==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-MAY-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 25-JUL-12 4GA4 . COMPND 2 MOLECULE: PUTATIVE THYMIDINE PHOSPHORYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMOCOCCUS KODAKARENSIS; . AUTHOR Y.NISHITANI,R.AONO,A.NAKAMURA,T.SATO,H.ATOMI,T.IMANAKA,K.MIK . 836 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 34080.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 598 71.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 50 6.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 59 7.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 2 0.2 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 . 37 4.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 55 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 342 40.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 27 3.2 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 1 1 2 2 5 2 7 7 1 0 2 2 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 0 0 4 0 0 2 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 4 1 5 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 ANTIPARALLEL BRIDGES PER LADDER . 2 2 2 2 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 85 A P > 0 0 85 0, 0.0 3,-1.7 0, 0.0 4,-0.2 0.000 360.0 360.0 360.0 139.5 -102.8 -14.6 -1.2 2 86 A E T >> + 0 0 74 1,-0.3 3,-1.4 2,-0.2 4,-1.0 0.614 360.0 87.1 -70.4 -9.4 -102.0 -18.0 -2.4 3 87 A S H 3> S+ 0 0 3 1,-0.3 4,-1.3 2,-0.2 3,-0.3 0.831 79.1 64.0 -59.9 -27.6 -98.6 -17.1 -1.5 4 88 A V H <> S+ 0 0 44 -3,-1.7 4,-2.3 1,-0.2 -1,-0.3 0.868 89.4 63.8 -62.9 -36.7 -99.6 -18.3 1.9 5 89 A R H <> S+ 0 0 55 -3,-1.4 4,-1.6 1,-0.3 -1,-0.2 0.915 102.0 50.7 -59.2 -40.1 -100.1 -21.8 0.6 6 90 A Y H X S+ 0 0 76 -4,-1.0 4,-1.5 -3,-0.3 -1,-0.3 0.899 106.8 54.7 -62.9 -37.6 -96.4 -21.9 -0.1 7 91 A I H X S+ 0 0 6 -4,-1.3 4,-1.6 1,-0.2 3,-0.2 0.905 105.4 52.8 -61.7 -41.3 -95.7 -20.8 3.4 8 92 A K H X S+ 0 0 105 -4,-2.3 4,-1.6 1,-0.2 -1,-0.2 0.859 100.6 61.9 -62.4 -33.7 -97.7 -23.6 4.7 9 93 A K H <>S+ 0 0 16 -4,-1.6 5,-2.1 1,-0.3 3,-0.4 0.923 104.0 48.1 -61.3 -41.2 -95.6 -26.0 2.7 10 94 A K H ><5S+ 0 0 6 -4,-1.5 3,-3.0 