==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-FEB-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION 09-NOV-12 4HX7 . COMPND 2 MOLECULE: TRANSCRIPTIONAL REGULATOR MNTR; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS SUBSP. SUBTILIS; . AUTHOR A.GLASFELD,B.J.CUTHBERT . 258 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14304.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 212 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 . 5 1.9 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 . 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 . 26 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 169 65.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 3.5 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 0 2 0 0 2 2 2 0 1 2 1 0 0 0 0 0 2 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 . 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 4 A P > 0 0 85 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -58.5 30.7 2.9 25.7 2 5 A S H > + 0 0 72 1,-0.2 4,-1.9 2,-0.2 3,-0.2 0.959 360.0 45.1 -56.9 -53.7 33.5 1.2 27.6 3 6 A M H > S+ 0 0 39 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.875 110.4 56.4 -56.8 -38.6 33.0 3.5 30.6 4 7 A E H > S+ 0 0 56 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.908 105.9 48.9 -62.2 -42.2 29.3 2.9 30.4 5 8 A D H X S+ 0 0 35 -4,-2.2 4,-2.3 -3,-0.2 -1,-0.2 0.892 112.8 49.2 -64.7 -41.4 29.6 -0.9 30.6 6 9 A Y H X S+ 0 0 9 -4,-1.9 4,-3.0 2,-0.2 5,-0.2 0.938 112.1 45.8 -62.4 -50.3 31.9 -0.5 33.7 7 10 A I H X S+ 0 0 6 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.895 113.3 51.8 -61.0 -39.8 29.7 1.9 35.6 8 11 A K H X S+ 0 0 1 -4,-2.3 4,-2.4 -5,-0.2 -1,-0.2 0.933 113.3 42.9 -61.6 -49.4 26.7 -0.3 34.8 9 12 A Q H X S+ 0 0 30 -4,-2.3 4,-2.5 2,-0.2 5,-0.2 0.926 113.1 52.3 -64.5 -46.1 28.4 -3.5 36.1 10 13 A I H X S+ 0 0 0 -4,-3.0 4,-2.1 1,-0.2 -2,-0.2 0.930 111.4 48.0 -54.4 -47.9 29.8 -1.7 39.1 11 14 A Y H X S+ 0 0 29 -4,-2.5 4,-2.6 -5,-0.2 5,-0.3 0.941 112.1 47.9 -58.0 -50.9 26.3 -0.4 40.0 12 15 A M H X S+ 0 0 60 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.879 110.4 51.8 -61.4 -38.1 24.6 -3.8 39.6 13 16 A L H X>S+ 0 0 11 -4,-2.5 4,-4.0 2,-0.2 5,-1.2 0.904 110.3 49.1 -64.8 -41.6 27.3 -5.6 41.7 14 17 A I H X5S+ 0 0 25 -4,-2.1 4,-0.6 4,-0.2 -2,-0.2 0.937 114.7 43.7 -64.0 -45.5 26.8 -3.1 44.5 15 18 A E H <5S+ 0 0 119 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.873 123.5 39.5 -63.8 -36.0 23.0 -3.5 44.4 16 19 A E H <5S+ 0 0 142 -4,-2.3 -2,-0.2 -5,-0.3 -3,-0.2 0.935 136.3 11.2 -80.7 -51.9 23.4 -7.2 44.1 17 20 A K H <5S- 0 0 86 -4,-4.0 -3,-0.2 2,-0.3 -2,-0.1 0.750 96.1-114.5-101.8 -32.5 26.3 -8.0 46.5 18 21 A G S < - 0 0 129 -2,-0.5 4,-1.8 1,-0.1 3,-0.4 -0.498 26.4-126.4 -73.3 141.4 35.4 -6.3 43.6 22 25 A V H > S+ 0 0 51 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.890 113.0 54.8 -50.6 -42.2 37.9 -5.8 40.8 23 26 A S H > S+ 0 0 51 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.860 106.5 50.0 -64.0 -36.3 37.8 -9.5 40.2 24 27 A D H > S+ 0 0 16 -3,-0.4 4,-1.9 2,-0.2 -1,-0.2 0.818 112.2 