==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER RECOMBINATION 08-AUG-08 3E3V . COMPND 2 MOLECULE: REGULATORY PROTEIN RECX; . SOURCE 2 ORGANISM_SCIENTIFIC: LACTOBACILLUS SALIVARIUS; . AUTHOR R.AGARWAL,S.K.BURLEY,S.SWAMINATHAN,NEW YORK SGX RESEARCH CEN . 154 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9557.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 118 76.6 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 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 10.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 94 61.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 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 1 0 0 1 1 0 0 0 2 1 1 1 0 1 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 55 A L >> 0 0 169 0, 0.0 3,-0.7 0, 0.0 4,-0.5 0.000 360.0 360.0 360.0-112.6 72.3 11.7 -6.0 2 56 A A H 3> + 0 0 69 1,-0.2 4,-1.0 2,-0.2 5,-0.0 0.531 360.0 71.4 -85.1 -8.4 71.0 15.0 -4.5 3 57 A D H 3> S+ 0 0 94 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.558 88.2 67.0 -81.8 -8.1 69.0 15.6 -7.7 4 58 A D H <> S+ 0 0 33 -3,-0.7 4,-1.9 2,-0.2 -2,-0.2 0.947 101.1 42.8 -74.7 -53.3 66.8 12.8 -6.6 5 59 A I H X S+ 0 0 31 -4,-0.5 4,-2.2 1,-0.2 -2,-0.2 0.837 114.4 55.7 -61.8 -31.8 65.3 14.6 -3.6 6 60 A S H X S+ 0 0 75 -4,-1.0 4,-2.1 2,-0.2 -1,-0.2 0.934 106.5 46.0 -67.3 -49.7 65.1 17.7 -5.8 7 61 A K H X S+ 0 0 136 -4,-1.9 4,-2.2 1,-0.2 -1,-0.2 0.855 112.4 55.4 -62.3 -32.2 63.0 16.0 -8.5 8 62 A G H X S+ 0 0 0 -4,-1.9 4,-1.7 1,-0.2 -2,-0.2 0.915 107.5 45.8 -66.5 -44.9 60.9 14.6 -5.6 9 63 A Y H X S+ 0 0 57 -4,-2.2 4,-1.8 1,-0.2 -1,-0.2 0.840 112.4 53.2 -66.5 -34.5 60.2 18.1 -4.1 10 64 A N H X S+ 0 0 102 -4,-2.1 4,-1.3 2,-0.2 -2,-0.2 0.932 109.3 45.4 -67.5 -47.8 59.3 19.4 -7.5 11 65 A A H X S+ 0 0 19 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.867 110.5 57.3 -64.3 -34.7 56.8 16.8 -8.4 12 66 A A H X S+ 0 0 0 -4,-1.7 4,-1.3 1,-0.2 -1,-0.2 0.927 107.4 45.0 -62.8 -47.6 55.2 17.1 -5.0 13 67 A L H X S+ 0 0 83 -4,-1.8 4,-1.7 2,-0.2 -1,-0.2 0.741 112.0 52.9 -71.1 -21.6 54.5 20.8 -5.3 14 68 A N H X S+ 0 0 97 -4,-1.3 4,-1.0 2,-0.2 -2,-0.2 0.959 110.7 47.3 -71.6 -52.2 53.1 20.4 -8.8 15 69 A Y H < S+ 0 0 57 -4,-2.4 4,-0.5 1,-0.2 -2,-0.2 0.713 119.0 41.0 -58.7 -27.8 50.7 17.7 -7.5 16 70 A L H < S+ 0 0 27 -4,-1.3 -1,-0.2 -5,-0.2 -2,-0.2 0.746 97.0 72.0 -96.2 -29.1 49.7 19.9 -4.6 17 71 A S H < S+ 