1,-0.2 -1,-0.3 0.893 102.7 62.8 -63.8 -35.2 -92.6 -24.9 4.7 11 95 A M H 3<5S+ 0 0 93 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.2 0.880 104.0 48.2 -59.1 -35.2 -94.6 -25.4 7.8 12 96 A H T 3<5S- 0 0 134 -4,-1.6 -1,-0.3 -3,-0.4 -2,-0.2 0.369 125.9-108.4 -87.5 8.7 -94.8 -29.0 6.8 13 97 A G T < 5 + 0 0 40 -3,-3.0 -3,-0.2 1,-0.2 -2,-0.1 0.492 66.1 149.3 84.2 5.5 -91.1 -28.9 6.2 14 98 A E < - 0 0 117 -5,-2.1 -1,-0.2 -6,-0.2 2,-0.1 -0.342 49.3-108.0 -72.7 152.5 -91.0 -29.1 2.4 15 99 A K - 0 0 125 -2,-0.1 2,-0.5 35,-0.1 -1,-0.1 -0.375 33.9-125.5 -73.6 156.4 -88.3 -27.4 0.2 16 100 A L - 0 0 12 -2,-0.1 2,-0.1 -6,-0.0 -1,-0.1 -0.920 10.4-135.8-115.2 130.3 -89.3 -24.4 -1.8 17 101 A R > - 0 0 48 -2,-0.5 4,-2.7 1,-0.1 3,-0.3 -0.372 31.6-109.8 -73.3 160.1 -88.9 -23.9 -5.5 18 102 A K H > S+ 0 0 56 1,-0.3 4,-2.5 2,-0.2 5,-0.3 0.878 122.9 58.0 -59.6 -34.3 -87.6 -20.6 -6.7 19 103 A V H > S+ 0 0 109 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.914 108.6 44.2 -61.8 -45.0 -91.0 -20.0 -8.0 20 104 A E H > S+ 0 0 51 -3,-0.3 4,-1.7 2,-0.2 -2,-0.2 0.914 112.7 50.3 -66.0 -44.4 -92.4 -20.4 -4.5 21 105 A I H X S+ 0 0 8 -4,-2.7 4,-2.5 1,-0.2 5,-0.3 0.926 110.2 49.9 -62.4 -43.3 -89.8 -18.4 -2.8 22 106 A E H X S+ 0 0 49 -4,-2.5 4,-4.0 1,-0.2 5,-0.3 0.901 105.5 56.7 -62.4 -40.7 -90.2 -15.4 -5.1 23 107 A A H X S+ 0 0 18 -4,-1.6 4,-2.6 -5,-0.3 -1,-0.2 0.921 110.8 44.6 -60.9 -42.4 -93.9 -15.4 -4.8 24 108 A I H X S+ 0 0 2 -4,-1.7 4,-2.7 2,-0.2 -1,-0.2 0.933 117.5 42.2 -64.9 -49.7 -93.6 -15.0 -1.1 25 109 A V H X S+ 0 0 7 -4,-2.5 4,-2.8 2,-0.2 -2,-0.2 0.893 113.7 54.6 -63.3 -38.1 -90.9 -12.4 -1.2 26 110 A R H X S+ 0 0 142 -4,-4.0 4,-1.5 -5,-0.3 -2,-0.2 0.944 112.6 41.8 -61.9 -48.4 -92.8 -10.7 -4.0 27 111 A D H <>S+ 0 0 40 -4,-2.6 5,-2.3 -5,-0.3 6,-1.0 0.864 111.8 55.9 -64.8 -35.6 -95.9 -10.6 -1.9 28 112 A I H ><5S+ 0 0 8 -4,-2.7 3,-1.3 1,-0.2 5,-0.2 0.945 108.5 48.7 -61.5 -44.9 -93.8 -9.5 1.1 29 113 A V H 3<5S+ 0 0 35 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.829 108.4 52.8 -63.1 -35.2 -92.4 -6.6 -0.8 30 114 A D T 3<5S- 0 0 127 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.311 111.7-114.9 -89.0 8.1 -95.8 -5.5 -2.1 31 115 A R T < 5S+ 0 0 84 -3,-1.3 -3,-0.2 -4,-0.3 -2,-0.1 0.850 83.7 124.4 61.7 30.4 -97.3 -5.3 1.4 32 116 A K < + 0 0 46 -5,-2.3 2,-0.6 1,-0.2 -4,-0.2 0.505 65.1 62.3 -91.9 -11.8 -99.6 -8.1 0.3 33 117 A L S S- 0 0 8 -6,-1.0 -1,-0.2 -5,-0.2 -2,-0.1 -0.960 79.1-158.6-117.1 114.5 -98.4 -10.1 3.3 34 118 A R > - 0 0 192 -2,-0.6 4,-1.7 -3,-0.1 3,-0.3 -0.094 39.2 -83.3 -80.9-177.2 -99.1 -8.4 6.6 35 119 A D H > S+ 0 0 124 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.814 122.4 64.2 -61.4 -33.7 -97.3 -9.1 9.8 36 120 A I H > S+ 0 0 135 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.954 108.2 40.6 -60.1 -49.0 -99.3 -12.1 10.7 37 121 A E H > S+ 0 0 46 -3,-0.3 4,-2.4 2,-0.2 5,-0.3 0.902 111.3 52.6 -64.9 -45.2 -97.9 -14.0 7.7 38 122 A I H X S+ 0 0 4 -4,-1.7 4,-2.9 1,-0.2 5,-0.2 0.918 108.4 55.0 -60.9 -36.2 -94.3 -12.9 7.8 39 123 A S H X S+ 0 0 38 -4,-2.1 4,-2.7 1,-0.2 -1,-0.2 0.900 108.4 46.4 -62.2 -43.3 -94.2 -14.0 11.4 40 124 A S H X S+ 0 0 41 -4,-1.4 4,-2.2 2,-0.2 -1,-0.2 0.895 113.6 48.0 -67.1 -42.2 -95.4 -17.5 10.6 41 125 A F H X S+ 0 0 21 -4,-2.4 4,-1.8 2,-0.2 -2,-0.2 0.922 113.7 48.7 -63.3 -43.5 -93.0 -17.9 7.7 42 126 A V H X S+ 0 0 3 -4,-2.9 4,-1.5 -5,-0.3 -2,-0.2 0.919 110.4 49.9 -63.1 -43.8 -90.2 -16.6 9.9 43 127 A T H X S+ 0 0 51 -4,-2.7 4,-2.1 1,-0.2 -1,-0.2 0.890 107.3 56.2 -62.8 -37.4 -91.2 -18.9 12.7 44 128 A A H X>S+ 0 0 6 -4,-2.2 4,-4.4 1,-0.2 5,-0.8 0.888 101.7 56.5 -62.3 -39.8 -91.2 -21.8 10.3 45 129 A L H X5S+ 0 0 6 -4,-1.8 4,-1.2 1,-0.2 -1,-0.2 0.907 107.7 46.5 -62.0 -43.7 -87.7 -21.1 9.2 46 130 A E H <5S+ 0 0 105 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.936 121.3 39.3 -63.6 -46.3 -86.3 -21.4 12.7 47 131 A I H <5S+ 0 0 124 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.936 134.8 17.9 -66.3 -52.8 -88.3 -24.6 13.2 48 132 A N H <5S- 0 0 69 -4,-4.4 -3,-0.2 -5,-0.2 -2,-0.2 0.805 95.3-154.9 -91.3 -36.2 -87.9 -26.2 9.8 49 133 A G << - 0 0 26 -4,-1.2 2,-0.4 -5,-0.8 -3,-0.1 -0.011 14.4 -93.4 85.9 172.3 -84.9 -24.4 8.3 50 134 A L - 0 0 39 -5,-0.1 2,-0.1 -35,-0.1 -1,-0.1 -0.997 25.5-139.5-127.9 130.7 -83.7 -23.7 4.8 51 135 A D >> - 0 0 60 -2,-0.4 4,-1.5 