47.9 -70.8 -31.5 34.0 -9.5 39.9 25 28 A I H X S+ 0 0 0 -4,-1.8 4,-2.2 2,-0.2 5,-0.2 0.928 109.9 52.5 -72.7 -46.3 34.2 -6.7 37.4 26 29 A A H X>S+ 0 0 8 -4,-2.9 5,-1.8 1,-0.2 4,-1.0 0.880 113.4 44.1 -53.6 -42.4 36.8 -8.5 35.4 27 30 A E H <5S+ 0 0 156 -4,-1.8 -1,-0.2 2,-0.2 -2,-0.2 0.891 111.3 52.7 -73.2 -40.3 34.7 -11.6 35.2 28 31 A A H <5S+ 0 0 48 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.838 120.8 32.8 -64.1 -33.9 31.5 -9.7 34.3 29 32 A L H <5S- 0 0 43 -4,-2.2 -1,-0.2 2,-0.1 -2,-0.2 0.537 103.3-125.1-100.5 -8.5 33.1 -7.9 31.4 30 33 A A T <5 + 0 0 93 -4,-1.0 2,-0.3 -5,-0.2 -3,-0.2 0.912 68.7 126.9 59.7 43.0 35.5 -10.6 30.4 31 34 A V < - 0 0 47 -5,-1.8 -1,-0.2 -6,-0.2 -2,-0.1 -0.771 66.3 -95.7-116.2 169.7 38.5 -8.3 30.7 32 35 A H >> - 0 0 139 -2,-0.3 3,-1.5 1,-0.1 4,-1.4 -0.589 31.5-116.1 -85.4 151.2 41.7 -8.7 32.6 33 36 A P H 3> S+ 0 0 71 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.793 115.2 63.6 -55.4 -28.9 42.0 -7.3 36.2 34 37 A S H 3> S+ 0 0 72 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.832 102.7 48.7 -65.2 -32.1 44.8 -5.0 34.9 35 38 A S H <> S+ 0 0 53 -3,-1.5 4,-2.7 2,-0.2 -1,-0.2 0.877 109.1 52.2 -73.0 -39.3 42.2 -3.3 32.6 36 39 A V H X S+ 0 0 0 -4,-1.4 4,-3.4 2,-0.2 5,-0.2 0.921 107.8 51.5 -61.6 -46.9 39.7 -2.9 35.4 37 40 A T H X S+ 0 0 67 -4,-2.4 4,-1.7 2,-0.2 -1,-0.2 0.935 110.9 48.4 -57.4 -46.4 42.3 -1.2 37.6 38 41 A K H X S+ 0 0 149 -4,-1.6 4,-1.4 2,-0.2 3,-0.3 0.952 114.8 44.9 -58.2 -49.7 43.1 1.2 34.8 39 42 A M H >X S+ 0 0 25 -4,-2.7 4,-2.3 1,-0.2 3,-0.5 0.939 108.3 56.5 -60.5 -50.6 39.4 2.0 34.1 40 43 A V H 3X S+ 0 0 26 -4,-3.4 4,-2.1 1,-0.3 -1,-0.2 0.831 104.3 54.7 -48.8 -37.8 38.6 2.4 37.9 41 44 A Q H 3X S+ 0 0 110 -4,-1.7 4,-2.6 -3,-0.3 -1,-0.3 0.899 108.1 48.5 -66.4 -39.7 41.3 5.1 38.1 42 45 A K H S+ 0 0 1 -4,-2.3 5,-3.1 2,-0.2 6,-1.3 0.830 111.9 50.1 -69.0 -33.8 36.2 6.7 36.9 44 47 A D H ><5S+ 0 0 61 -4,-2.1 3,-0.8 -5,-0.2 -1,-0.2 0.930 114.5 44.4 -61.2 -49.9 37.8 7.9 40.2 45 48 A K H 3<5S+ 0 0 147 -4,-2.6 -2,-0.2 1,-0.3 -3,-0.2 0.881 113.3 49.1 -66.0 -39.5 39.4 10.8 38.3 46 49 A D T 3<5S- 0 0 66 -4,-3.3 -1,-0.3 -5,-0.1 -2,-0.2 0.436 117.5-117.9 -81.4 -0.2 36.2 11.6 36.4 47 50 A E T < 5S+ 0 0 126 -3,-0.8 12,-0.3 2,-0.2 11,-0.3 0.728 79.8 122.2 75.2 28.0 34.4 11.5 39.7 48 51 A Y S - 0 0 39 -8,-1.5 4,-2.9 -2,-0.3 5,-0.2 -0.249 36.9 -91.8 -73.6 177.2 29.5 9.0 44.1 57 64 A S H > S+ 0 0 86 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.881 132.4 52.1 -58.3 -34.7 26.1 10.5 43.6 58 65 A K H > S+ 0 0 85 -11,-0.3 4,-1.7 2,-0.2 -1,-0.2 0.891 111.1 45.7 -70.5 -40.4 27.1 11.1 40.0 59 66 A G H > S+ 0 0 0 -12,-0.3 4,-2.9 -11,-0.2 -2,-0.2 0.901 113.2 49.5 -66.0 -43.5 28.1 7.5 39.6 60 67 A K H X S+ 0 0 93 -4,-2.9 4,-2.0 2,-0.2 -2,-0.2 0.859 110.9 49.1 -67.7 -36.3 24.9 6.1 41.3 61 68 A K H X S+ 0 0 131 -4,-2.1 4,-2.0 -5,-0.2 -1,-0.2 0.905 115.1 44.7 -68.6 -40.6 22.6 8.3 39.2 62 69 A I H X S+ 0 0 65 -4,-1.7 4,-2.8 2,-0.2 -2,-0.2 0.930 112.1 51.4 -68.8 -45.3 24.4 7.2 36.0 63 70 A G H X S+ 0 0 0 -4,-2.9 4,-2.5 1,-0.2 -2,-0.2 0.911 110.5 49.4 -56.9 -43.5 24.5 3.6 