==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=31-MAY-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION 24-JUL-12 4G9Y . COMPND 2 MOLECULE: PCAV TRANSCRIPTIONAL REGULATOR; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOMYCES COELICOLOR; . AUTHOR B.L.BROWN,J.R.DAVIS,J.K.SELLO,R.PAGE . 136 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9791.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 102 75.0 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 . 8 5.9 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 . 2 1.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 6 4.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 81 59.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 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 0 0 0 0 1 0 0 0 1 1 0 0 0 0 0 2 0 0 1 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 . 1 0 0 0 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 ANTIPARALLEL BRIDGES PER LADDER . 0 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 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 8 A T 0 0 175 0, 0.0 5,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -71.0 -26.4 -34.9 -47.2 2 9 A H > - 0 0 138 3,-0.1 4,-1.9 1,-0.1 5,-0.1 0.993 360.0-175.1 71.6 71.7 -22.9 -34.7 -45.7 3 10 A P H > S+ 0 0 99 0, 0.0 4,-2.1 0, 0.0 5,-0.1 0.756 80.8 60.2 -73.0 -20.1 -23.3 -33.0 -42.3 4 11 A G H > S+ 0 0 38 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.940 107.2 46.6 -68.4 -45.2 -19.5 -33.0 -41.6 5 12 A H H > S+ 0 0 103 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.921 112.5 50.5 -54.8 -48.4 -19.0 -30.9 -44.7 6 13 A L H X S+ 0 0 106 -4,-1.9 4,-2.1 1,-0.2 -1,-0.2 0.888 107.9 52.3 -63.3 -40.2 -21.9 -28.6 -43.8 7 14 A A H X S+ 0 0 61 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.918 109.4 48.9 -64.9 -41.4 -20.5 -28.0 -40.2 8 15 A R H X S+ 0 0 150 -4,-2.0 4,-2.8 1,-0.2 -1,-0.2 0.908 109.9 52.9 -63.2 -41.9 -17.1 -27.0 -41.6 9 16 A R H X S+ 0 0 154 -4,-2.2 4,-2.6 2,-0.2 -1,-0.2 0.899 108.4 50.2 -56.4 -45.1 -18.8 -24.6 -44.0 10 17 A L H X S+ 0 0 65 -4,-2.1 4,-1.7 2,-0.2 -1,-0.2 0.909 113.0 45.4 -63.6 -43.3 -20.8 -23.0 -41.2 11 18 A Q H X S+ 0 0 123 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.925 114.0 48.9 -67.1 -42.6 -17.7 -22.5 -39.1 12 19 A Q H X S+ 0 0 120 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.867 107.6 55.5 -63.4 -37.7 -15.7 -21.2 -42.1 13 20 A A H X S+ 0 0 42 