0 0 101 -4,-1.7 -2,-0.2 -5,-0.1 -3,-0.1 0.870 108.4 38.4 -55.9 -36.7 49.4 23.3 -6.2 18 72 A Y S < S+ 0 0 83 -4,-1.0 -2,-0.1 1,-0.1 -3,-0.1 0.914 125.8 6.5 -75.7 -90.6 46.2 22.1 -8.0 19 73 A Q S S- 0 0 123 -4,-0.5 2,-0.3 1,-0.1 -1,-0.1 -0.286 78.6 -99.8 -91.6 174.6 44.3 19.9 -5.6 20 74 A L - 0 0 86 -2,-0.1 2,-0.3 -3,-0.1 -1,-0.1 -0.694 42.5-162.2 -90.1 145.7 44.6 19.0 -1.9 21 75 A R - 0 0 38 31,-0.3 33,-0.5 -2,-0.3 37,-0.1 -0.990 17.0-122.2-136.7 144.9 46.2 15.5 -1.3 22 76 A T > - 0 0 0 -2,-0.3 4,-1.4 62,-0.2 5,-0.2 -0.331 37.2-106.9 -74.4 164.7 46.4 13.1 1.6 23 77 A R H >> S+ 0 0 86 1,-0.2 4,-3.7 2,-0.2 3,-0.5 0.944 121.8 50.1 -57.2 -48.7 49.8 12.1 2.9 24 78 A K H 3> S+ 0 0 109 61,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.834 103.1 59.6 -61.0 -35.3 49.5 8.7 1.2 25 79 A E H 34 S+ 0 0 22 59,-0.4 -1,-0.2 2,-0.2 -2,-0.2 0.881 117.4 32.5 -60.7 -38.3 48.5 10.1 -2.1 26 80 A V H XX S+ 0 0 0 -4,-1.4 3,-1.9 -3,-0.5 4,-1.3 0.875 112.0 64.6 -82.3 -41.7 51.8 12.0 -2.2 27 81 A E H 3< S+ 0 0 43 -4,-3.7 -2,-0.2 1,-0.3 -3,-0.2 0.799 114.3 32.5 -51.6 -35.4 53.6 9.2 -0.3 28 82 A D T 3< S+ 0 0 64 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.1 -0.321 107.1 67.8-121.5 51.2 52.9 6.9 -3.3 29 83 A K T <4 S+ 0 0 69 -3,-1.9 -2,-0.2 2,-0.1 -3,-0.1 0.283 94.2 59.8-131.4 -20.4 53.1 9.5 -6.1 30 84 A L S ><>S+ 0 0 0 -4,-1.3 5,-0.7 1,-0.2 3,-0.6 0.651 99.9 58.5 -81.3 -18.8 56.8 9.9 -5.4 31 85 A R G > 5S+ 0 0 118 1,-0.2 3,-1.3 -5,-0.2 -1,-0.2 0.674 90.2 68.6 -82.0 -20.2 56.9 6.2 -6.2 32 86 A S G 3 5S+ 0 0 85 1,-0.3 -1,-0.2 2,-0.1 -2,-0.2 0.488 106.0 43.5 -74.7 -2.9 55.4 6.9 -9.7 33 87 A L G < 5S- 0 0 71 -3,-0.6 -1,-0.3 2,-0.1 -2,-0.2 0.160 120.2-110.3-125.2 11.9 58.8 8.6 -10.2 34 88 A D T < 5 + 0 0 123 -3,-1.3 2,-0.5 1,-0.2 -3,-0.2 0.979 57.7 159.9 54.2 67.9 60.9 5.8 -8.6 35 89 A I < - 0 0 7 -5,-0.7 -1,-0.2 -28,-0.0 -2,-0.1 -0.986 39.6-115.1-121.1 126.3 62.1 7.7 -5.5 36 90 A H >> - 0 0 98 -2,-0.5 4,-2.6 1,-0.1 3,-1.1 -0.170 18.1-116.9 -62.6 151.4 63.4 5.6 -2.6 37 91 A E H 3> S+ 0 0 97 1,-0.3 4,-1.6 2,-0.2 5,-0.2 0.741 114.3 67.4 -57.0 -25.7 61.6 5.4 0.8 38 92 A D H 3> S+ 0 0 121 1,-0.2 4,-0.5 2,-0.2 -1,-0.3 0.917 113.3 29.1 -61.0 -43.2 64.8 6.9 2.2 39 93 A Y H <> S+ 0 0 76 -3,-1.1 4,-2.5 2,-0.2 -2,-0.2 0.807 112.3 62.4 -88.5 -35.5 64.0 10.1 0.3 40 94 A I H X S+ 0 0 3 -4,-2.6 4,-3.2 1,-0.2 5,-0.2 0.930 104.6 51.0 -56.9 -45.6 60.2 