36.9 64 71 A K H X S+ 0 0 128 -4,-2.0 4,-2.6 1,-0.2 -1,-0.2 0.925 111.6 48.5 -63.4 -46.3 20.8 3.6 37.7 65 72 A R H X S+ 0 0 137 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.899 110.5 51.6 -58.8 -44.1 20.0 5.3 34.3 66 73 A L H X S+ 0 0 8 -4,-2.8 4,-2.3 2,-0.2 -2,-0.2 0.922 110.7 48.3 -61.9 -44.2 22.2 2.7 32.5 67 74 A V H X S+ 0 0 21 -4,-2.5 4,-2.5 2,-0.2 5,-0.2 0.926 111.9 49.2 -59.3 -46.0 20.3 -0.1 34.2 68 75 A Y H X S+ 0 0 111 -4,-2.6 4,-2.8 1,-0.2 -2,-0.2 0.922 111.4 49.8 -57.7 -44.9 17.0 1.4 33.3 69 76 A R H X S+ 0 0 12 -4,-2.6 4,-2.5 2,-0.2 -1,-0.2 0.888 110.4 50.3 -64.8 -39.5 18.1 1.9 29.7 70 77 A H H X S+ 0 0 20 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.950 113.7 43.7 -63.2 -50.6 19.2 -1.7 29.5 71 78 A E H X S+ 0 0 119 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.877 113.0 52.4 -61.3 -42.4 15.9 -3.1 30.8 72 79 A L H X S+ 0 0 8 -4,-2.8 4,-2.2 -5,-0.2 -2,-0.2 0.932 110.1 48.7 -59.5 -47.4 13.9 -0.7 28.7 73 80 A L H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 5,-0.2 0.902 110.9 49.5 -62.2 -41.7 15.7 -1.8 25.5 74 81 A E H X S+ 0 0 38 -4,-2.3 4,-2.8 1,-0.2 -1,-0.2 0.929 111.5 49.8 -59.6 -43.4 15.3 -5.6 26.4 75 82 A Q H X S+ 0 0 76 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.866 110.4 51.4 -65.5 -36.4 11.6 -4.9 27.0 76 83 A F H X S+ 0 0 8 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.963 112.4 43.3 -63.6 -54.4 11.3 -3.1 23.6 77 84 A L H <>S+ 0 0 0 -4,-2.5 5,-2.6 1,-0.2 4,-0.4 0.904 115.1 51.8 -61.7 -38.7 13.0 -5.9 21.6 78 85 A R H ><5S+ 0 0 104 -4,-2.8 3,-1.0 -5,-0.2 -1,-0.2 0.916 109.1 49.8 -60.5 -45.8 10.9 -8.4 23.6 79 86 A I H 3<5S+ 0 0 30 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.883 108.6 51.3 -63.1 -41.0 7.7 -6.6 22.8 80 87 A I T 3<5S- 0 0 0 -4,-2.3 -1,-0.2 -5,-0.1 -2,-0.2 0.441 124.5-100.4 -83.3 2.4 8.4 -6.3 19.0 81 88 A G T < 5 + 0 0 24 -3,-1.0 -3,-0.2 -4,-0.4 -2,-0.1 0.641 59.2 163.6 100.9 17.7 9.0 -10.1 18.9 82 89 A V < - 0 0 8 -5,-2.6 -1,-0.2 -6,-0.2 5,-0.1 -0.451 53.8 -95.6 -69.3 137.0 12.8 -10.6 18.9 83 90 A D >> - 0 0 83 1,-0.2 3,-2.3 -2,-0.1 4,-0.8 -0.355 35.4-126.4 -50.3 127.7 13.8 -14.2 19.7 84 91 A E H >> S+ 0 0 92 1,-0.3 3,-1.0 2,-0.2 4,-0.6 0.826 106.8 58.5 -50.7 -38.0 14.6 -14.0 23.5 85 92 A E H 34 S+ 0 0 145 1,-0.3 4,-0.3 2,-0.1 -1,-0.3 0.673 105.5 49.4 -70.6 -17.8 18.0 -15.5 23.0 86 93 A K H <> S+ 0 0 107 -3,-2.3 4,-1.4 1,-0.1 -1,-0.3 0.670 92.0 81.0 -87.6 -19.3 19.1 -12.7 20.6 87 94 A I H S+ 0 0 112 -4,-0.3 4,-0.8 1,-0.2 -1,-0.2 0.866 113.4 48.5 -58.8 -39.7 23.6 -9.2 22.8 90 97 A D H >X S+ 0 0 11 -4,-1.4 4,-3.0 2,-0.2 3,-0.8 0.949 111.7 48.3 -65.9 -50.4 21.8 -6.6 20.8 91 98 A V H 3X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.910 107.6 56.0 -55.5 -45.8 20.9 -4.4 23.8 92 99 A E H 3< S+ 0 0 38 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.757 116.0 38.5 -59.5 -26.4 24.6 -4.6 25.0 93 100 A G H X< S+ 0 0 10 -4,-0.8 3,-0.8 -3,-0.8 -2,-0.2 0.912 120.1 39.8 -88.3 -51.7 25.6 -3.2 21.6 94 101 A I H >< S+ 0 0 6 -4,-3.0 3,-2.3 135,-0.4 -3,-0.2 0.785 95.2 81.1 -72.3 -27.1 23.0 -0.7 20.7 95 102 A E G >< S+ 