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.894 108.5 47.9 -62.3 -39.0 -18.5 -18.8 -43.0 14 21 A H H X S+ 0 0 55 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.915 111.0 50.8 -68.0 -40.3 -18.3 -17.3 -39.5 15 22 A Y H X S+ 0 0 145 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.901 109.0 52.5 -62.2 -40.7 -14.5 -17.0 -39.7 16 23 A L H X S+ 0 0 106 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.920 109.8 47.7 -60.5 -44.3 -14.9 -15.2 -43.0 17 24 A L H X S+ 0 0 37 -4,-2.0 4,-2.8 1,-0.2 5,-0.5 0.854 107.5 56.1 -69.7 -33.4 -17.4 -12.7 -41.5 18 25 A W H X>S+ 0 0 16 -4,-2.2 5,-2.1 1,-0.2 4,-1.9 0.942 110.9 45.2 -58.0 -46.0 -15.1 -12.1 -38.6 19 26 A N H <5S+ 0 0 42 -4,-2.0 -2,-0.2 3,-0.2 -1,-0.2 0.840 120.8 37.4 -71.0 -30.9 -12.3 -11.2 -41.0 20 27 A T H <5S+ 0 0 84 -4,-1.9 -1,-0.2 -5,-0.1 -2,-0.2 0.791 130.5 25.9 -91.9 -26.4 -14.5 -9.0 -43.2 21 28 A M H <5S+ 0 0 49 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.2 0.587 130.4 27.9-114.1 -15.1 -16.7 -7.3 -40.6 22 29 A V T <5S- 0 0 5 -4,-1.9 2,-0.3 -5,-0.5 -3,-0.2 0.769 118.7 -37.6-110.2 -67.6 -14.7 -7.3 -37.3 23 30 A S < - 0 0 21 -5,-2.1 -1,-0.1 3,-0.1 -2,-0.1 -0.923 21.7-159.7-166.4 136.9 -11.0 -7.3 -38.0 24 31 A E S S+ 0 0 165 -2,-0.3 -5,-0.1 -4,-0.1 3,-0.1 0.528 104.3 41.3 -87.2 -9.3 -8.3 -8.7 -40.3 25 32 A E S S+ 0 0 125 1,-0.2 2,-0.6 -6,-0.1 -2,-0.1 0.822 105.2 58.7-106.4 -48.0 -5.8 -8.0 -37.6 26 33 A T S S- 0 0 2 -7,-0.1 -1,-0.2 4,-0.1 -3,-0.1 -0.776 76.2-148.9 -90.2 122.5 -7.3 -9.0 -34.2 27 34 A T > - 0 0 57 -2,-0.6 4,-2.5 1,-0.1 5,-0.2 -0.384 26.6-104.9 -83.8 167.4 -8.3 -12.6 -34.1 28 35 A S H > S+ 0 0 65 2,-0.2 4,-2.3 1,-0.2 5,-0.1 0.915 121.5 47.8 -55.2 -47.9 -11.2 -14.2 -32.2 29 36 A P H > S+ 0 0 53 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.894 110.7 52.4 -63.9 -37.1 -8.8 -15.7 -29.5 30 37 A Q H > S+ 0 0 11 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.930 110.0 48.2 -62.3 -44.1 -7.0 -12.4 -29.2 31 38 A Y H X S+ 0 0 34 -4,-2.5 4,-3.1 1,-0.2 -1,-0.2 0.891 106.1 57.5 -62.6 -40.2 -10.3 -10.6 -28.6 32 39 A A H X S+ 0 0 32 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.878 106.3 50.6 -58.4 -36.3 -11.3 -13.2 -26.0 33 40 A V H X S+ 0 0 0 -4,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.934 110.8 46.7 -67.0 -47.4 -8.1 -12.4 -24.1 34 41 A L H X S+ 0 0 0 -4,-2.0 4,-1.5 1,-0.2 -2,-0.2 0.931 113.6 51.4 -56.9 -44.2 -8.8 -8.6 -24.1 35 42 A N H X S+ 0 0 74 -4,-3.1 4,-1.6 1,-0.2 3,-0.3 0.916 108.1 49.5 -60.5 -45.6 -12.4 -9.5 -23.1 36 43 A A H X S+ 0 0 11 -4,-2.6 4,-1.8 1,-0.2 -1,-0.2 0.858 110.9 51.4 -60.1 -35.5 -11.3 -11.6 -20.2 37 44 A L H < S+ 0 0 3 -4,-1.9 51,-0.3 2,-0.2 -1,-0.2 0.705 103.1 57.0 -82.3 -20.8 -9.0 -8.8 -19.0 38 45 A V H < S+ 0 0 54 -4,-1.5 -1,-0.2 -3,-0.3 -2,-0.2 0.896 112.1 43.7 -67.1 -42.9 -11.7 -6.1 -19.1 39 46 A A H < S+ 0 0 77 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.1 0.856 131.9 20.9 -70.0 -35.1 -13.7 -8.3 -16.7 40 47 A E S >< S- 0 0 75 -4,-1.8 3,-1.6 -5,-0.2 -1,-0.2 -0.610 77.0-162.2-138.7 78.4 -10.7 -9.1 -14.5 41 48 A P T 3 S+ 0 0 76 0, 0.0 46,-0.2 0, 0.0 -3,-0.1 -0.296 78.8 24.4 -59.6 138.6 -7.8 -6.7 -14.8 42 49 A G T 3 S+ 0 0 14 44,-1.7 45,-0.2 1,-0.2 -5,-0.1 0.503 81.2 154.5 87.4 3.3 -4.6 -8.1 -13.4 43 50 A L < - 0 0 26 -3,-1.6 43,-2.6 43,-0.3 -1,-0.2 -0.301 48.6-107.8 -60.5 148.0 -5.5 -11.8 -13.9 44 51 A D B > -A 85 0A 10 41,-0.2 4,-2.4 1,-0.1 41,-0.2 -0.446 23.7-113.2 -80.3 160.9 -2.4 -14.0 -14.3 45 52 A Q H > S+ 0 0 29 39,-2.1 4,-2.5 1,-0.2 5,-0.2 0.867 113.9 54.7 -61.0 -42.4 -1.6 -15.5 -17.7 46 53 A R H > S+ 0 0 181 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.935 112.2 44.2 -58.6 -46.1 -2.2 -19.1 -16.7 47 54 A T H > S+ 0 0 19 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.893 109.5 55.6 -69.0 -38.0 -5.7 -18.2 -15.6 48 55 A V H X S+ 0 0 0 -4,-2.4 4,-1.8 1,-0.2 -1,-0.2 0.928 106.7 51.4 -59.1 -43.4 -6.4 -16.0 -18.6 49 56 A G H X>S+ 0 0 2 -4,-2.5 5,-2.6 1,-0.2 4,-0.8 0.896 110.0 50.5 -58.2 -40.3 -5.5 -19.0 -20.8 50 57 A E H ><5S+ 0 0 115 -4,-1.7 3,-0.5 3,-0.2 -2,-0.2 0.904 106.7 53.7 -64.2 -42.4 -8.0 -21.0 -18.7 51 58 A R H 3<5S+ 0 0 126 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.856 118.0 35.5 -60.1 -39.0 -10.8 -18.4 -19.2 52 59 A V H 3<5S- 0 0 36 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.445 111.9-116.8 -98.3 -0.4 -10.5 -18.5 -22.9 53 60 A G T <<5 + 0 0 64 -4,-0.8 2,-0.4 -3,-0.5 -3,-0.2 0.893 63.5 141.0 68.6 43.6 -9.7 -22.2 -23.2 54 61 A L < - 0 0 42 -5,-2.6 -1,-0.2 -6,-0.1 -2,-0.1 -0.912 50.8-115.5-117.1 146.5 -6.2 -21.9 -24.7 55 62 A D > - 0 0 95 -2,-0.4 4,-2.6 1,-0.1 5,-0.3 -0.240 38.5 -98.4 -72.0 166.7 -3.1 -24.1 -24.0 56 63 A R H > S+ 0 0 202 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.822 122.2 48.1 -60.3 -32.8 -0.0 -22.5 -22.4 57 64 A S H > S+ 0 0 68 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.901 112.4 47.1 -74.9 -40.7 1.8 -22.1 -25.7 58 65 A T H > S+ 0 0 40 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.911 