4 4,-2.1 -4,-0.4 3,-1.5 0.951 109.3 56.3 -52.4 -61.6 46.0 26.0 21.8 37 39 A F H 3X - 0 0 75 1,-0.1 4,-2.3 -2,-0.0 -1,-0.1 -0.304 30.9 -93.5 -87.6 178.3 49.2 20.6 6.4 47 49 A X H > S+ 0 0 41 2,-0.2 4,-2.2 1,-0.2 -1,-0.1 0.928 122.4 49.7 -58.7 -54.1 52.9 20.2 5.9 48 50 A S H 4 S+ 0 0 94 1,-0.2 -1,-0.2 2,-0.2 5,-0.1 0.919 111.3 52.9 -53.3 -44.7 53.3 21.8 2.5 49 51 A S H >> S+ 0 0 27 1,-0.2 4,-1.5 3,-0.1 3,-0.5 0.962 107.6 50.0 -54.5 -56.8 51.4 24.7 3.8 50 52 A L H 3X S+ 0 0 2 -4,-2.3 2,-1.5 1,-0.3 4,-0.6 0.862 106.6 53.4 -51.8 -46.5 53.6 25.2 6.8 51 53 A E H 3< S+ 0 0 139 -4,-2.2 -1,-0.3 1,-0.2 -2,-0.1 -0.415 118.0 39.5 -88.4 58.9 56.9 25.1 4.8 52 54 A A H <> S+ 0 0 45 -2,-1.5 4,-1.1 -3,-0.5 -2,-0.2 0.205 94.9 81.8-171.3 -28.8 55.5 27.9 2.6 53 55 A L H X S+ 0 0 3 -4,-1.5 4,-2.8 -3,-0.3 5,-0.2 0.935 79.5 58.7 -58.9 -60.8 53.6 30.2 5.0 54 56 A H H X S+ 0 0 14 -4,-0.6 4,-3.0 2,-0.2 3,-0.3 0.896 107.2 44.7 -42.5 -63.3 56.2 32.5 6.6 55 57 A P H > S+ 0 0 76 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.951 117.1 47.8 -47.1 -52.0 57.6 34.1 3.4 56 58 A R H < S+ 0 0 88 -4,-1.1 4,-0.3 1,-0.3 -2,-0.2 0.843 111.8 52.4 -56.2 -34.9 54.0 34.5 2.3 57 59 A F H >X S+ 0 0 9 -4,-2.8 4,-1.5 -3,-0.3 3,-1.0 0.892 106.4 51.0 -69.8 -42.3 53.3 35.9 5.7 58 60 A E H 3< S+ 0 0 74 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.835 107.1 54.6 -65.8 -31.9 56.1 38.4 5.5 59 61 A S T 3< S+ 0 0 89 -4,-2.0 4,-0.3 -5,-0.3 -1,-0.2 0.531 114.9 38.8 -81.1 -4.8 54.9 39.7 2.2 60 62 A A T <> S+ 0 0 5 -3,-1.0 4,-3.1 -4,-0.3 5,-0.3 0.560 86.1 93.4-116.3 -16.7 51.4 40.4 3.4 61 63 A R H X S+ 0 0 72 -4,-1.5 4,-1.2 1,-0.2 -2,-0.1 0.887 91.9 46.7 -42.7 -46.1 52.3 41.7 6.9 62 64 A P H >> S+ 0 0 44 0, 0.0 4,-2.3 0, 0.0 3,-0.7 0.966 111.8 47.7 -62.5 -55.7 52.2 45.2 5.4 63 65 A R H 3> S+ 0 0 108 -4,-0.3 4,-2.0 1,-0.3 -2,-0.2 0.898 112.0 51.3 -51.4 -45.7 49.0 44.8 3.4 64 66 A a H 3X S+ 0 0 5 -4,-3.1 4,-1.8 1,-0.2 -1,-0.3 0.784 108.7 51.3 -67.3 -26.3 47.3 43.4 6.5 65 67 A I H S+ 0 0 27 -4,-3.6 5,-2.7 2,-0.2 6,-0.4 0.909 117.0 41.2 -47.5 -47.5 42.1 51.9 7.7 71 73 A S H ><5S+ 0 0 12 -4,-2.4 3,-2.1 -5,-0.2 -2,-0.2 0.986 114.5 47.1 -65.6 -63.5 39.6 50.2 9.9 72 74 A D H 3<5S+ 0 0 15 -4,-3.3 -1,-0.2 1,-0.3 -2,-0.2 0.786 109.9 56.6 -50.8 -32.1 40.8 51.4 13.3 73 75 A L T 3<5S- 0 0 0 -4,-3.0 -1,-0.3 -5,-0.3 -2,-0.2 0.061 111.4-119.8 -90.8 24.6 41.1 54.9 12.0 74 76 A Q T <>5 + 0 0 7 -3,-2.1 4,-2.6 1,-0.1 3,-0.3 0.816 64.5 146.6 41.5 41.7 37.5 55.0 10.9 75 77 A L H >X + 0 0 1 -5,-2.7 4,-1.9 -6,-0.3 5,-1.1 0.678 55.7 72.6 -80.4 -18.1 38.5 55.5 7.4 76 78 A b H 4>S+ 0 0 7 -6,-0.4 5,-1.5 -5,-0.2 -1,-0.2 0.931 114.9 28.3 -58.2 -40.5 35.7 53.6 5.9 77 79 A W H 4>S+ 0 0 18 -3,-0.3 5,-3.1 3,-0.2 6,-0.9 0.947 118.2 53.1 -83.6 -58.5 33.7 56.6 7.0 78 80 A L H <5S+ 0 0 0 -4,-2.6 7,-2.0 4,-0.2 6,-1.2 0.771 131.9 8.8 -52.5 -27.4 36.1 59.5 6.9 79 81 A V T <5S+ 0 0 13 -4,-1.9 4,-0.3 4,-0.2 -3,-0.2 0.695 127.9 42.8-117.5 -76.1 37.0 58.6 3.3 80 82 A D T - 0 0 51 -2,-0.4 4,-2.9 1,-0.1 5,-0.1 -0.240 20.2-126.9 -60.4 148.6 41.4 63.0 0.7 87 89 A V H > S+ 0 0 83 2,-0.2 4,-3.4 1,-0.2 5,-0.3 0.910 113.1 56.7 -60.7 -42.6 42.5 59.6 -0.5 88 90 A D H > S+ 0 0 129 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.949 109.4 44.6 -53.6 -52.5 45.9 61.1 -1.0 89 91 A D H > S+ 0 0 73 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.965 114.4 50.6 -54.8 -55.2 46.0 62.1 2.7 90 92 A A H X S+ 0 0 4 -4,-2.9 4,-2.5 1,-0.2 -2,-0.2 0.902 111.3 45.4 -49.7 -54.0 44.6 58.7 3.7 91 93 A E H X S+ 0 0 76 -4,-3.4 4,-2.5 2,-0.2 -1,-0.2 0.942 112.6 51.5 -59.3 -49.2 47.1 56.6 1.8 92 94 A A H X S+ 0 0 46 -4,-2.4 4,-2.2 -5,-0.3 5,-0.2 0.940 111.0 48.5 -50.8 -54.4 50.0 58.8 3.0 93 95 A L H X S+ 0 0 4 -4,-2.9 4,-2.1 1,-0.2 5,-0.3 0.876 110.6 49.7 -54.8 -44.7 48.9 58.4 6.6 94 96 A K H X S+ 0 0 23 -4,-2.5 4,-2.3 -5,-0.2 -1,-0.2 0.876 109.4 55.4 -65.0 -34.2 48.6 54.7 6.3 95 97 A D H X S+ 0 0 67 -4,-2.5 4,-3.5 -5,-0.2 -2,-0.2 0.984 109.4 42.3 -60.3 -62.5 52.0 54.5 4.7 96 98 A E H X S+ 0 0 61 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.842 116.1 48.0 -55.3 -41.3 53.9 56.3 7.5 97 99 A I H X S+ 0 0 0 -4,-2.1 4,-2.4 -5,-0.2 5,-0.2 0.938 114.9 46.3 -66.8 -45.4 52.1 54.4 10.3 