0 0 1 -4,-2.3 3,-0.7 -5,-0.3 -1,-0.2 0.788 90.5 52.8 -51.9 -31.7 22.6 0.8 24.2 96 103 A H G < S+ 0 0 25 -3,-0.8 -1,-0.3 1,-0.2 -2,-0.1 0.581 107.4 49.9 -82.9 -9.7 25.6 3.0 23.8 97 104 A H G < S+ 0 0 61 -3,-2.3 2,-0.5 -4,-0.2 129,-0.4 0.014 85.1 98.6-122.8 23.8 24.6 4.7 20.5 98 105 A L < - 0 0 14 -3,-0.7 124,-0.0 -4,-0.1 120,-0.0 -0.970 66.6-134.8-112.8 128.0 21.1 5.8 21.3 99 106 A S > - 0 0 27 -2,-0.5 4,-2.1 119,-0.2 3,-0.3 -0.287 29.0-108.0 -70.8 161.8 20.4 9.4 22.3 100 107 A W H > S+ 0 0 111 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.896 122.6 61.5 -57.4 -35.3 18.2 10.1 25.3 101 108 A N H > S+ 0 0 15 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.922 106.3 43.6 -54.7 -48.3 15.7 11.3 22.6 102 109 A S H > S+ 0 0 0 -3,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.879 112.4 53.1 -66.8 -36.3 15.6 7.9 21.1 103 110 A I H X S+ 0 0 0 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.926 110.2 47.1 -66.5 -45.6 15.4 6.2 24.5 104 111 A D H X S+ 0 0 69 -4,-2.8 4,-2.4 2,-0.2 -2,-0.2 0.918 112.9 48.1 -61.6 -47.2 12.4 8.3 25.6 105 112 A R H X S+ 0 0 54 -4,-2.0 4,-2.2 -5,-0.2 -1,-0.2 0.840 110.4 52.8 -57.9 -37.3 10.6 7.7 22.2 106 113 A I H X S+ 0 0 3 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.898 108.3 51.6 -66.7 -37.3 11.4 4.0 22.6 107 114 A G H X S+ 0 0 16 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.895 108.8 48.8 -63.7 -42.6 9.8 4.2 26.1 108 115 A D H X S+ 0 0 28 -4,-2.4 4,-2.7 2,-0.2 -1,-0.2 0.907 109.9 53.7 -59.3 -42.1 6.7 5.8 24.6 109 116 A L H X S+ 0 0 1 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.894 108.3 48.8 -61.5 -42.2 6.6 3.0 22.1 110 117 A V H X S+ 0 0 7 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.911 112.2 47.7 -62.0 -44.7 6.7 0.4 24.8 111 118 A Q H X S+ 0 0 103 -4,-2.3 4,-1.4 2,-0.2 -2,-0.2 0.871 106.0 60.7 -65.2 -36.2 3.9 2.1 26.7 112 119 A Y H >X S+ 0 0 1 -4,-2.7 4,-0.8 1,-0.2 3,-0.7 0.970 110.1 39.5 -53.7 -54.4 2.0 2.3 23.4 113 120 A F H >< S+ 0 0 1 -4,-2.0 3,-0.5 1,-0.2 7,-0.4 0.867 113.1 54.7 -66.5 -35.5 2.0 -1.5 23.1 114 121 A E H 3< S+ 0 0 79 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.695 98.4 65.4 -72.1 -17.2 1.4 -2.1 26.8 115 122 A E H << S+ 0 0 87 -4,-1.4 2,-0.4 -3,-0.7 -1,-0.2 0.852 113.7 22.0 -74.2 -33.4 -1.7 0.1 26.8 116 123 A D XX - 0 0 71 -4,-0.8 3,-1.2 -3,-0.5 4,-0.8 -0.951 57.9-156.8-142.9 117.1 -3.7 -2.2 24.4 117 124 A D H 3> S+ 0 0 112 -2,-0.4 4,-1.9 1,-0.3 5,-0.1 0.694 94.0 71.3 -63.7 -18.3 -3.1 -5.9 23.8 118 125 A A H 3> S+ 0 0 40 1,-0.2 4,-2.4 2,-0.2 -1,-0.3 0.868 92.2 55.6 -65.0 -37.4 -4.9 -5.4 20.5 119 126 A R H <> S+ 0 0 28 -3,-1.2 4,-1.6 2,-0.2 -1,-0.2 0.865 107.3 48.6 -64.5 -39.3 -1.9 -3.5 19.2 120 127 A K H X S+ 0 0 76 -4,-0.8 4,-2.1 -7,-0.4 -1,-0.2 0.882 110.7 51.6 -64.8 -41.3 0.4 -6.4 20.0 121 128 A K H X S+ 0 0 147 -4,-1.9 4,-1.5 1,-0.2 -2,-0.2 0.890 109.0 51.0 -62.2 -40.0 -2.1 -8.7 18.2 122 129 A D H X S+ 0 0 67 -4,-2.4 4,-1.5 1,-0.2 -1,-0.2 0.843 109.4 50.1 -67.2 -33.6 -2.0 -6.4 15.2 123 130 A L H X S+ 0 0 3 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.888 107.4 53.1 -72.5 -38.9 1.8 -6.4 15.1 124 131 A K H X S+ 0 0 114 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.853 106.9 54.2 -62.2 -35.7 1.9 -10.2 15.3 125 132 A S H X S+ 0 0 69 -4,-1.5 4,-2.0 2,-0.2 -1,-0.2 0.884 106.7 50.5 -65.7 -40.6 -0.4 -10.3 12.3 126 133 A I H < S+ 0 0 12 -4,-1.5 -2,-0.2 1,-0.2 -1,-0.2 0.924 107.8 53.7 -60.4 -46.3 2.0 -8.1 10.3 127 134 A Q H < S+ 0 0 35 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.877 108.0 49.1 -57.5 -41.6 4.8 -10.4 11.2 128 135 A K H < 0 0 158 -4,-1.8 -1,-0.2 -5,-0.1 -2,-0.2 0.902 360.0 360.0 -66.3 -39.7 2.9 -13.4 9.8 129 136 A K < 0 0 211 -4,-2.0 0, 0.0 -5,-0.1 0, 0.0 -0.423 360.0 360.0 -70.7 360.0 2.1 -11.4 6.7 130 !* 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 0.0 131 3 B T > 0 0 95 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 155.2 33.2 -6.0 11.6 132 4 B P H > + 0 0 59 0, 0.0 4,-1.9 0, 0.0 5,-0.1 0.931 360.0 47.5 -47.9 -54.2 31.4 -2.6 12.2 133 5 B S H >> S+ 0 0 65 1,-0.2 4,-2.2 2,-0.2 3,-0.6 0.953 108.3 53.3 -52.3 -58.0 34.2 -0.8 10.3 134 6 B M H 3> S+ 0 0 16 1,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.887 108.7 52.1 -45.0 -45.0 34.1 -3.2 7.4 135 7 B E H 3X S+ 0 0 50 -4,-2.4 4,-2.3 1,-0.2 -1,-0.3 0.885 106.5 52.5 -59.8 -43.1 30.3 -2.6 7.2 136 8 B D H S+ 0 0 18 -4,-2.4 4,-3.8 2,-0.2 5,-1.0 0.934 112.0 48.6 -61.8 -46.3 29.5 6.0 -4.1 145 17 B I H X5S+ 0 0 38 -4,-2.3 4,-0.8 4,-0.2 -2,-0.2 0.900 113.8 47.0 -61.4 -40.2 29.3 3.5 -7.0 146 18 B E H <5S+ 0 0 128 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.863 122.3 35.0 -69.6 -35.9 25.6 3.9 -7.2 147 19 B E H <5S+ 0 0 149 -4,-2.2 -2,-0.2 -5,-0.2 -3,-0.2 0.909 135.4 18.6 -85.7 -46.9 25.8 7.7 -7.0 148 20 B K H <5S- 0 0 86 -4,-3.8 -3,-0.2 2,-0.3 -2,-0.1 0.727 99.1-115.2 -99.1 -25.4 29.0 8.5 -9.0 149 21 B G S < - 0 0 128 -2,-0.5 4,-2.1 1,-0.1 5,-0.2 -0.646 27.3-128.5 -83.7 141.7 37.6 6.6 -5.3 153 25 B V H > S+ 0 0 49 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.925 113.0 54.6 -49.6 -45.5 39.8 6.0 -2.2 154 26 B S H > S+ 0 0 63 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.875 107.1 48.9 -59.7 -40.9 39.8 9.7 -1.8 155 27 B D H > S+ 0 0 19 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.837 111.3 49.6 -68.8 -34.6 35.9 9.9 -1.8 156 28 B I H X S+ 0 0 0 -4,-2.1 4,-2.1 2,-0.2 6,-0.2 0.919 108.6 53.6 -68.8 -43.3 35.7 7.1 0.7 157 29 B A H X>S+ 0 0 8 -4,-2.7 5,-2.0 -5,-0.2 4,-1.0 0.944 112.6 43.6 -53.1 -51.0 38.2 8.8 3.0 158 30 B E H ><5S+ 0 0 158 -4,-2.1 3,-0.8 1,-0.2 -2,-0.2 0.952 111.5 53.3 -61.4 -49.3 36.1 12.0 2.9 159 31 B A H 3<5S+ 0 0 50 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.860 120.0 33.3 -54.1 -38.7 32.8 10.2 3.4 160 32 B L H 3<5S- 0 0 39 -4,-2.1 -1,-0.3 -5,-0.1 -2,-0.2 0.477 105.8-124.3 -99.4 -5.8 34.1 8.4 6.5 161 33 B A T <<5 + 0 0 90 -4,-1.0 2,-0.3 -3,-0.8 -3,-0.2 0.890 67.6 127.3 59.2 44.4 36.3 11.2 7.7 162 34 B V < - 0 0 52 -5,-2.0 -1,-0.2 -6,-0.2 -2,-0.1 -0.780 66.8 -92.2-120.1 169.1 39.4 8.9 7.8 163 35 B H >> - 0 0 122 -2,-0.3 4,-1.4 1,-0.1 3,-1.1 -0.544 36.5-118.3 -74.1 146.4 42.9 9.0 6.4 164 36 B P H 3> S+ 0 0 58 0, 0.0 4,-3.1 0, 0.0 