113.1 48.6 -68.0 -40.5 -1.1 -20.5 -27.6 59 66 A I H X S+ 0 0 4 -4,-2.6 4,-3.0 2,-0.2 5,-0.3 0.916 109.5 53.8 -65.1 -39.6 -1.8 -18.1 -24.7 60 67 A A H X S+ 0 0 35 -4,-1.7 4,-2.1 -5,-0.3 -1,-0.2 0.912 111.1 46.1 -57.2 -44.2 1.9 -17.2 -24.6 61 68 A E H X S+ 0 0 84 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.924 113.3 48.2 -66.5 -45.3 1.7 -16.4 -28.4 62 69 A V H X S+ 0 0 4 -4,-2.7 4,-2.7 2,-0.2 5,-0.3 0.945 112.8 48.4 -59.8 -47.6 -1.5 -14.4 -28.1 63 70 A V H X S+ 0 0 4 -4,-3.0 4,-2.3 1,-0.2 -1,-0.2 0.900 109.8 52.1 -62.3 -41.5 -0.2 -12.4 -25.1 64 71 A S H X S+ 0 0 65 -4,-2.1 4,-2.2 -5,-0.3 -1,-0.2 0.915 112.1 46.4 -60.3 -43.2 3.1 -11.6 -26.9 65 72 A R H X S+ 0 0 130 -4,-2.1 4,-1.3 2,-0.2 -2,-0.2 0.935 113.2 46.6 -67.4 -46.3 1.3 -10.3 -29.9 66 73 A L H <>S+ 0 0 0 -4,-2.7 5,-2.7 1,-0.2 6,-0.8 0.866 112.2 53.7 -62.9 -35.3 -1.2 -8.2 -27.9 67 74 A G H ><5S+ 0 0 32 -4,-2.3 3,-1.5 -5,-0.3 -2,-0.2 0.926 106.4 50.5 -62.5 -45.8 1.8 -6.9 -26.0 68 75 A R H 3<5S+ 0 0 218 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.743 107.1 54.9 -67.3 -24.4 3.7 -5.9 -29.1 69 76 A R T 3<5S- 0 0 81 -4,-1.3 -1,-0.3 -5,-0.1 -2,-0.2 0.426 116.7-114.4 -87.3 1.4 0.6 -4.0 -30.4 70 77 A G T < 5S+ 0 0 36 -3,-1.5 22,-0.4 2,-0.2 21,-0.3 0.784 84.6 118.5 73.6 28.1 0.6 -2.0 -27.2 71 78 A L S S- 0 0 89 1,-0.1 3,-1.5 2,-0.0 -3,-0.4 -0.743 73.6-159.6 -84.7 107.0 4.7 -15.4 -6.6 81 88 A G T 3 S+ 0 0 21 -2,-0.9 -1,-0.1 1,-0.3 -4,-0.1 0.625 82.8 61.9 -63.6 -15.0 7.6 -14.7 -8.9 82 89 A R T 3 S+ 0 0 244 -6,-0.1 2,-0.3 2,-0.0 -1,-0.3 0.126 91.2 72.7-107.1 22.8 6.7 -17.4 -11.4 83 90 A R S < S- 0 0 90 -3,-1.5 -6,-2.9 -6,-0.2 2,-0.4 -0.950 70.1-143.3-123.4 154.0 3.3 -16.1 -12.5 84 91 A S E - B 0 76A 35 -2,-0.3 -39,-2.1 -8,-0.2 2,-0.4 -0.967 7.8-140.8-120.9 130.4 2.8 -13.0 -14.7 85 92 A L E -AB 44 75A 36 -10,-3.7 -10,-2.9 -2,-0.4 2,-0.4 -0.734 16.2-154.0 -92.7 136.1 -0.1 -10.5 -14.2 86 93 A L E + B 0 74A 0 -43,-2.6 -44,-1.7 -2,-0.4 2,-0.3 -0.880 16.0 172.7-112.7 140.4 -1.7 -9.1 -17.4 87 94 A R E - B 0 73A 138 -14,-2.3 -14,-3.3 -2,-0.4 -49,-0.1 -0.997 31.2-115.0-145.0 139.8 -3.5 -5.8 -17.7 88 95 A L E - B 0 72A 20 -2,-0.3 -16,-0.3 -51,-0.3 2,-0.1 -0.411 27.1-132.3 -69.6 150.1 -5.0 -3.9 -20.7 89 96 A T > - 0 0 24 -18,-1.7 4,-2.1 -2,-0.1 5,-0.2 -0.449 35.0 -95.7 -86.3 171.6 -3.4 -0.6 -21.8 90 97 A D H > S+ 0 0 127 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.894 130.2 47.7 -53.2 -41.6 -5.7 2.4 -22.5 91 98 A E H > S+ 