1,-0.1 3,-0.6 -0.364 42.5 -93.2 -79.3 170.2 -81.3 -25.9 2.8 52 136 A M H 3> S+ 0 0 48 1,-0.3 4,-2.1 2,-0.2 5,-0.3 0.891 121.2 60.5 -60.0 -41.6 -78.8 -24.0 0.8 53 137 A D H 3> S+ 0 0 78 1,-0.3 4,-2.0 2,-0.2 -1,-0.3 0.926 105.8 49.8 -54.6 -41.7 -80.7 -23.9 -2.4 54 138 A E H <> S+ 0 0 7 -3,-0.6 4,-2.7 1,-0.2 -1,-0.3 0.908 107.7 53.7 -62.1 -41.4 -83.5 -22.1 -0.7 55 139 A I H X S+ 0 0 6 -4,-1.5 4,-3.1 -3,-0.3 -1,-0.2 0.923 108.5 47.8 -61.2 -46.4 -81.2 -19.5 0.8 56 140 A A H X S+ 0 0 8 -4,-2.1 4,-2.2 1,-0.2 5,-0.2 0.897 112.9 49.3 -63.1 -39.2 -79.6 -18.5 -2.5 57 141 A A H X S+ 0 0 21 -4,-2.0 4,-3.1 -5,-0.3 -1,-0.2 0.909 113.0 49.2 -63.4 -41.2 -83.0 -18.2 -4.1 58 142 A L H X S+ 0 0 6 -4,-2.7 4,-3.1 2,-0.2 5,-0.3 0.904 108.7 50.3 -64.7 -43.5 -84.0 -16.1 -1.1 59 143 A T H X S+ 0 0 0 -4,-3.1 4,-2.6 1,-0.2 -1,-0.2 0.956 117.4 40.8 -61.6 -48.1 -81.0 -13.9 -1.3 60 144 A I H X S+ 0 0 47 -4,-2.2 4,-3.3 2,-0.2 5,-0.3 0.906 115.6 49.9 -63.8 -45.2 -81.6 -13.3 -4.9 61 145 A A H X S+ 0 0 0 -4,-3.1 4,-0.8 -5,-0.2 -2,-0.2 0.919 114.1 45.8 -62.6 -42.9 -85.3 -13.0 -4.6 62 146 A M H < S+ 0 0 7 -4,-3.1 96,-0.4 -5,-0.2 3,-0.2 0.915 118.6 42.0 -64.0 -47.3 -85.0 -10.6 -1.8 63 147 A A H >< S+ 0 0 0 -4,-2.6 3,-2.2 -5,-0.3 93,-0.4 0.891 107.2 57.0 -66.4 -45.6 -82.4 -8.5 -3.6 64 148 A E H 3< S+ 0 0 93 -4,-3.3 -1,-0.2 1,-0.3 -2,-0.2 0.732 99.5 63.9 -63.7 -19.8 -83.8 -8.5 -7.1 65 149 A T T 3< S+ 0 0 49 -4,-0.8 2,-0.3 -5,-0.3 -1,-0.3 0.360 98.9 66.3 -85.1 4.3 -86.9 -7.0 -5.6 66 150 A G S < S- 0 0 9 -3,-2.2 89,-0.2 1,-0.1 -37,-0.0 -0.886 100.0 -79.4-127.7 159.4 -85.1 -3.9 -4.6 67 151 A D - 0 0 95 87,-0.9 2,-0.3 -2,-0.3 89,-0.2 -0.200 50.6-164.2 -56.9 144.5 -83.4 -1.1 -6.3 68 152 A M - 0 0 89 -4,-0.1 2,-0.3 87,-0.1 120,-0.2 -0.927 6.6-149.2-129.5 156.5 -79.9 -2.1 -7.5 69 153 A L - 0 0 31 118,-1.7 2,-0.4 -2,-0.3 65,-0.0 -0.932 1.7-154.6-128.9 151.6 -77.0 -0.1 -8.7 70 154 A D - 0 0 143 -2,-0.3 2,-0.5 120,-0.0 119,-0.1 -0.996 13.9-149.8-123.9 126.3 -74.2 -0.8 -11.2 71 155 A I - 0 0 23 -2,-0.4 5,-0.1 117,-0.3 33,-0.0 -0.842 9.5-146.8-103.0 133.4 -70.9 1.0 -10.8 72 156 A D S S+ 0 0 85 -2,-0.5 -1,-0.1 65,-0.1 2,-0.0 0.879 83.6 75.8 -62.3 -39.8 -68.8 1.8 -13.8 73 157 A R S S- 0 0 38 -3,-0.1 -2,-0.1 2,-0.0 3,-0.1 -0.391 86.8-107.6 -69.7 152.6 -65.6 1.3 -11.8 74 158 A K S S+ 0 0 73 1,-0.2 2,-0.1 2,-0.1 -2,-0.0 -0.983 72.1 19.4-157.6 163.3 -64.8 -2.2 -11.2 75 159 A P S S- 0 0 31 0, 0.0 29,-0.7 0, 0.0 -1,-0.2 0.609 74.5-134.8 -84.0 153.2 -64.4 -4.6 -9.7 76 160 A I B -a 104 0A 7 113,-0.2 116,-2.1 -3,-0.1 2,-0.4 -0.390 20.8-162.5 -68.1 144.3 -66.7 -3.6 -6.8 77 161 A M E -b 192 0B 2 27,-2.2 2,-0.3 114,-0.2 116,-0.2 -0.984 8.5-177.0-130.1 140.8 -65.3 -4.3 -3.4 78 162 A D E -b 193 0B 1 114,-1.7 116,-1.7 -2,-0.4 2,-0.4 -0.979 15.3-159.0-141.1 154.7 -67.2 -4.5 -0.1 79 163 A V E +b 194 0B 18 -2,-0.3 2,-0.3 114,-0.2 29,-0.2 -0.996 16.0 171.1-131.8 134.3 -66.6 -5.0 3.7 80 164 A H E -b 195 0B 57 114,-1.3 116,-2.2 -2,-0.4 2,-0.4 -0.967 19.2-145.0-140.2 151.2 -69.3 -6.1 6.2 81 165 A S E -b 196 0B 17 -2,-0.3 116,-0.2 114,-0.2 3,-0.1 -0.977 14.0-148.8-124.4 130.3 -69.0 -7.1 9.8 82 166 A I - 0 0 51 114,-3.3 115,-0.2 -2,-0.4 -1,-0.2 0.931 52.0-169.1 -59.2 -38.3 -71.1 -9.8 11.5 83 167 A G + 0 0 14 113,-0.6 121,-0.7 -3,-0.1 122,-0.3 -0.266 48.4 137.5 85.4-171.7 -70.6 -7.5 14.4 84 168 A G + 0 0 47 1,-0.3 -1,-0.1 119,-0.2 113,-0.0 0.229 50.8 108.0 108.6 -8.3 -71.3 -7.8 18.1 85 169 A V > - 0 0 18 118,-0.1 3,-0.7 3,-0.0 -1,-0.3 -0.897 67.7-129.9-105.4 123.1 -68.1 -6.2 19.4 86 170 A P T 3 S+ 0 0 11 0, 0.0 154,-0.9 0, 0.0 3,-0.1 -0.350 87.3 31.5 -68.9 147.1 -68.5 -2.8 20.9 87 171 A G T 3 S+ 0 0 4 152,-0.2 2,-1.7 1,-0.2 156,-0.2 0.721 72.1 156.0 79.0 21.2 -66.3 0.0 19.8 88 172 A N < + 0 0 23 -3,-0.7 3,-0.3 1,-0.2 -1,-0.2 -0.579 9.4 142.5 -84.8 79.7 -66.0 -1.3 16.3 89 173 A K >> + 0 0 1 -2,-1.7 3,-0.9 1,-0.2 4,-0.6 0.311 42.1 102.2 -95.2 7.6 -65.2 1.9 14.4 90 174 A T H >> + 0 0 0 1,-0.3 3,-1.8 2,-0.2 4,-1.7 0.872 59.1 71.1 -61.4 -42.8 -62.8 0.0 12.2 91 175 A N H 3> S+ 0 0 17 1,-0.3 4,-1.9 -3,-0.3 -1,-0.3 0.868 94.3 62.1 -48.3 -33.1 -64.8 -0.3 9.1 92 176 A I H <4 S+ 0 0 0 -3,-0.9 -1,-0.3 1,-0.2 -2,-0.2 0.885 103.2 46.2 -60.9 -43.1 -64.2 3.4 8.7 93 177 A L H S+ 0 0 0 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.928 117.0 48.7 -65.2 -42.4 -60.3 4.7 3.1 97 181 A I H X