5,-0.2 0.833 113.7 64.2 -56.0 -32.6 43.3 7.4 3.0 165 37 B S H 3> S+ 0 0 68 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.884 100.7 50.9 -56.4 -40.3 45.8 4.9 4.5 166 38 B S H <> S+ 0 0 50 -3,-1.1 4,-1.9 2,-0.2 -1,-0.2 0.897 111.4 48.3 -64.4 -41.0 42.9 3.6 6.6 167 39 B V H X S+ 0 0 0 -4,-1.4 4,-3.0 2,-0.2 -2,-0.2 0.932 109.8 51.0 -62.3 -49.7 40.8 3.2 3.5 168 40 B T H X S+ 0 0 66 -4,-3.1 4,-1.6 1,-0.2 -2,-0.2 0.898 110.1 50.5 -54.9 -44.4 43.6 1.5 1.6 169 41 B K H X S+ 0 0 133 -4,-2.3 4,-1.7 -5,-0.2 -1,-0.2 0.930 113.3 44.9 -59.7 -47.4 44.1 -1.0 4.5 170 42 B M H X S+ 0 0 11 -4,-1.9 4,-2.6 1,-0.2 -2,-0.2 0.902 107.9 57.1 -65.8 -42.2 40.4 -1.8 4.6 171 43 B V H X S+ 0 0 17 -4,-3.0 4,-2.0 1,-0.2 -1,-0.2 0.838 105.8 53.2 -57.6 -33.9 40.1 -2.1 0.8 172 44 B Q H X S+ 0 0 132 -4,-1.6 4,-2.8 2,-0.2 -1,-0.2 0.916 108.7 46.7 -66.8 -45.5 42.8 -4.8 1.1 173 45 B K H X S+ 0 0 72 -4,-1.7 4,-2.5 1,-0.2 -2,-0.2 0.887 113.3 51.1 -63.0 -37.5 40.8 -6.8 3.7 174 46 B L H <>S+ 0 0 1 -4,-2.6 5,-3.1 2,-0.2 6,-0.9 0.864 111.0 47.0 -67.9 -38.7 37.8 -6.4 1.4 175 47 B D H ><5S+ 0 0 72 -4,-2.0 3,-1.8 3,-0.2 -2,-0.2 0.945 113.3 49.0 -65.5 -49.1 39.7 -7.6 -1.6 176 48 B K H 3<5S+ 0 0 153 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.891 111.5 48.8 -57.3 -43.9 41.1 -10.6 0.4 177 49 B D T 3<5S- 0 0 54 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.2 0.262 117.3-116.2 -83.9 11.0 37.6 -11.4 1.7 178 50 B E T < 5S+ 0 0 129 -3,-1.8 13,-0.3 2,-0.2 12,-0.3 0.807 79.6 123.6 62.7 36.0 36.2 -11.2 -1.9 179 51 B Y S - 0 0 35 -9,-1.8 4,-2.8 -2,-0.1 5,-0.2 -0.354 37.6 -93.3 -82.1 178.1 31.8 -8.6 -6.4 189 64 B S H > S+ 0 0 102 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.876 131.2 51.2 -60.7 -36.1 28.3 -10.1 -6.3 190 65 B K H > S+ 0 0 92 -12,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.929 111.6 45.9 -65.6 -45.5 28.9 -10.8 -2.6 191 66 B G H > S+ 0 0 0 -13,-0.3 4,-2.4 2,-0.2 -2,-0.2 0.857 113.0 51.0 -66.1 -36.6 29.9 -7.2 -2.0 192 67 B K H X S+ 0 0 108 -4,-2.8 4,-2.3 2,-0.2 -2,-0.2 0.941 111.9 46.0 -64.0 -50.2 27.0 -5.9 -4.1 193 68 B K H X S+ 0 0 150 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.950 115.8 46.1 -56.8 -50.7 24.5 -8.0 -2.1 194 69 B I H X S+ 0 0 55 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.911 112.0 50.1 -63.6 -41.2 26.0 -7.1 1.2 195 70 B G H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.901 109.2 52.0 -64.3 -41.0 26.2 -3.4 0.4 196 71 B K H X S+ 0 0 129 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.908 111.3 47.0 -61.7 -42.6 22.5 -3.3 -0.8 197 72 B R H X S+ 0 0 119 -4,-2.1 4,-2.9 2,-0.2 -1,-0.2 0.874 110.6 52.9 -66.1 -36.6 21.4 -4.9 2.5 198 73 B L H X S+ 0 0 9 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.901 110.7 46.3 -67.4 -41.6 23.6 -2.5 4.5 199 74 B V H X S+ 0 0 21 -4,-2.4 4,-2.6 2,-0.2 5,-0.2 0.908 112.8 50.3 -64.0 -44.4 22.0 0.5 2.8 200 75 B Y H X S+ 0 0 104 -4,-2.3 4,-3.0 -5,-0.2 5,-0.3 0.958 109.7 51.1 -56.2 -51.4 18.5 -1.0 3.3 201 76 B R H X S+ 0 0 14 -4,-2.9 4,-2.3 2,-0.2 -1,-0.2 0.888 111.0 48.9 -51.7 -42.3 19.3 -1.5 7.0 202 77 B H H X S+ 0 0 22 -4,-1.9 4,-2.5 2,-0.2 5,-0.2 0.967 113.7 44.4 -64.5 -52.8 20.4 2.2 7.3 203 78 B E H X S+ 0 0 120 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.891 113.7 50.8 -58.3 -43.8 17.3 3.5 5.6 204 79 B L H X S+ 0 0 8 -4,-3.0 4,-2.6 -5,-0.2 -1,-0.2 0.915 110.7 49.6 -60.9 -45.1 15.0 1.2 7.6 205 80 B L H X S+ 0 0 0 -4,-2.3 4,-2.3 -5,-0.3 -2,-0.2 0.890 110.9 48.0 -65.1 -39.7 16.7 2.3 10.8 206 81 B E H X S+ 0 0 36 -4,-2.5 4,-2.6 2,-0.2 -1,-0.2 0.928 112.7 50.0 -62.3 -44.2 16.3 6.0 10.0 207 82 B Q H X S+ 0 0 66 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.873 108.7 52.9 -62.3 -40.7 12.7 5.4 9.1 208 83 B F H X S+ 0 0 7 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.961 112.3 43.2 -57.9 -53.2 12.1 3.6 12.3 209 84 B L H <>S+ 0 0 0 -4,-2.3 5,-2.3 1,-0.2 4,-0.3 0.892 113.8 52.4 -64.8 -37.4 13.5 6.4 14.4 210 85 B R H ><5S+ 0 0 103 -4,-2.6 3,-1.3 3,-0.2 -1,-0.2 0.934 108.8 50.3 -59.4 -47.8 11.6 9.0 12.4 211 86 B I H 3<5S+ 0 0 28 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.908 107.0 51.7 -63.8 -42.9 8.3 7.2 12.8 212 87 B I T 3<5S- 0 0 0 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.508 123.7-106.0 -77.5 4.2 8.6 6.9 16.5 213 88 B G T < 5 + 0 0 33 -3,-1.3 2,-0.2 -4,-0.3 -3,-0.2 0.685 57.4 163.1 91.1 20.7 9.3 10.7 16.6 214 89 B V < - 0 0 6 -5,-2.3 -1,-0.2 1,-0.1 5,-0.1 -0.521 54.4 -92.5 -67.4 136.4 13.0 11.1 17.3 215 90 B D >> - 0 0 87 -2,-0.2 3,-1.8 1,-0.1 4,-0.8 -0.259 35.2-125.6 -48.1 130.8 14.2 14.7 16.4 216 91 B E H >> S+ 0 0 103 1,-0.3 3,-1.0 2,-0.2 4,-0.6 0.847 106.2 60.6 -54.8 -39.1 15.5 14.5 12.9 217 92 B E H 34 S+ 0 0 164 1,-0.3 4,-0.4 2,-0.1 -1,-0.3 0.765 105.4 49.1 -60.3 -26.2 18.9 16.0 13.8 218 93 B K H <> S+ 0 0 74 -3,-1.8 4,-1.7 1,-0.1 -1,-0.3 0.693 92.5 80.2 -86.4 -20.0 19.6 13.0 16.2 219 94 B I H S+ 0 0 120 -4,-0.4 4,-1.1 1,-0.2 -1,-0.2 0.901 112.6 48.0 -59.1 -43.4 24.2 9.6 14.5 222 97 B D H >X S+ 0 0 14 -4,-1.7 4,-2.8 2,-0.2 3,-0.6 0.944 113.4 47.2 -64.5 -43.5 22.1 7.0 16.3 223 98 B V H 3X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.3 -2,-0.2 0.926 106.0 58.3 -67.1 -40.3 21.6 4.8 13.2 224 99 B E H 3< S+ 0 0 32 -4,-2.9 -1,-0.3 -5,-0.2 4,-0.2 0.807 116.1 36.5 -56.5 -29.1 25.3 5.0 12.3 225 100 B G H X< S+ 0 0 11 -4,-1.1 3,-0.8 -3,-0.6 -2,-0.2 0.913 118.6 43.8 -89.7 -50.4 26.1 3.5 15.7 226 101 B I H >< S+ 0 0 5 -4,-2.8 3,-2.1 -129,-0.4 4,-0.2 0.733 94.2 79.4 -71.3 -21.8 23.2 1.0 16.4 227 102 B E G >< S+ 0 0 0 -4,-2.2 3,-0.8 1,-0.3 -1,-0.2 0.825 91.0 52.8 -57.8 -34.0 23.2 -0.5 12.9 228 103 B H G < S+ 0 0 30 -3,-0.8 -1,-0.3 -4,-0.2 -2,-0.1 0.428 107.5 51.7 -82.1 -0.4 26.2 -2.7 13.6 229 104 B H G < S+ 0 0 61 -3,-2.1 2,-0.5 -4,-0.1 -135,-0.4 0.157 83.9 96.3-127.1 14.8 24.7 -4.2 16.8 230 105 B L < - 0 0 16 -3,-0.8 -140,-0.0 -4,-0.2 -141,-0.0 -0.940 67.4-134.7-108.3 127.6 21.3 -5.4 15.7 231 106 B S > - 0 0 21 -2,-0.5 4,-2.0 -145,-0.2 5,-0.1 -0.219 30.8-105.6 -64.2 168.2 20.9 -9.1 14.6 232 107 B W H > S+ 0 0 122 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.857 122.6 60.5 -64.2 -33.2 19.0 -9.8 11.5 233 108 B N H > S+ 0 0 24 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.929 