0 0 71 -21,-0.3 4,-2.9 2,-0.2 5,-0.2 0.869 106.7 56.2 -71.0 -33.7 -5.5 1.5 -26.2 92 99 A G H > S+ 0 0 0 -22,-0.4 4,-2.3 1,-0.2 -2,-0.2 0.895 108.0 49.2 -62.9 -37.7 -6.3 -2.2 -25.4 93 100 A L H X S+ 0 0 79 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.900 112.0 48.5 -65.4 -41.9 -9.5 -1.0 -23.7 94 101 A R H X S+ 0 0 102 -4,-1.7 4,-2.6 2,-0.2 -2,-0.2 0.916 111.9 48.1 -64.4 -45.9 -10.4 1.2 -26.7 95 102 A V H X S+ 0 0 6 -4,-2.9 4,-2.8 2,-0.2 5,-0.3 0.921 110.4 52.5 -62.1 -42.9 -9.8 -1.7 -29.2 96 103 A H H X S+ 0 0 27 -4,-2.3 4,-2.2 -5,-0.2 -2,-0.2 0.927 111.2 47.2 -60.2 -44.1 -11.8 -4.0 -27.0 97 104 A R H X S+ 0 0 144 -4,-2.1 4,-1.5 2,-0.2 -2,-0.2 0.929 113.9 45.7 -62.2 -47.9 -14.7 -1.5 -27.0 98 105 A R H X S+ 0 0 127 -4,-2.6 4,-1.6 1,-0.2 -2,-0.2 0.915 114.6 47.9 -63.8 -43.6 -14.6 -0.8 -30.8 99 106 A L H X S+ 0 0 13 -4,-2.8 4,-3.0 -5,-0.2 5,-0.2 0.892 105.3 59.9 -65.7 -39.1 -14.4 -4.5 -31.7 100 107 A G H X S+ 0 0 21 -4,-2.2 4,-2.2 -5,-0.3 -1,-0.2 0.902 105.0 48.5 -53.5 -45.7 -17.2 -5.4 -29.3 101 108 A V H X S+ 0 0 75 -4,-1.5 4,-1.8 1,-0.2 -1,-0.2 0.915 113.9 47.1 -61.2 -42.0 -19.6 -3.2 -31.2 102 109 A R H X S+ 0 0 115 -4,-1.6 4,-2.6 1,-0.2 -2,-0.2 0.876 109.6 53.2 -69.2 -36.1 -18.4 -4.8 -34.5 103 110 A I H X S+ 0 0 24 -4,-3.0 4,-2.6 2,-0.2 5,-0.2 0.914 107.8 50.8 -66.1 -41.3 -18.8 -8.3 -33.1 104 111 A A H X S+ 0 0 63 -4,-2.2 4,-1.5 1,-0.2 -1,-0.2 0.912 113.6 44.6 -62.5 -43.5 -22.4 -7.6 -32.1 105 112 A R H X S+ 0 0 135 -4,-1.8 4,-2.4 2,-0.2 -1,-0.2 0.901 112.2 53.2 -66.3 -40.9 -23.2 -6.3 -35.5 106 113 A M H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.920 108.6 47.8 -63.9 -45.7 -21.4 -9.1 -37.2 107 114 A N H X S+ 0 0 62 -4,-2.6 4,-1.5 2,-0.2 -1,-0.2 0.832 110.2 52.8 -66.2 -31.8 -23.2 -11.9 -35.4 108 115 A Q H X S+ 0 0 144 -4,-1.5 4,-0.8 -5,-0.2 -2,-0.2 0.919 111.6 46.5 -66.6 -43.4 -26.6 -10.2 -36.1 109 116 A V H < S+ 0 0 65 -4,-2.4 3,-0.4 1,-0.2 -2,-0.2 0.897 108.0 57.2 -63.6 -40.5 -25.7 -10.2 -39.8 110 117 A F H < S+ 0 0 44 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.886 115.8 35.3 -54.5 -42.9 -24.5 -13.8 -39.6 111 118 A L H >< S+ 0 0 26 -4,-1.5 3,-1.9 1,-0.2 -1,-0.2 0.516 91.8 101.2 -89.9 -7.0 -28.0 -14.9 -38.3 112 119 A A T 3< + 0 0 63 -4,-0.8 -1,-0.2 -3,-0.4 -2,-0.1 0.658 66.2 66.2 -59.6 -26.2 -29.9 -12.4 -40.4 113 120 A P T 3 S+ 0 0 107 0, 0.0 2,-0.4 0, 0.0 -1,-0.3 0.720 95.7 76.0 -64.9 -17.7 -31.1 -14.7 -43.3 114 121 A L S < S- 0 0 51 -3,-1.9 5,-0.0 2,-0.0 -3,-0.0 -0.775 