==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 30-AUG-04 1W77 . COMPND 2 MOLECULE: 2C-METHYL-D-ERYTHRITOL 4-PHOSPHATE . SOURCE 2 ORGANISM_SCIENTIFIC: ARABIDOPSIS THALIANA; . AUTHOR M.GABRIELSEN,J.KAISER,F.ROHDICH,W.EISENREICH,A.BACHER, . 212 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11549.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 147 69.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 26 12.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 17 8.0 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 . 1 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 . 17 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 13.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 54 25.5 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+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 1 0 0 0 0 0 2 0 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 1 1 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 PARALLEL BRIDGES PER LADDER . 1 1 1 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 ANTIPARALLEL BRIDGES PER LADDER . 1 0 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 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 75 A M > 0 0 165 0, 0.0 3,-0.6 0, 0.0 2,-0.2 0.000 360.0 360.0 360.0 100.9 -4.0 50.3 -9.4 2 76 A E T 3 + 0 0 147 1,-0.2 39,-0.3 2,-0.1 40,-0.1 -0.459 360.0 2.1 -91.9 146.4 -4.8 53.8 -8.1 3 77 A K T 3 S+ 0 0 66 37,-2.3 -1,-0.2 -2,-0.2 39,-0.2 0.936 91.2 128.5 46.0 49.1 -2.4 56.5 -6.9 4 78 A S < + 0 0 17 37,-1.7 89,-2.3 -3,-0.6 90,-1.4 0.572 45.8 79.1-109.9 -6.2 0.4 54.1 -8.0 5 79 A V E -ab 42 94A 2 36,-2.5 38,-3.2 87,-0.2 39,-1.1 -0.842 57.8-158.6-111.3 130.1 2.4 56.4 -10.2 6 80 A S E -ab 44 95A 0 88,-2.5 90,-3.0 -2,-0.4 2,-0.4 -0.939 17.8-144.8 -97.5 127.7 4.9 59.1 -9.2 7 81 A V E -ab 45 96A 0 37,-2.4 39,-3.2 -2,-0.5 2,-0.6 -0.730 9.7-163.4 -90.6 135.9 5.5 61.7 -11.8 8 82 A I E -ab 46 97A 0 88,-3.1 90,-3.0 -2,-0.4 2,-0.5 -0.973 16.3-166.0-112.0 110.0 8.9 63.2 -12.2 9 83 A L E -ab 47 98A 0 37,-2.9 39,-2.5 -2,-0.6 2,-0.7 -0.872 9.3-143.1-106.4 126.3 8.2 66.3 -14.2 10 84 A L E +ab 48 99A 14 88,-4.0 90,-2.6 -2,-0.5 91,-0.3 -0.754 45.2 