S+ 0 0 8 -4,-2.6 4,-0.8 1,-0.2 -2,-0.2 0.928 117.4 41.7 -63.7 -43.3 -57.4 2.3 3.3 98 182 A V H <>S+ 0 0 3 -4,-4.5 5,-0.8 1,-0.2 3,-0.3 0.904 113.8 53.2 -66.9 -42.4 -59.0 0.1 0.7 99 183 A A H ><5S+ 0 0 12 -4,-3.4 3,-2.6 -5,-0.3 -2,-0.2 0.834 96.3 63.6 -64.2 -38.2 -60.1 3.0 -1.5 100 184 A A H 3<5S+ 0 0 43 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.899 90.5 66.0 -59.8 -39.3 -56.7 4.7 -1.8 101 185 A A T 3<5S- 0 0 51 -4,-0.8 -1,-0.3 -3,-0.3 -2,-0.2 0.767 122.5-116.3 -52.7 -14.0 -55.4 1.8 -3.6 102 186 A G T < 5S+ 0 0 57 -3,-2.6 -2,-0.2 1,-0.4 -3,-0.2 0.399 72.0 138.2 90.3 -0.3 -58.0 3.1 -6.0 103 187 A L < - 0 0 26 -5,-0.8 2,-0.5 1,-0.1 -1,-0.4 -0.417 59.0-109.4 -69.5 157.4 -60.1 -0.1 -5.7 104 188 A T B +a 76 0A 6 -29,-0.7 -27,-2.2 -3,-0.1 41,-0.2 -0.809 42.0 166.6 -98.1 121.2 -63.8 0.7 -5.5 105 189 A I E -f 145 0C 1 39,-1.3 41,-1.4 -2,-0.5 2,-1.0 -0.886 15.0-170.2-135.0 104.3 -65.6 0.1 -2.2 106 190 A P E -f 146 0C 7 0, 0.0 2,-0.6 0, 0.0 41,-0.1 -0.819 18.2-162.5 -93.0 105.5 -69.1 1.5 -1.7 107 191 A K E -f 147 0C 6 39,-2.5 41,-1.3 -2,-1.0 2,-0.4 -0.807 11.9-179.8 -98.3 124.4 -69.7 0.9 2.0 108 192 A T E +f 148 0C 21 -2,-0.6 2,-0.3 39,-0.2 41,-0.2 -0.963 6.6 173.4-120.7 135.6 -73.2 1.0 3.3 109 193 A S E -f 149 0C 26 39,-2.1 41,-4.7 -2,-0.4 42,-0.5 -0.858 21.6-127.4-133.8 166.2 -74.0 0.5 6.9 110 194 A S - 0 0 62 -2,-0.3 9,-0.5 39,-0.2 10,-0.3 -0.946 29.1-102.4-126.0 145.5 -77.1 0.7 9.1 111 195 A R - 0 0 51 -2,-0.4 2,-0.3 7,-0.2 6,-0.0 -0.329 56.7-101.9 -58.2 140.1 -77.8 2.5 12.4 112 196 A A - 0 0 29 1,-0.1 6,-0.2 2,-0.1 -1,-0.1 -0.551 25.5-163.5 -80.5 129.9 -77.6 -0.2 15.1 113 197 A I S S+ 0 0 101 -2,-0.3 -1,-0.1 1,-0.1 -2,-0.1 0.846 96.9 11.5 -68.8 -40.5 -80.6 -1.7 16.7 114 198 A T S S+ 0 0 75 3,-0.0 2,-0.1 0, 0.0 -1,-0.1 0.538 108.0 90.9-117.9 -11.9 -78.6 -3.1 19.6 115 199 A S S S- 0 0 42 1,-0.1 3,-0.2 239,-0.0 -3,-0.0 -0.448 78.8-120.3 -83.4 160.6 -75.1 -1.5 19.4 116 200 A A S S+ 0 0 5 1,-0.3 2,-0.4 -2,-0.1 -1,-0.1 0.937 100.7 13.3 -63.7 -44.6 -74.3 1.7 21.2 117 201 A A S S- 0 0 12 241,-0.2 -1,-0.3 128,-0.1 -29,-0.1 -0.984 73.5-136.9-138.1 127.9 -73.4 3.3 17.9 118 202 A G > - 