85.6-125.0 -97.5 136.4 -33.2 -16.4 -40.6 115 122 A A > - 0 0 58 -2,-0.4 4,-2.1 1,-0.1 3,-0.3 -0.310 39.3 -99.4 -64.6 160.2 -36.4 -15.0 -39.1 116 123 A A H > S+ 0 0 77 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.886 125.5 51.0 -53.0 -41.7 -36.4 -14.7 -35.3 117 124 A D H > S+ 0 0 137 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.883 110.4 49.6 -63.5 -38.1 -38.3 -17.9 -34.9 118 125 A E H > S+ 0 0 105 -3,-0.3 4,-2.8 2,-0.2 -1,-0.2 0.826 104.1 58.8 -70.6 -33.1 -35.9 -19.7 -37.2 119 126 A Q H X S+ 0 0 58 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.900 105.3 49.9 -62.6 -39.4 -32.9 -18.4 -35.2 120 127 A A H X S+ 0 0 64 -4,-1.5 4,-2.2 2,-0.2 -1,-0.2 0.900 112.3 47.1 -66.7 -38.6 -34.3 -20.0 -32.1 121 128 A V H X S+ 0 0 79 -4,-1.5 4,-3.2 2,-0.2 5,-0.3 0.927 107.5 57.5 -64.8 -42.2 -34.7 -23.3 -34.0 122 129 A F H X S+ 0 0 54 -4,-2.8 4,-2.0 1,-0.2 5,-0.3 0.928 111.4 42.3 -53.2 -49.5 -31.2 -23.0 -35.4 123 130 A F H X S+ 0 0 83 -4,-2.2 4,-2.6 2,-0.2 5,-0.2 0.929 114.0 51.0 -65.8 -44.9 -29.7 -22.8 -31.9 124 131 A D H X S+ 0 0 79 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.941 113.6 43.6 -58.0 -50.3 -31.9 -25.6 -30.5 125 132 A L H X S+ 0 0 84 -4,-3.2 4,-2.1 2,-0.2 -1,-0.2 0.905 115.1 46.9 -65.9 -45.0 -31.1 -28.1 -33.3 126 133 A I H X S+ 0 0 74 -4,-2.0 4,-3.0 -5,-0.3 5,-0.3 0.927 112.7 50.6 -66.1 -41.4 -27.4 -27.4 -33.3 127 134 A R H X S+ 0 0 148 -4,-2.6 4,-2.7 -5,-0.3 5,-0.2 0.914 109.4 50.6 -60.9 -42.5 -27.1 -27.6 -29.5 128 135 A R H X S+ 0 0 155 -4,-2.2 4,-2.0 -5,-0.2 -1,-0.2 0.909 113.5 45.8 -62.1 -40.8 -29.0 -30.9 -29.5 129 136 A V H X S+ 0 0 107 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.939 116.6 43.1 -68.8 -47.1 -26.7 -32.4 -32.1 130 137 A A H X S+ 0 0 38 -4,-3.0 4,-2.1 1,-0.2 -2,-0.2 0.909 114.4 50.8 -66.1 -39.2 -23.4 -31.1 -30.5 131 138 A D H X S+ 0 0 105 -4,-2.7 4,-0.7 -5,-0.3 -1,-0.2 0.912 111.0 47.8 -66.8 -42.6 -24.5 -32.1 -27.0 132 139 A A H < S+ 0 0 66 -4,-2.0 3,-0.4 -5,-0.2 -1,-0.2 0.881 111.8 49.3 -67.9 -37.7 -25.5 -35.6 -28.0 133 140 A A H >< S+ 0 0 67 -4,-1.9 3,-1.2 1,-0.2 -1,-0.2 0.893 112.2 47.8 -69.0 -37.8 -22.2 -36.2 -29.9 134 141 A E H 3< S+ 0 0 159 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.566 106.6 57.6 -80.9 -7.4 -20.1 -35.0 -27.0 135 142 A G T 3< 0 0 62 -4,-0.7 -1,-0.3 -3,-0.4 -2,-0.2 0.328 360.0 360.0 -95.9 3.1 -22.1 -37.2 -24.6 136 143 A L < 0 0 194 -3,-1.2 -1,-0.2 -5,-0.1 -2,-0.0 -0.533 360.0 360.0 70.5 360.0 -21.0 -40.1 -26.8