10.0 0.2 41 95 A S H X S+ 0 0 56 -4,-1.6 4,-2.1 2,-0.2 -1,-0.2 0.854 108.9 50.4 -60.6 -38.1 60.1 10.2 4.0 42 96 A E H X S+ 0 0 95 -4,-0.5 4,-1.7 -5,-0.2 -1,-0.2 0.937 114.0 45.2 -66.2 -45.2 62.4 13.2 4.0 43 97 A I H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.924 112.7 50.8 -63.4 -46.4 60.2 15.0 1.5 44 98 A I H X S+ 0 0 0 -4,-3.2 4,-2.4 1,-0.2 -1,-0.2 0.904 109.8 48.5 -60.6 -46.4 57.0 14.0 3.3 45 99 A N H X S+ 0 0 86 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.886 112.0 49.9 -62.4 -40.0 58.1 15.3 6.7 46 100 A K H X S+ 0 0 94 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.936 111.3 48.9 -63.8 -46.3 59.3 18.5 5.2 47 101 A L H <>S+ 0 0 1 -4,-2.6 5,-3.2 1,-0.2 6,-1.1 0.875 111.5 49.6 -61.7 -37.4 56.0 19.0 3.4 48 102 A I H ><5S+ 0 0 62 -4,-2.4 3,-1.4 3,-0.2 -1,-0.2 0.918 109.5 52.1 -66.6 -41.5 54.1 18.2 6.7 49 103 A D H 3<5S+ 0 0 128 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.895 110.1 47.4 -60.2 -41.7 56.3 20.8 8.5 50 104 A L T 3<5S- 0 0 95 -4,-2.3 -1,-0.3 -5,-0.1 -2,-0.2 0.381 115.9-120.6 -80.3 3.7 55.5 23.4 5.8 51 105 A D T < 5S+ 0 0 98 -3,-1.4 -3,-0.2 2,-0.2 -2,-0.1 0.791 79.9 125.7 60.3 29.9 51.8 22.4 6.3 52 106 A L S - 0 0 59 -33,-0.5 4,-2.4 -2,-0.4 3,-0.2 -0.673 22.0-171.8-157.6 94.9 47.9 18.0 6.5 55 109 A D H > S+ 0 0 19 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.815 87.0 57.8 -61.0 -34.0 45.5 15.0 6.8 56 110 A K H > S+ 0 0 125 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.935 112.4 42.3 -62.7 -42.9 43.3 16.6 9.5 57 111 A N H > S+ 0 0 74 -3,-0.2 4,-2.1 2,-0.2 5,-0.3 0.878 113.1 53.2 -70.1 -38.7 42.7 19.5 7.1 58 112 A Y H X S+ 0 0 23 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.983 112.3 44.3 -58.0 -56.8 42.2 17.2 4.1 59 113 A A H X S+ 0 0 0 -4,-2.9 4,-2.4 1,-0.2 -2,-0.2 0.860 112.2 52.4 -56.7 -41.2 39.6 15.1 5.9 60 114 A E H X S+ 0 0 35 -4,-2.0 4,-2.3 -5,-0.3 -1,-0.2 0.913 111.2 44.8 -65.6 -42.0 37.8 18.2 7.3 61 115 A S H X S+ 0 0 38 -4,-2.1 4,-2.9 2,-0.2 -2,-0.2 0.880 111.8 53.4 -70.3 -35.6 37.4 19.9 4.0 62 116 A Y H X S+ 0 0 52 -4,-2.3 4,-2.9 -5,-0.3 5,-0.2 0.963 110.3 47.8 -61.2 -48.8 36.3 16.6 2.3 63 117 A V H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.903 112.6 48.0 -57.9 -44.2 33.6 16.2 5.0 64 118 A R H X S+ 0 0 110 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.930 111.7 51.2 -64.2 -43.4 32.4 19.8 4.6 65 119 A T H X S+ 0 0 73 -4,-2.9 4,-3.2 1,-0.2 5,-0.3 0.960 112.5 44.2 -57.7 -52.3 32.3 19.3 0.8 66 120 A M H X S+ 0 0 25 -4,-2.9 4,-2.0 1,-0.2 6,-0.3 0.863 111.0 54.7 -62.3 -37.1 30.3 16.1 1.0 67 121 A M H < S+ 0 0 26 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.895 119.2 34.9 -61.4 -40.5 27.9 17.6 3.6 68 122 A N H < S+ 0 0 127 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.803 130.3 27.8 -87.1 -30.9 27.3 20.5 1.2 69 123 A T H < S+ 0 0 107 -4,-3.2 2,-0.3 -5,-0.2 -3,-0.2 0.485 112.1 56.4-113.3 -2.6 27.4 18.8 -2.2 70 124 A S < - 0 0 16 -4,-2.0 0, 0.0 -5,-0.3 0, 0.0 -0.797 62.6-137.6-128.8 170.6 26.3 15.2 -1.6 71 125 A D + 0 0 45 -2,-0.3 2,-0.2 2,-0.0 -4,-0.1 0.132 66.8 124.0-107.2 15.9 23.5 13.1 -0.3 72 126 A K - 0 0 65 -6,-0.3 66,-0.2 66,-0.1 -2,-0.1 -0.514 51.0-140.8 -82.8 145.5 26.0 10.7 1.4 73 127 A G >> - 0 0 0 64,-4.1 4,-2.2 -2,-0.2 3,-0.9 -0.447 37.2 -82.7 -96.3 175.2 26.0 9.9 5.2 74 128 A P H 3> S+ 0 0 26 0, 0.0 4,-2.6 0, 0.0 65,-0.2 0.805 122.2 56.1 -44.4 -46.7 28.9 9.5 7.6 75 129 A K H 3> S+ 0 0 121 63,-2.1 4,-1.7 2,-0.2 63,-0.2 0.862 112.1 40.0 -62.5 -38.9 29.6 5.8 6.7 76 130 A V H <> S+ 0 0 25 -3,-0.9 4,-2.1 61,-0.4 5,-0.2 0.889 113.8 54.1 -77.3 -38.4 30.1 6.4 3.0 77 131 A I H X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.925 110.0 50.4 -58.6 -40.3 32.0 9.6 3.6 78 132 A K H X S+ 0 0 53 -4,-2.6 4,-2.6 -5,-0.2 -1,-0.2 0.902 108.7 47.8 -65.9 -45.3 34.3 7.6 5.9 79 133 A L H X S+ 0 0 84 -4,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.819 110.1 54.4 -68.2 -27.5 35.0 4.8 3.5 80 134 A N H < S+ 0 0 39 -4,-2.1 4,-0.4 2,-0.2 -2,-0.2 0.938 109.8 47.3 -68.2 -43.4 35.8 7.4 0.8 81 135 A L H ><>S+ 0 0 1 -4,-2.1 5,-2.1 1,-0.2 3,-1.2 0.904 110.9 51.3 -60.7 -43.6 38.3 8.9 3.3 82 136 A S H ><5S+ 0 0 48 -4,-2.6 3,-1.3 1,-0.3 -1,-0.2 0.859 104.4 57.4 -62.3 -36.2 39.7 5.5 3.9 83 137 A K T 3<5S+ 0 0 161 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.590 105.1 52.8 -70.7 -10.0 40.1 4.9 0.2 84 138 A K T < 5S- 0 0 82 -3,-1.2 -59,-0.4 -4,-0.4 -1,-0.3 0.379 126.1 -98.5-103.2 -1.5 42.3 8.0 0.1 85 139 A G T < 5 + 0 0 20 -3,-1.3 2,-0.4 1,-0.3 -61,-0.3 0.653 69.5 152.0 94.3 16.0 44.6 6.9 2.8 86 140 A I < - 0 0 7 -5,-2.1 -1,-0.3 -6,-0.1 -2,-0.1 -0.677 49.1-113.5 -84.6 130.8 43.1 8.8 5.8 87 141 A D > - 0 0 95 -2,-0.4 4,-2.5 1,-0.1 5,-0.2 -0.275 21.3-121.7 -59.1 144.9 43.6 7.1 9.2 88 142 A D H > S+ 0 0 90 