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0 0 103 -5,-1.8 -1,-0.2 1,-0.1 -2,-0.1 -0.343 49.5-109.9 -68.6 151.9 -62.4 -51.2 55.8 434 99 B K - 0 0 122 1,-0.1 2,-0.5 35,-0.0 -1,-0.1 -0.349 36.0-118.7 -73.2 161.1 -61.4 -48.2 57.8 435 100 B L - 0 0 16 -2,-0.1 -1,-0.1 -6,-0.0 2,-0.0 -0.909 10.4-134.3-115.7 128.7 -58.1 -48.4 59.6 436 101 B R > - 0 0 56 -2,-0.5 4,-2.5 1,-0.1 3,-0.4 -0.368 33.6-110.3 -69.0 155.4 -57.4 -48.1 63.3 437 102 B K H > S+ 0 0 53 1,-0.3 4,-4.6 2,-0.2 5,-0.2 0.865 121.3 54.7 -59.0 -37.4 -54.5 -45.9 64.3 438 103 B V H > S+ 0 0 92 2,-0.2 4,-4.7 1,-0.2 -1,-0.3 0.933 107.5 51.4 -61.7 -41.5 -52.5 -48.8 65.3 439 104 B E H > S+ 0 0 42 -3,-0.4 4,-2.3 2,-0.2 -2,-0.2 0.955 115.2 40.0 -61.7 -48.2 -53.1 -50.2 61.9 440 105 B I H X S+ 0 0 10 -4,-2.5 4,-2.3 1,-0.2 5,-0.2 0.950 118.5 50.1 -62.8 -43.2 -52.0 -47.0 60.2 441 106 B E H X S+ 0 0 52 -4,-4.6 4,-3.0 -5,-0.3 -2,-0.2 0.912 108.8 50.8 -61.4 -44.8 -49.3 -46.8 62.8 442 107 B A H X S+ 0 0 15 -4,-4.7 4,-2.8 2,-0.2 5,-0.2 0.945 109.4 49.7 -62.5 -44.8 -48.1 -50.3 62.2 443 108 B I H X S+ 0 0 3 -4,-2.3 4,-2.5 -5,-0.3 -1,-0.2 0.938 114.5 44.6 -61.2 -45.2 -47.9 -49.9 58.5 444 109 B V H X S+ 0 0 3 -4,-2.3 4,-2.8 1,-0.2 5,-0.3 0.906 110.4 55.8 -63.3 -39.2 -45.9 -46.8 58.8 445 110 B R H X S+ 0 0 114 -4,-3.0 4,-1.8 -5,-0.2 6,-0.2 0.922 110.8 44.2 -61.6 -44.4 -43.8 -48.3 61.5 446 111 B D H X>S+ 0 0 34 -4,-2.8 5,-3.1 2,-0.2 4,-1.0 0.919 112.7 52.1 -64.8 -42.6 -42.9 -51.2 59.2 447 112 B I H ><5S+ 0 0 7 -4,-2.5 3,-0.6 -5,-0.2 -2,-0.2 0.921 111.1 44.5 -62.8 -44.9 -42.2 -48.9 56.3 448 113 B V H 3<5S+ 0 0 30 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.906 113.7 53.2 -64.4 -39.2 -39.9 -46.6 58.1 449 114 B D H 3<5S- 0 0 110 -4,-1.8 -1,-0.3 -5,-0.3 -2,-0.2 0.637 115.1-117.9 -69.6 -16.9 -38.2 -49.7 59.5 450 115 B R T <<5S+ 0 0 69 -4,-1.0 -3,-0.2 -3,-0.6 -2,-0.1 0.652 79.3 128.4 85.0 11.8 -37.8 -51.1 56.0 451 116 B K < + 0 0 43 -5,-3.1 2,-0.6 -6,-0.2 -4,-0.2 0.880 67.4 50.5 -64.6 -40.6 -40.0 -53.9 57.1 452 117 B L S S- 0 0 5 -6,-0.7 -1,-0.2 -9,-0.2 -2,-0.1 -0.900 79.1-164.5-106.7 120.1 -42.2 -53.4 54.1 453 118 B R > - 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