134.3 -99.7 115.3 11.3 68.0 -15.7 11 85 A A + 0 0 4 37,-2.7 39,-0.4 -2,-0.7 -1,-0.1 0.132 41.2 117.8-139.8 26.0 11.3 71.8 -15.9 12 86 A G 0 0 28 37,-0.2 7,-0.2 65,-0.1 37,-0.1 0.232 360.0 360.0 -86.7-161.3 14.8 72.7 -14.7 13 87 A G 0 0 106 61,-0.1 36,-0.1 63,-0.1 -1,-0.0 -0.318 360.0 360.0-119.3 360.0 17.8 74.4 -16.2 14 ! 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 15 95 A S 0 0 180 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -76.3 14.7 85.8 -22.5 16 96 A M - 0 0 95 1,-0.1 5,-0.3 2,-0.1 4,-0.2 -0.398 360.0-102.3 -76.3 125.7 12.0 83.6 -20.8 17 97 A P >> - 0 0 52 0, 0.0 3,-2.3 0, 0.0 4,-0.7 -0.187 37.1-120.5 -49.9 121.5 12.8 79.9 -20.1 18 98 A K T 34 S+ 0 0 82 1,-0.3 3,-0.3 2,-0.2 10,-0.3 0.657 108.5 58.4 -47.9 -39.1 11.0 78.0 -22.8 19 99 A Q T 34 S+ 0 0 26 1,-0.2 10,-1.9 -7,-0.2 -1,-0.3 0.232 109.9 48.8 -77.4 17.9 8.8 75.9 -20.5 20 100 A Y T <4 S+ 0 0 3 -3,-2.3 -1,-0.2 8,-0.2 -2,-0.2 0.540 74.9 111.8-127.6 -19.0 7.4 79.1 -19.1 21 101 A I S < S- 0 0 31 -4,-0.7 7,-1.2 -3,-0.3 2,-0.2 -0.303 79.5-113.8 -39.5 124.7 6.7 81.0 -22.3 22 102 A P E -G 27 0B 68 0, 0.0 2,-0.5 0, 0.0 -1,-0.1 -0.496 20.0-145.4 -80.2 148.2 2.9 81.0 -22.0 23 103 A L E > S-G 26 0B 0 3,-3.0 2,-1.9 -2,-0.2 3,-1.2 -0.956 76.4 -39.0-118.7 116.1 0.6 79.1 -24.4 24 104 A L T 3 S- 0 0 138 -2,-0.5 186,-0.0 1,-0.2 0, 0.0 -0.559 136.3 -20.8 56.8 -84.5 -2.6 80.9 -25.0 25 105 A G T 3 S+ 0 0 58 -2,-1.9 -1,-0.2 1,-0.1 0, 0.0 0.766 122.4 54.4-118.6 -30.3 -2.7 81.8 -21.3 26 106 A Q E < S-G 23 0B 51 -3,-1.2 -3,-3.0 1,-0.1 5,-0.1 -0.775 85.9 -85.0-117.7 153.4 -0.6 79.7 -18.9 27 107 A P E >> -G 22 0B 28 0, 0.0 3,-2.0 0, 0.0 4,-0.5 -0.179 42.0-114.5 -57.9 150.6 3.1 78.7 -18.8 28 108 A I H >> S+ 0 0 0 -7,-1.2 3,-0.9 1,-0.3 4,-0.8 0.831 110.9 61.8 -64.4 -35.5 4.0 75.6 -20.7 29 109 A A H 3> S+ 0 0 0 -10,-1.9 4,-0.8 1,-0.2 -1,-0.3 0.407 96.6 67.0 -65.6 -0.2 4.9 73.4 -17.8 30 110 A L H <> S+ 0 0 3 -3,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.831 87.6 59.7-100.2 -34.3 1.4 73.8 -16.7 31 111 A Y H XX S+ 0 0 39 -3,-0.9 4,-1.9 -4,-0.5 3,-0.9 0.990 113.3 37.3 -56.7 -63.4 -0.5 72.0 -19.4 32 112 A S H 3X S+ 0 0 0 -4,-0.8 4,-2.1 68,-0.3 5,-0.3 