98 100 A T H X S+ 0 0 9 -4,-2.3 4,-2.9 -5,-0.3 5,-0.3 0.917 106.6 58.9 -60.2 -42.4 52.7 51.2 8.6 99 101 A E H X S+ 0 0 144 -4,-3.5 4,-0.7 -5,-0.2 -1,-0.2 0.937 109.6 46.3 -50.8 -46.6 56.3 52.2 8.0 100 102 A L H ><>S+ 0 0 62 -4,-1.9 3,-2.2 2,-0.2 5,-1.8 0.976 111.6 45.7 -59.7 -63.7 56.5 52.5 11.8 101 103 A V H ><5S+ 0 0 7 -4,-2.4 3,-1.5 1,-0.3 -1,-0.2 0.845 110.4 56.9 -53.2 -34.2 54.8 49.2 12.9 102 104 A L H 3<5S+ 0 0 68 -4,-2.9 -1,-0.3 1,-0.3 -2,-0.2 0.722 103.0 55.6 -69.7 -20.5 56.9 47.4 10.2 103 105 A A T <<5S- 0 0 85 -3,-2.2 -1,-0.3 -4,-0.7 -2,-0.2 0.154 136.2 -82.6 -97.9 18.4 60.0 48.8 11.9 104 106 A G T < 5S+ 0 0 64 -3,-1.5 -3,-0.2 1,-0.3 -2,-0.1 0.177 79.3 148.6 106.0 -18.5 59.1 47.3 15.3 105 107 A R < - 0 0 93 -5,-1.8 2,-0.4 -6,-0.2 -1,-0.3 -0.224 57.3-108.9 -52.8 134.4 56.6 50.0 16.5 106 108 A E > - 0 0 106 1,-0.2 4,-3.9 4,-0.0 5,-0.3 -0.557 22.0-135.2 -68.1 121.0 54.0 48.4 18.7 107 109 A Y H > S+ 0 0 42 -2,-0.4 4,-3.7 1,-0.2 5,-0.3 0.906 105.2 53.7 -39.1 -60.8 50.7 48.5 16.8 108 110 A S H > S+ 0 0 66 1,-0.3 4,-1.6 2,-0.2 3,-0.3 0.921 115.7 37.9 -38.1 -67.3 48.9 49.8 19.8 109 111 A E H > S+ 0 0 101 1,-0.2 4,-1.5 2,-0.2 -1,-0.3 0.910 116.3 53.6 -55.2 -45.4 51.3 52.6 20.3 110 112 A A H X S+ 0 0 0 -4,-3.9 4,-1.8 1,-0.2 -1,-0.2 0.865 104.4 54.5 -58.9 -40.4 51.6 53.2 16.5 111 113 A L H X S+ 0 0 15 -4,-3.7 4,-2.3 -5,-0.3 -1,-0.2 0.893 103.7 56.7 -61.5 -39.9 47.8 53.5 16.1 112 114 A S H X S+ 0 0 51 -4,-1.6 4,-2.3 -5,-0.3 -1,-0.2 0.928 106.7 48.4 -57.3 -46.7 47.8 56.2 18.8 113 115 A E H X S+ 0 0 50 -4,-1.5 4,-2.6 1,-0.2 -1,-0.2 0.852 110.9 51.4 -62.3 -35.5 50.3 58.3 16.8 114 116 A G H X S+ 0 0 0 -4,-1.8 4,-1.6 2,-0.2 -1,-0.2 0.843 106.0 54.1 -69.6 -33.8 48.1 57.7 13.7 115 117 A R H X S+ 0 0 67 -4,-2.3 4,-2.8 2,-0.2 5,-0.2 0.946 110.1 50.2 -62.1 -47.9 45.1 58.9 15.6 116 118 A R H X S+ 0 0 136 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.964 110.7 44.1 -54.9 -61.9 47.1 62.0 16.4 117 119 A R H X S+ 0 0 70 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.795 113.3 56.5 -58.3 -25.0 48.3 62.8 12.8 118 120 A L H X S+ 0 0 0 -4,-1.6 