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.890 114.7 54.2 -55.4 -40.3 40.4 5.9 10.8 89 143 A N H > S+ 0 0 108 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.892 109.5 45.8 -61.7 -42.6 41.1 8.2 13.7 90 144 A I H > S+ 0 0 34 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.890 112.9 49.9 -69.5 -39.3 41.5 11.3 11.5 91 145 A A H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.939 110.5 50.8 -63.1 -47.3 38.3 10.5 9.6 92 146 A E H X S+ 0 0 105 -4,-2.7 4,-0.6 1,-0.2 -2,-0.2 0.881 109.9 49.1 -59.4 -41.5 36.3 10.0 12.8 93 147 A D H >< S+ 0 0 102 -4,-1.9 3,-1.0 1,-0.2 4,-0.2 0.935 113.0 48.3 -63.3 -45.2 37.5 13.3 14.2 94 148 A A H >< S+ 0 0 2 -4,-2.1 3,-1.9 1,-0.2 -2,-0.2 0.870 102.5 61.3 -63.2 -38.4 36.6 15.0 11.0 95 149 A L H >< S+ 0 0 22 -4,-2.6 3,-1.9 1,-0.3 -1,-0.2 0.668 81.5 83.4 -66.0 -14.2 33.1 13.4 10.8 96 150 A I T << S+ 0 0 124 -3,-1.0 -1,-0.3 -4,-0.6 -2,-0.2 0.771 80.3 66.9 -59.1 -23.8 32.3 15.1 14.0 97 151 A L T < S+ 0 0 55 -3,-1.9 2,-1.8 -4,-0.2 -1,-0.3 0.759 81.5 78.2 -69.6 -23.6 31.5 18.1 11.8 98 152 A Y S < S- 0 0 7 -3,-1.9 -1,-0.2 -4,-0.2 5,-0.1 -0.569 80.5-164.4 -87.9 76.6 28.5 16.3 10.3 99 153 A T > - 0 0 48 -2,-1.8 4,-2.2 1,-0.1 5,-0.2 -0.071 29.3-109.9 -58.4 159.0 26.3 16.9 13.3 100 154 A D H > S+ 0 0 93 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.920 117.9 51.8 -58.6 -47.1 23.1 14.9 13.9 101 155 A K H > S+ 0 0 131 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.848 110.5 48.9 -62.1 -32.7 20.8 17.8 13.1 102 156 A L H > S+ 0 0 74 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.885 112.4 47.9 -73.2 -37.3 22.6 18.5 9.8 103 157 A Q H X S+ 0 0 13 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.924 111.8 50.0 -66.1 -46.1 22.4 14.8 8.8 104 158 A V H X S+ 0 0 16 -4,-2.9 4,-2.5 1,-0.2 -2,-0.2 0.901 108.9 52.5 -59.5 -42.3 18.7 14.6 9.7 105 159 A E H X S+ 0 0 137 -4,-1.8 4,-1.2 -5,-0.2 -1,-0.2 0.860 112.9 43.2 -65.2 -36.0 18.0 17.8 7.7 106 160 A K H X S+ 0 0 56 -4,-1.6 4,-1.7 2,-0.2 -1,-0.2 0.873 114.3 52.0 -76.0 -35.0 19.7 16.4 4.6 107 161 A G H X S+ 0 0 0 -4,-2.7 4,-2.8 1,-0.2 -2,-0.2 0.832 106.0 53.2 -67.7 -35.0 18.0 13.0 5.2 108 162 A V H X S+ 0 0 19 -4,-2.5 4,-2.6 2,-0.2 -1,-0.2 0.875 107.2 53.2 -67.1 -38.2 14.6 14.6 5.4 109 163 A T H X S+ 0 0 61 -4,-1.2 4,-1.4 2,-0.2 -2,-0.2 0.906 113.9 41.1 -62.8 -44.1 15.2 16.3 2.0 110 164 A L H X S+ 0 0 18 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.929 