105.5 45.3 -58.7 -49.6 16.1 -10.9 13.7 234 109 B S H > S+ 0 0 0 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.919 112.4 52.0 -57.5 -45.2 15.9 -7.5 15.3 235 110 B I H X S+ 0 0 1 -4,-2.0 4,-1.7 1,-0.2 -2,-0.2 0.888 109.8 48.9 -63.0 -39.3 16.1 -5.8 11.9 236 111 B D H X S+ 0 0 76 -4,-2.6 4,-2.2 2,-0.2 -1,-0.2 0.926 112.8 47.0 -62.8 -44.9 13.2 -8.0 10.6 237 112 B R H X S+ 0 0 41 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.842 111.5 51.1 -66.9 -35.5 11.1 -7.2 13.6 238 113 B I H X S+ 0 0 3 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.807 108.1 54.3 -67.5 -31.6 11.9 -3.5 13.2 239 114 B G H X S+ 0 0 12 -4,-1.7 4,-2.2 -5,-0.2 -2,-0.2 0.908 108.5 47.5 -66.9 -43.1 10.9 -3.9 9.6 240 115 B D H X S+ 0 0 27 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.856 110.6 52.8 -63.8 -37.0 7.5 -5.3 10.7 241 116 B L H X S+ 0 0 1 -4,-1.9 4,-1.7 2,-0.2 -2,-0.2 0.898 108.7 49.0 -68.0 -40.4 7.2 -2.5 13.2 242 117 B V H X S+ 0 0 7 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.921 113.3 46.4 -64.9 -42.9 7.8 0.2 10.5 243 118 B Q H X S+ 0 0 98 -4,-2.2 4,-1.8 1,-0.2 -2,-0.2 0.885 106.3 61.6 -65.1 -36.3 5.2 -1.5 8.2 244 119 B Y H < S+ 0 0 1 -4,-2.3 4,-0.3 1,-0.2 -2,-0.2 0.902 114.0 33.4 -51.4 -46.6 2.8 -1.7 11.2 245 120 B F H >< S+ 0 0 1 -4,-1.7 3,-1.0 1,-0.2 7,-0.3 0.868 115.7 54.8 -80.3 -40.1 2.8 2.1 11.5 246 121 B E H 3< S+ 0 0 86 -4,-2.6 3,-0.3 1,-0.2 -2,-0.2 0.751 100.7 62.8 -64.4 -25.7 3.1 3.0 7.8 247 122 B E T 3< S+ 0 0 98 -4,-1.8 -1,-0.2 1,-0.3 2,-0.2 0.653 116.8 22.0 -80.7 -18.0 0.1 0.9 7.0 248 123 B D X> - 0 0 74 -3,-1.0 3,-2.2 -4,-0.3 4,-0.7 -0.713 58.7-160.3-153.2 106.0 -2.3 3.0 9.1 249 124 B D H 3> S+ 0 0 77 -3,-0.3 4,-1.8 1,-0.3 3,-0.2 0.706 89.4 74.3 -48.7 -26.1 -1.6 6.6 10.2 250 125 B A H 3> S+ 0 0 45 1,-0.3 4,-1.6 2,-0.2 -1,-0.3 0.801 92.2 53.2 -64.1 -28.7 -4.2 6.2 13.0 251 126 B R H <> S+ 0 0 30 -3,-2.2 4,-2.4 -6,-0.2 -1,-0.3 0.841 106.8 53.0 -72.6 -32.8 -1.7 4.1 14.9 252 127 B K H X S+ 0 0 51 -4,-0.7 4,-2.4 -7,-0.3 -2,-0.2 0.856 107.8 50.3 -67.1 -37.6 0.8 7.0 14.5 253 128 B K H X S+ 0 0 95 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.872 110.2 50.0 -67.9 -36.8 -1.8 9.4 15.9 254 129 B D H X S+ 0 0 69 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.920 108.6 52.0 -68.4 -43.5 -2.3 7.1 18.9 255 130 B L H X S+ 0 0 2 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.949 109.4 51.0 -53.6 -48.4 1.5 6.9 19.4 256 131 B K H X S+ 0 0 85 -4,-2.4 4,-1.5 1,-0.2 -2,-0.2 0.884 106.7 54.3 -54.1 -41.3 1.4 10.7 19.4 257 132 B S H X S+ 0 0 54 -4,-1.9 4,-1.4 1,-0.2 -1,-0.2 0.892 108.2 49.0 -62.6 -42.4 -1.4 10.6 22.0 258 133 B I H < S+ 0 0 7 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.909 107.1 55.7 -60.3 -43.8 0.8 8.5 24.3 259 134 B Q H < S+ 0 0 63 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.803 106.3 51.3 -60.9 -29.8 3.7 10.8 23.8 260 135 B K H < 0 0 172 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.851 360.0 360.0 -72.2 -37.8 1.6 13.7 25.1 261 136 B K < 0 0 169 -4,-1.4 0, 0.0 -3,-0.2 0, 0.0 -0.522 360.0 360.0 -71.0 360.0 0.6 11.7 28.1