4,-2.8 2,-0.2 5,-0.3 0.985 104.5 48.0 -67.0 -60.5 44.7 62.1 11.8 119 121 A H H X S+ 0 0 44 -4,-2.8 4,-2.7 1,-0.2 -2,-0.2 0.890 109.8 57.4 -44.5 -44.0 43.1 64.7 14.1 120 122 A E H < S+ 0 0 127 -4,-2.4 3,-0.3 -5,-0.2 -1,-0.2 0.973 108.2 43.9 -50.7 -62.2 45.7 67.0 12.7 121 123 A I H >< S+ 0 0 30 -4,-2.2 3,-0.6 1,-0.3 -2,-0.2 0.910 111.1 54.0 -50.0 -52.1 44.5 66.5 9.2 122 124 A L H 3< S+ 0 0 6 -4,-2.8 2,-1.4 1,-0.3 -1,-0.3 0.899 105.2 56.0 -51.9 -43.9 40.9 66.8 10.2 123 125 A R T 3< 0 0 130 -4,-2.7 -1,-0.3 -3,-0.3 -2,-0.1 -0.385 360.0 360.0 -87.9 57.7 41.7 70.1 11.8 124 126 A S < 0 0 121 -2,-1.4 -1,-0.1 -3,-0.6 -3,-0.0 -0.525 360.0 360.0-139.4 360.0 43.1 71.6 8.6 125 !* 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 0.0 126 205 B E > 0 0 134 0, 0.0 4,-1.0 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 -29.8 24.9 83.8 8.5 127 206 B L H >> + 0 0 127 1,-0.2 4,-2.6 2,-0.2 3,-2.2 0.900 360.0 53.3 -44.2 -64.3 22.1 81.5 7.3 128 207 B X H 3> S+ 0 0 104 1,-0.3 4,-2.3 2,-0.2 5,-0.5 0.891 103.3 56.9 -41.6 -55.8 24.1 78.7 5.8 129 208 B R H 3> S+ 0 0 134 1,-0.2 4,-1.1 2,-0.2 -1,-0.3 0.808 115.8 40.7 -47.9 -30.9 26.1 78.2 8.9 130 209 B L H X S+ 0 0 20 -4,-2.3 4,-2.4 2,-0.2 3,-0.7 0.898 108.7 62.9 -80.8 -41.6 23.7 73.0 8.4 133 212 B R H 3X S+ 0 0 113 -4,-1.1 4,-1.2 -5,-0.5 -2,-0.2 0.805 103.3 57.9 -50.3 -25.1 24.3 73.6 12.1 134 213 B R H 3< S+ 0 0 139 -4,-2.3 -1,-0.3 2,-0.2 -2,-0.2 0.907 104.1 46.9 -73.2 -43.4 20.7 72.4 12.0 135 214 B I H X< S+ 0 0 37 -4,-0.8 3,-0.9 -3,-0.7 6,-0.3 0.862 110.8 50.4 -69.2 -36.9 21.4 69.0 10.4 136 215 B L H 3< S+ 0 0 0 -4,-2.4 6,-0.3 1,-0.3 -1,-0.2 0.884 110.0 52.0 -67.3 -33.6 24.3 68.2 12.6 137 216 B E T 3< S+ 0 0 72 -4,-1.2 -1,-0.3 -5,-0.4 -2,-0.2 0.489 88.6 118.7 -76.3 -5.3 22.0 69.0 15.5 138 217 B S S <> S- 0 0 22 -3,-0.9 4,-1.7 1,-0.1 5,-0.1 -0.159 70.6-132.3 -55.3 156.4 19.6 66.6 13.8 139 218 B Y H > S+ 0 0 200 2,-0.2 4,-2.5 3,-0.1 5,-0.3 0.928 104.3 53.5 -81.3 -45.3 18.8 63.6 16.0 140 219 B R H > S+ 0 0 165 1,-0.2 4,-1.5 2,-0.2 5,-0.2 0.871 115.1 43.2 -54.5 -39.7 19.4 61.0 13.4 141 220 B W H >>S+ 0 0 3 -6,-0.3 