114.4 52.6 -70.5 -44.8 16.1 13.0 0.4 111 165 A A H X S+ 0 0 0 -4,-2.8 4,-2.0 1,-0.2 -2,-0.2 0.867 105.7 54.7 -58.7 -39.2 13.2 11.2 2.2 112 166 A E H X S+ 0 0 88 -4,-2.6 4,-1.6 2,-0.2 -1,-0.2 0.920 108.6 47.9 -62.4 -42.6 10.7 13.8 1.0 113 167 A K H X S+ 0 0 132 -4,-1.4 4,-1.8 1,-0.2 -2,-0.2 0.923 113.3 47.5 -63.2 -45.3 11.7 13.3 -2.6 114 168 A L H X S+ 0 0 12 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.807 105.3 59.5 -66.4 -31.0 11.5 9.5 -2.3 115 169 A A H < S+ 0 0 15 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.920 108.6 44.9 -63.7 -42.4 8.1 9.7 -0.5 116 170 A N H >< S+ 0 0 123 -4,-1.6 3,-1.2 1,-0.2 -2,-0.2 0.868 111.3 54.1 -67.6 -37.5 6.7 11.5 -3.6 117 171 A R H 3< S+ 0 0 174 -4,-1.8 3,-0.3 1,-0.3 -2,-0.2 0.886 117.5 35.0 -65.1 -39.0 8.4 8.9 -5.8 118 172 A Y T >< S+ 0 0 58 -4,-2.4 3,-2.5 1,-0.2 -1,-0.3 0.063 78.7 131.1-103.1 25.6 6.8 6.0 -4.0 119 173 A S T < + 0 0 65 -3,-1.2 -1,-0.2 1,-0.3 -2,-0.1 0.696 69.6 56.8 -50.7 -24.8 3.5 7.9 -3.3 120 174 A H T 3 S+ 0 0 185 -3,-0.3 -1,-0.3 -4,-0.1 -2,-0.1 0.650 90.5 90.9 -84.0 -15.9 1.5 4.9 -4.6 121 175 A D S < S- 0 0 53 -3,-2.5 2,-0.1 1,-0.1 -3,-0.0 -0.270 89.2 -95.0 -74.5 166.3 3.0 2.5 -2.1 122 176 A S > - 0 0 56 1,-0.1 4,-2.5 4,-0.0 5,-0.2 -0.377 41.1-103.8 -73.9 161.1 1.5 1.7 1.3 123 177 A Y H > S+ 0 0 127 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.904 122.7 49.5 -52.0 -43.6 3.0 3.8 4.1 124 178 A R H > S+ 0 0 159 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.951 112.5 43.0 -62.0 -55.2 4.9 0.7 5.2 125 179 A N H > S+ 0 0 53 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.834 113.6 56.1 -62.3 -31.7 6.4 -0.2 1.8 126 180 A K H X S+ 0 0 51 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.960 108.9 43.3 -65.1 -53.2 7.2 3.5 1.3 127 181 A Q H X S+ 0 0 27 -4,-2.5 4,-3.1 1,-0.2 5,-0.2 0.837 109.8 57.9 -62.9 -34.7 9.2 3.8 4.6 128 182 A N H X S+ 0 0 77 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.938 108.1 46.1 -60.9 -47.4 11.0 0.6 3.9 129 183 A K H X S+ 0 0 71 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.900 114.5 48.3 -62.6 -41.2 12.3 1.9 0.6 130 184 A I H X S+ 0 0 0 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.939 111.8 47.8 -66.2 -46.1 13.3 5.2 2.1 131 185 A K H X S+ 0 0 56 -4,-3.1 4,-2.1 1,-0.2 -1,-0.2 0.905 112.7 51.2 -58.5 -42.3 15.1 3.6 5.1 132 186 A Q H X S+ 0 0 130 -4,-2.3 4,-2.3 -5,-0.2 -1,-0.2 0.917 109.4 48.7 -61.4 -47.7 16.9 1.3 2.6 133 187 A S H X S+ 0 0 29 -4,-2.3 4,-1.0 1,-0.2 -2,-0.2 0.934 112.7 47.9 -60.4 -46.6 18.0 4.2 0.4 134 188 A L H <>S+ 0 0 0 -4,-2.5 5,-2.1 1,-0.2 4,-0.2 0.843 109.8 53.8 -64.1 -35.1 19.3 6.2 3.4 135 189 A L H ><5S+ 0 0 64 -4,-2.1 3,-1.8 1,-0.2 -2,-0.2 0.938 107.0 49.4 -64.9 -47.3 21.2 3.1 4.7 136 190 A T H 3<5S+ 0 0 106 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.731 107.2 58.4 -65.8 -19.3 23.0 2.5 1.4 137 191 A K T 3<5S- 0 0 42 -4,-1.0 -64,-4.1 -5,-0.2 -61,-0.4 0.476 124.6 -99.6 -87.1 -5.4 24.0 6.2 1.5 138 192 A G T < 5S+ 0 0 3 -3,-1.8 -63,-2.1 1,-0.3 2,-0.2 0.490 73.4 138.0 105.4 -0.2 25.7 5.9 4.9 139 193 A F < - 0 0 0 -5,-2.1 -1,-0.3 -66,-0.2 2,-0.1 -0.576 50.8-118.1 -82.5 144.8 23.2 7.1 7.5 140 194 A S > - 0 0 41 -2,-0.2 4,-2.5 1,-0.1 5,-0.2 -0.379 22.8-109.1 -79.5 159.0 22.9 5.2 10.8 141 195 A Y H > S+ 0 0 161 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.913 118.1 50.2 -49.6 -52.8 19.7 3.5 12.0 142 196 A D H > S+ 0 0 122 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.911 111.0 48.4 -56.8 -44.9 19.1 6.1 14.7 143 197 A I H > S+ 0 0 9 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.896 112.1 50.4 -61.6 -40.2 19.5 9.0 12.4 144 198 A I H X S+ 0 0 2 -4,-2.5 4,-2.8 2,-0.2 -2,-0.2 0.889 107.4 52.9 -65.9 -40.4 17.1 7.3 9.9 145 199 A D H X S+ 0 0 79 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.890 110.5 48.0 -62.7 -38.9 14.5 6.8 12.7 146 200 A T H X S+ 0 0 57 -4,-1.9 4,-2.0 -5,-0.2 -1,-0.2 0.878 110.9 51.1 -69.2 -36.6 14.7 10.5 13.5 147 201 A I H X S+ 0 0 0 -4,-1.9 4,-2.9 2,-0.2 -2,-0.2 0.927 109.9 50.0 -64.8 -44.3 14.4 11.3 9.8 148 202 A I H X S+ 0 0 10 -4,-2.8 4,-2.0 2,-0.2 -2,-0.2 0.870 109.9 50.0 -61.4 -39.9 11.3 9.1 9.5 149 203 A Q H X S+ 0 0 138 -4,-1.9 4,-1.1 1,-0.2 -1,-0.2 0.901 112.9 48.4 -65.8 -38.4 9.7 10.8 12.6 150 204 A E H X S+ 0 0 81 -4,-2.0 4,-1.0 1,-0.2 3,-0.3 0.912 109.0 52.2 -66.4 -45.4 10.4 14.1 11.0 151 205 A L H < S+ 0 0 21 -4,-2.9 3,-0.5 1,-0.2 -1,-0.2 0.868 105.2 54.7 -60.4 -41.0 9.0 13.1 7.6 152 206 A D H < S+ 0 0 72 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.832 99.4 61.4 -64.1 -31.4 5.7 11.9 9.2 153 207 A L H < 0 0 144 -4,-1.1 -1,-0.3 -3,-0.3 -2,-0.2 0.888 360.0 360.0 -60.6 -35.4 5.3 15.3 10.7 154 208 A I < 0 0 102 -4,-1.0 -2,-0.3 -3,-0.5 -1,-0.2 0.922 360.0 360.0 -76.3 360.0 5.3 16.5 7.1