4,-3.8 2,-0.2 5,-1.0 0.982 111.3 51.4 -69.1 -60.4 22.8 62.4 12.8 142 221 B Q H <>S+ 0 0 48 -4,-1.7 5,-1.6 -6,-0.3 -2,-0.2 0.811 120.4 35.9 -45.6 -39.4 23.8 63.0 16.4 143 222 B E H <5S+ 0 0 135 -4,-2.5 -1,-0.2 4,-0.1 -2,-0.2 0.748 126.3 36.6 -90.0 -25.9 22.9 59.3 17.3 144 223 B D H <5S- 0 0 27 -4,-1.5 -2,-0.2 -5,-0.3 -3,-0.2 0.656 136.2 -2.5-101.4 -19.7 24.0 57.7 14.1 145 224 B V T X5S+ 0 0 4 -4,-3.8 4,-2.5 -5,-0.2 -3,-0.2 0.605 120.1 52.1-135.5 -63.7 27.1 59.6 13.2 146 225 B V T 44 S+ 0 0 40 0, 0.0 2,-4.9 0, 0.0 3,-0.6 0.888 90.2 72.1 -41.1 -55.1 29.0 57.3 17.3 149 228 B L T 3< + 0 0 13 -4,-2.5 3,-0.2 1,-0.3 8,-0.1 -0.182 59.3 117.9 -63.2 55.5 32.3 58.5 15.8 150 229 B S T 3 + 0 0 91 -2,-4.9 -1,-0.3 1,-0.2 -3,-0.1 0.379 38.9 106.4 -98.4 -3.4 33.7 58.8 19.3 151 230 B R < 0 0 87 -3,-0.6 -1,-0.2 1,-0.3 -2,-0.1 0.398 360.0 360.0 -59.7 5.9 36.1 56.2 18.1 152 231 B E 0 0 57 -3,-0.2 -1,-0.3 -79,-0.0 -3,-0.1 -0.238 360.0 360.0-116.2 360.0 38.7 58.9 18.1 153 ! 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 0.0 154 236 B V > 0 0 103 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -47.0 32.1 65.5 20.1 155 237 B E H > + 0 0 127 1,-0.2 4,-1.3 2,-0.2 3,-0.2 0.914 360.0 43.8 -38.2 -60.6 31.7 69.2 20.2 156 238 B E H >> S+ 0 0 87 1,-0.2 4,-2.2 2,-0.2 3,-1.3 0.947 105.8 58.1 -53.2 -61.2 34.8 69.7 18.0 157 239 B F H 3> S+ 0 0 22 1,-0.3 4,-3.2 2,-0.2 5,-0.3 0.870 102.9 57.7 -36.9 -49.5 34.0 66.9 15.5 158 240 B Q H 3X S+ 0 0 11 -4,-2.3 4,-3.1 1,-0.3 -1,-0.3 0.918 108.1 45.1 -47.8 -50.7 30.8 68.8 14.8 159 241 B D H - 0 0 80 -2,-0.2 4,-2.3 1,-0.0 3,-0.1 -0.407 31.9 -92.9 -91.3 172.1 29.6 71.7 2.3 167 249 B X H > S+ 0 0 43 1,-0.2 4,-2.4 2,-0.2 -1,-0.0 0.916 121.9 50.5 -49.5 -61.0 25.8 72.1 2.3 168 250 B S H 4 S+ 0 0 77 1,-0.2 -1,-0.2 2,-0.2 5,-0.1 0.900 111.6 52.3 -47.8 -43.4 24.9 69.9 -0.7 169 251 B S H > S+ 0 0 37 1,-0.2 4,-1.3 -3,-0.1 3,-0.4 0.956 107.1 50.7 -58.8 -53.4 27.0 67.2 1.0 170 252 B L H >X S+ 0 0 3 -4,-2.3 2,-1.8 1,-0.3 4,-0.6 0.894 106.0 55.5 -51.1 -48.9 25.2 67.5 4.3 171 253 B E H 3< S+ 0 0 152 -4,-2.4 -1,-0.3 1,-0.2 -2,-0.1 -0.442 117.1 35.8 -85.9 62.1 21.8 67.1 2.7 172 254 B A H 3> S+ 0 0 55 -2,-1.8 4,-1.1 -3,-0.4 -1,-0.2 0.213 94.9 81.1-179.6 -23.1 22.8 63.8 1.1 173 255 B L H S+ 0 0 87 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.963 115.6 44.5 -52.9 -58.6 21.1 58.1 3.4 176 258 B R H < S+ 0 0 110 -4,-1.1 4,-0.2 1,-0.2 -2,-0.2 0.817 112.8 57.5 -54.8 -31.4 24.4 57.1 1.8 177 259 B F H >X S+ 0 0 0 -4,-2.9 3,-1.3 1,-0.2 4,-1.0 0.928 104.7 47.0 -65.4 -50.0 25.5 56.6 5.4 178 260 B E H 3< S+ 0 0 79 -4,-2.7 -2,-0.2 1,-0.3 3,-0.2 0.824 108.4 56.3 -64.1 -31.8 22.8 54.1 6.3 179 261 B S T 3< S+ 0 0 86 -4,-1.9 -1,-0.3 -5,-0.2 4,-0.2 0.495 115.3 37.9 -79.0 -3.7 23.5 52.1 3.1 180 262 B A T <> S+ 0 0 10 -3,-1.3 4,-2.9 -4,-0.2 5,-0.3 0.432 86.3 93.6-123.4 -7.0 27.1 51.7 4.0 181 263 B R H X S+ 0 0 79 -4,-1.0 4,-1.2 -3,-0.2 -2,-0.1 0.876 91.0 48.1 -55.3 -38.7 26.9 51.2 7.8 182 264 B P H >> S+ 0 0 43 0, 0.0 4,-2.7 0, 0.0 3,-0.9 0.987 111.2 48.4 -64.2 -59.5 26.8 47.4 7.2 183 265 B R H 3> S+ 0 0 146 1,-0.3 4,-2.5 -4,-0.2 -2,-0.2 0.899 110.8 51.4 -45.6 -51.4 29.8 47.4 4.8 184 266 B b H 3X S+ 0 0 5 -4,-2.9 4,-1.6 1,-0.2 -1,-0.3 0.800 111.3 48.1 -61.2 -30.1 31.8 49.5 7.2 185 267 B I H S+ 0 0 29 -4,-3.7 5,-2.6 2,-0.2 6,-0.4 0.912 117.1 42.2 -41.6 -50.7 37.1 41.3 9.3 191 273 B S H ><5S+ 0 0 10 -4,-2.3 3,-2.6 -5,-0.3 5,-0.3 0.996 114.3 45.5 -60.5 -73.3 39.9 43.4 10.8 192 274 B D H 3<5S+ 0 0 21 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.756 109.2 59.0 -45.3 -30.9 39.2 43.0 14.5 193 275 B L T 3<5S- 0 0 2 -4,-3.2 -1,-0.3 -5,-0.3 -2,-0.2 0.163 110.3-121.5 -88.9 20.6 38.8 39.2 13.9 194 276 B Q T X>5 + 0 0 12 -3,-2.6 4,-2.2 1,-0.1 3,-0.9 0.784 62.8 149.0 46.2 33.3 42.3 38.9 12.5 195 277 B L H 3>X + 0 0 1 -5,-2.6 4,-1.3 -6,-0.3 5,-1.3 0.596 54.8 73.1 -74.4 -8.7 40.7 37.6 9.4 196 278 B a H 34>S+ 0 0 7 -6,-0.4 5,-1.7 -5,-0.3 -1,-0.2 0.860 113.1 28.3 -69.3 -33.8 43.4 39.0 7.1 197 279 B W H <4>S+ 0 0 24 -3,-0.9 5,-3.3 3,-0.2 6,-0.8 0.922 118.5 53.4 -88.6 -57.1 45.6 36.2 8.5 198 280 B L H <5S+ 0 0 0 -4,-2.2 7,-2.0 4,-0.2 6,-1.8 0.749 131.9 8.6 -52.0 -28.4 43.2 33.5 9.3 199 281 B V T <5S+ 0 0 12 -4,-1.3 4,-0.2 4,-0.2 -3,-0.2 0.707 127.9 42.9-118.2 -74.8 41.8 33.7 5.8 200 282 B D T - 0 0 55 -2,-0.4 4,-2.9 1,-0.1 5,-0.2 -0.329 20.3-125.0 -66.0 145.9 37.1 28.9 4.9 207 289 B V H > S+ 0 0 89 1,-0.2 4,-3.5 2,-0.2 5,-0.3 0.929 113.2 55.5 -54.3 -44.8 35.8 32.0 3.1 208 290 B D H > S+ 0 0 132 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.947 108.0 45.7 -53.1 -53.8 32.4 30.5 3.5 209 291 B D H > S+ 0 0 75 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.956 115.8 48.4 -54.5 -50.6 32.8 30.2 7.2 210 292 B A H X S+ 0 0 5 -4,-2.9 4,-2.7 2,-0.2 5,-0.2 0.913 111.1 46.8 -56.2 -52.8 34.2 33.8 7.4 211 293 B E H X S+ 0 0 79 -4,-3.5 4,-2.4 2,-0.2 -1,-0.2 0.952 113.2 51.4 -56.8 -48.3 31.6 35.5 5.3 212 294 B A H X S+ 0 0 37 -4,-2.6 4,-2.2 -5,-0.3 3,-0.3 0.954 110.4 47.4 -50.8 -57.8 28.9 33.7 7.3 213 295 B L H X S+ 0 0 5 -4,-2.7 4,-2.1 1,-0.3 5,-0.3 0.875 110.4 52.2 -53.3 -43.3 30.3 34.8 10.6 214 296 B K H X S+ 0 0 10 -4,-2.7 4,-2.1 -5,-0.2 -1,-0.3 0.883 109.4 52.2 -62.9 -36.9 30.7 38.4 9.4 215 297 B D H X S+ 0 0 74 -4,-2.4 4,-3.6 -3,-0.3 -2,-0.2 0.994 109.3 46.4 -58.6 -66.5 27.0 38.3 8.4 216 298 B E H X S+ 0 0 77 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.828 116.2 43.8 -45.6 -48.7 25.6 37.1 11.7 217 299 B I H X S+ 0 0 0 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.898 114.2 48.9 -70.3 -39.9 27.6 39.5 13.8 218 300 B T H X S+ 0 0 7 -4,-2.1 4,-2.9 -5,-0.3 -2,-0.2 0.933 107.7 57.6 -62.1 -42.5 26.9 42.4 11.4 219 301 B E H X S+ 0 0 127 -4,-3.6 4,-0.5 -5,-0.2 -2,-0.2 0.939 109.9 45.1 -49.1 -51.9 23.2 41.3 11.7 220 302 B L H ><>S+ 0 0 55 -4,-2.0 3,-2.9 1,-0.2 5,-1.5 0.977 111.9 47.7 -56.8 -64.8 23.5 41.8 15.4 221 303 B V H ><5S+ 0 0 11 -4,-2.6 3,-1.4 1,-0.3 -1,-0.2 0.834 108.9 56.6 -48.0 -37.7 25.3 45.1 15.5 222 304 B L H 3<5S+ 0 0 61 -4,-2.9 -1,-0.3 1,-0.3 -2,-0.2 0.642 102.8 57.1 -70.9 -14.0 22.7 46.4 12.9 223 305 B A T <<5S- 0 0 88 -3,-2.9 -1,-0.3 -4,-0.5 -2,-0.2 0.132 134.7 -81.9-102.1 18.0 20.0 45.4 15.3 224 306 B G T < 5S+ 0 0 52 -3,-1.4 -3,-0.2 1,-0.3 -2,-0.1 0.124 81.1 145.9 106.5 -22.2 21.3 47.6 18.2 225 307 B R < - 0 0 113 -5,-1.5 2,-0.5 -6,-0.2 -1,-0.3 -0.235 58.8-108.7 -52.3 133.6 23.9 45.2 19.5 226 308 B E > - 0 0 112 1,-0.2 4,-3.6 4,-0.0 5,-0.3 -0.539 20.0-136.4 -69.0 117.8 26.9 47.1 20.9 227 309 B Y H > S+ 0 0 45 -2,-0.5 4,-3.8 1,-0.3 5,-0.3 0.891 106.3 54.6 -36.6 -58.0 29.8 46.5 18.5 228 310 B S H > S+ 0 0 88 1,-0.2 4,-1.5 2,-0.2 -1,-0.3 0.930 115.0 37.5 -41.2 -62.5 32.0 46.0 21.5 229 311 B E H > S+ 0 0 94 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.897 116.6 53.2 -60.8 -41.8 29.8 43.3 22.9 230 312 B A H X S+ 0 0 0 -4,-3.6 4,-2.1 1,-0.2 -2,-0.2 0.906 104.1 54.9 -60.2 -44.5 29.0 41.9 19.4 231 313 B L H X S+ 0 0 16 -4,-3.8 4,-2.3 -5,-0.3 -1,-0.2 0.886 104.2 56.1 -57.3 -39.4 32.7 41.6 18.6 232 314 B S H X S+ 0 0 54 -4,-1.5 4,-2.1 -5,-0.3 -1,-0.2 0.906 107.8 47.8 -59.2 -43.2 33.1 39.5 21.7 233 315 B E H X S+ 0 0 52 -4,-1.5 4,-2.6 1,-0.2 -1,-0.2 0.842 110.4 52.3 -66.2 -34.6 30.4 37.1 20.5 234 316 B G H X S+ 0 0 0 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.873 106.6 52.0 -68.5 -37.1 32.1 37.0 17.1 235 317 B R H X S+ 0 0 31 -4,-2.3 4,-3.1 2,-0.2 5,-0.2 0.936 109.9 52.5 -62.0 -44.8 35.4 36.1 18.8 236 318 B R H X S+ 0 0 144 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.976 110.9 42.8 -53.2 -65.6 33.5 33.3 20.5 237 319 B R H X S+ 0 0 71 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.799 113.8 55.8 -55.1 -29.1 32.0 31.8 17.4 238 320 B L H X S+ 0 0 0 -4,-2.0 4,-2.7 2,-0.2 5,-0.3 0.984 104.7 48.9 -66.9 -58.2 35.3 32.2 15.7 239 321 B H H X S+ 0 0 23 -4,-3.1 4,-2.3 1,-0.2 -2,-0.2 0.906 109.0 57.0 -46.5 -45.4 37.2 30.2 18.4 240 322 B E H < S+ 0 0 113 -4,-2.5 3,-0.4 -5,-0.2 -1,-0.2 0.961 108.5 44.6 -49.5 -59.1 34.5 27.6 17.9 241 323 B I H >< S+ 0 0 25 -4,-2.1 3,-0.7 1,-0.2 -2,-0.2 0.894 110.5 54.2 -52.8 -48.1 35.2 27.3 14.2 242 324 B L H 3< S+ 0 0 3 -4,-2.7 2,-1.1 1,-0.3 -1,-0.2 0.875 106.1 53.5 -56.2 -40.7 39.0 27.2 14.7 243 325 B R T 3< 0 0 161 -4,-2.3 -1,-0.3 -3,-0.4 -2,-0.1 -0.435 360.0 360.0 -94.3 58.4 38.6 24.3 17.1 244 326 B S < 0 0 123 -2,-1.1 -1,-0.2 -3,-0.7 -3,-0.0 -0.520 360.0 360.0-141.6 360.0 36.6 22.3 14.6