0.930 113.9 60.1 -55.1 -43.0 1.3 68.6 -18.8 33 113 A F H 3X S+ 0 0 1 -4,-0.8 4,-1.4 1,-0.3 -1,-0.2 0.823 108.0 42.4 -54.8 -37.2 1.3 69.3 -15.0 34 114 A F H < S+ 0 0 0 -4,-2.1 3,-1.3 1,-0.2 6,-0.3 0.887 107.5 62.6 -72.6 -36.5 -1.1 64.3 -14.7 37 117 A S H 3< S+ 0 0 10 -4,-1.4 28,-0.4 -5,-0.3 -1,-0.2 0.811 103.7 50.1 -56.4 -31.9 -2.9 65.9 -11.6 38 118 A R T 3< S+ 0 0 163 -4,-1.5 -1,-0.2 -3,-0.4 -2,-0.2 0.538 86.3 97.1 -81.9 -14.8 -6.3 64.7 -13.0 39 119 A M X - 0 0 4 -3,-1.3 3,-1.9 -4,-0.4 -36,-0.1 -0.723 66.5-147.8 -84.3 125.3 -5.4 61.0 -13.5 40 120 A P T 3 S+ 0 0 60 0, 0.0 -37,-2.3 0, 0.0 -1,-0.2 0.763 96.7 66.7 -63.4 -27.2 -6.4 58.8 -10.6 41 121 A E T 3 S+ 0 0 30 -39,-0.3 -36,-2.5 -38,-0.2 -37,-1.7 0.739 84.1 89.9 -56.2 -24.9 -3.4 56.6 -11.3 42 122 A V E < +a 5 0A 1 -3,-1.9 -36,-0.2 -6,-0.3 3,-0.1 -0.659 47.3 175.0 -93.6 119.6 -1.1 59.5 -10.2 43 123 A K E - 0 0 24 -38,-3.2 24,-2.2 -2,-0.5 2,-0.3 0.833 64.9 -6.8 -87.3 -41.2 -0.2 59.7 -6.5 44 124 A E E -ac 6 67A 4 -39,-1.1 -37,-2.4 22,-0.3 2,-0.4 -0.976 56.8-133.8-155.4 151.3 2.3 62.6 -6.4 45 125 A I E -ac 7 68A 0 22,-2.9 24,-1.3 -2,-0.3 2,-0.7 -0.985 8.9-161.6-113.3 127.2 4.2 64.9 -8.7 46 126 A V E -ac 8 69A 0 -39,-3.2 -37,-2.9 -2,-0.4 2,-0.3 -0.923 17.2-156.8-102.3 105.6 7.9 65.7 -8.2 47 127 A V E -ac 9 70A 0 22,-2.4 24,-1.1 -2,-0.7 2,-0.7 -0.672 4.4-150.6 -87.3 137.8 8.6 68.9 -10.1 48 128 A V E +ac 10 71A 0 -39,-2.5 -37,-2.7 -2,-0.3 2,-0.3 -0.933 42.5 127.8-116.1 108.6 12.2 69.6 -11.2 49 129 A C - 0 0 2 22,-1.0 -37,-0.2 -2,-0.7 22,-0.1 -0.995 66.7 -92.3-157.2 146.4 12.8 73.3 -11.3 50 130 A D > - 0 0 74 -39,-0.4 3,-3.8 -2,-0.3 4,-0.3 -0.552 48.1-123.2 -58.9 115.1 14.9 76.3 -10.4 51 131 A P G >> S+ 0 0 49 0, 0.0 3,-5.3 0, 0.0 4,-0.5 0.871 107.4 77.2 -32.0 -48.1 13.2 77.4 -7.2 52 132 A F G 34 S+ 0 0 154 1,-0.3 3,-0.3 2,-0.1 4,-0.1 0.790 102.7 41.5 -34.9 -32.6 12.7 80.8 -8.7 53 133 A F G X4 S+ 0 0 19 -3,-3.8 3,-0.9 1,-0.2 4,-0.5 0.415 83.8 101.9 -98.6 1.2 9.9 79.0 -10.6 54 134 A R T X> S+ 0 0 99 -3,-5.3 4,-1.7 -4,-0.3 3,-1.4 0.831 76.9 60.3 -49.5 -39.8 8.6 77.0 -7.5 55 135 A D H 3X S+ 0 0 129 -4,-0.5 4,-1.2 -3,-0.3 -1,-0.3 0.844 87.1 70.4 -58.9 -43.9 5.7 79.5 -7.2 56 136 A I H <4 S+ 0 0 35 -3,-0.9 -1,-0.3 1,-0.2 -2,-0.2 0.763 112.7 33.0 -43.5 -22.9 4.4 78.6 -10.6 57 137 A F H X4 S+ 0 0 0 -3,-1.4 3,-1.7 -4,-0.5 -2,-0.2 0.890 107.9 55.9-106.7 -53.1 3.5 75.3 -9.0 58 138 A E H >< S+ 0 0 87 -4,-1.7 3,-1.2 1,-0.3 4,-0.2 0.613 91.5 81.5 -60.3 -12.4 2.5 75.6 -5.3 59 139 A E T 3< S+ 0 0 139 -4,-1.2 -1,-0.3 1,-0.3 -2,-0.1 0.452 101.6 33.9 -74.0 -2.3 -0.2 78.1 -6.4 60 140 A Y T X S+ 0 0 69 -3,-1.7 3,-0.6 2,-0.1 -1,-0.3 0.179 82.7 115.5-131.5 13.2 -2.4 75.2 -7.4 61 141 A E T < S+ 0 0 58 -3,-1.2 3,-0.3 1,-0.2 7,-0.2 0.685 81.1 44.8 -55.0 -22.2 -1.3 72.8 -4.6 62 142 A E T 3 S+ 0 0 173 -4,-0.2 -1,-0.2 1,-0.2 2,-0.2 0.705 104.4 59.3-105.1 -22.4 -4.8 72.9 -3.1 63 143 A S S < S+ 0 0 90 -3,-0.6 2,-0.4 2,-0.0 -1,-0.2 -0.224 95.7 86.6 -91.5 41.0 -6.9 72.5 -6.3 64 144 A I - 0 0 21 -3,-0.3 4,-0.1 -2,-0.2 -26,-0.1 -0.995 67.5-147.9-153.9 126.9 -5.2 69.2 -7.0 65 145 A D S S+ 0 0 147 -28,-0.4 2,-0.3 -2,-0.4 -3,-0.1 0.130 79.1 71.7 -94.1 24.7 -5.9 65.7 -5.9 66 146 A V S S- 0 0 9 -5,-0.1 2,-0.4 -21,-0.0 -22,-0.3 -0.911 88.1 -99.6-127.9 161.2 -2.2 64.6 -5.9 67 147 A D E -c 44 0A 105 -24,-2.2 -22,-2.9 -2,-0.3 2,-0.2 -0.664 33.6-140.8 -80.0 129.9 0.8 65.4 -3.6 68 148 A L E +c 45 0A 15 -2,-0.4 2,-0.3 -24,-0.2 -22,-0.2 -0.541 25.3 175.0 -83.9 148.8 3.2 68.1 -4.9 69 149 A R E -c 46 0A 100 -24,-1.3 -22,-2.4 -2,-0.2 2,-0.3 -0.971 14.1-152.3-154.3 162.1 7.0 67.7 -4.3 70 150 A F E +c 47 0A 30 -2,-0.3 2,-0.3 -24,-0.2 -22,-0.2 -0.958 15.1 166.3-141.3 148.8 10.1 69.4 -5.3 71 151 A A E -c 48 0A 4 -24,-1.1 -22,-1.0 -2,-0.3 13,-0.1 -0.941 37.9-102.2-156.8 157.3 13.7 68.6 -5.8 72 152 A I - 0 0 88 -2,-0.3 -22,-0.1 -24,-0.2 11,-0.1 -0.642 32.9-116.6 -93.9 146.5 16.5 70.5 -7.4 73 153 A P - 0 0 38 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.098 26.2-141.8 -63.1 168.1 17.9 70.0 -10.8 74 154 A G - 0 0 28 2,-0.3 6,-0.2 3,-0.1 -61,-0.1 -0.636 33.1 -82.8-126.8-171.1 21.4 68.9 -11.7 75 155 A K S S+ 0 0 84 -2,-0.2 2,-0.3 4,-0.1 -1,-0.0 0.889 107.6 27.5 -66.3 -43.9 24.0 69.6 -14.3 76 156 A E S >> S- 0 0 120 1,-0.1 3,-2.0 -3,-0.0 4,-1.2 -0.808 91.7 -98.1-121.6 160.0 22.7 67.3 -17.0 77 157 A R H 3> S+ 0 0 111 -2,-0.3 4,-1.4 1,-0.3 3,-0.1 0.782 122.0 51.1 -41.7 -39.8 19.2 66.0 -18.0 78 158 A Q H 3> S+ 0 0 49 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.672 101.7 59.0 -77.5 -20.9 20.0 62.7 -16.1 79 159 A D H <> S+ 0 0 60 -3,-2.0 4,-1.8 2,-0.2 -1,-0.2 0.831 105.0 50.1 -76.0 -38.1 21.1 64.2 -12.8 80 160 A S H X S+ 0 0 11 -4,-1.2 4,-3.8 2,-0.2 5,-0.3 0.969 107.8 53.3 -61.0 -55.0 17.7 66.0 -12.4 81 161 A V H X S+ 0 0 5 -4,-1.4 4,-3.0 1,-0.3 -2,-0.2 0.920 110.9 47.7 -41.7 -51.9 15.9 62.7 -13.1 82 162 A Y H X S+ 0 0 87 -4,-1.6 4,-0.9 2,-0.2 -1,-0.3 0.872 111.3 49.5 -63.4 -39.6 18.0 61.2 -10.3 83 163 A S H >X S+ 0 0 32 -4,-1.8 3,-1.0 -3,-0.3 4,-0.7 0.971 112.3 49.3 -64.2 -47.4 17.2 64.2 -8.0 84 164 A G H >< S+ 0 0 0 -4,-3.8 3,-1.1 1,-0.2 4,-0.5 0.877 105.9 57.0 -45.7 -52.2 13.5 63.7 -8.9 85 165 A L H >< S+ 0 0 10 -4,-3.0 3,-0.6 -5,-0.3 -1,-0.2 0.754 95.7 66.3 -53.8 -30.0 13.9 60.0 -8.1 86 166 A Q H << S+ 0 0 98 -3,-1.0 -1,-0.2 -4,-0.9 -2,-0.2 0.816 103.3 44.6 -70.6 -22.9 15.1 60.8 -4.5 87 167 A E T << S+ 0 0 69 -3,-1.1 -1,-0.2 -4,-0.7 -2,-0.2 0.494 81.5 119.6 -97.0 -6.3 11.8 62.3 -3.5 88 168 A I S < S- 0 0 20 -3,-0.6 7,-0.0 -4,-0.5 -82,-0.0 -0.276 77.7 -79.0 -68.8 149.2 9.1 59.8 -4.8 89 169 A D > - 0 0 67 1,-0.1 3,-2.0 2,-0.1 -1,-0.1 -0.106 43.8-117.3 -47.1 130.8 6.6 57.8 -2.3 90 170 A V T 3 S+ 0 0 134 1,-0.3 -1,-0.1 -3,-0.1 -2,-0.1 0.776 111.9 36.9 -40.1 -27.8 8.4 54.9 -0.7 91 171 A N T 3 S+ 0 0 122 0, 0.0 -1,-0.3 0, 0.0 2,-0.1 0.001 74.7 139.5-127.5 20.5 6.0 52.6 -2.4 92 172 A S < - 0 0 5 -3,-2.0 -87,-0.2 1,-0.1 3,-0.1 -0.483 38.1-155.7 -69.9 141.3 5.2 54.0 -5.9 93 173 A E S S+ 0 0 103 -89,-2.3 2,-0.4 1,-0.2 -88,-0.2 0.696 74.1 32.6 -90.9 -22.2 5.1 51.2 -8.5 94 174 A L E -b 5 0A 9 -90,-1.4 -88,-2.5 62,-0.2 2,-0.5 -0.999 63.7-149.2-135.4 137.5 5.9 53.3 -11.5 95 175 A V E -bD 6 155A 0 60,-3.8 60,-3.0 -2,-0.4 2,-0.7 -0.914 13.3-162.0-103.0 130.2 8.0 56.4 -12.1 96 176 A C E -bD 7 154A 1 -90,-3.0 -88,-3.1 -2,-0.5 2,-0.5 -0.894 5.2-164.5-113.8 101.1 6.7 58.5 -14.9 97 177 A I E +bD 8 153A 1 56,-3.3 56,-2.1 -2,-0.7 2,-0.4 -0.784 13.9 176.5 -93.6 124.0 9.3 60.9 -16.2 98 178 A H E -b 9 0A 0 -90,-3.0 -88,-4.0 -2,-0.5 2,-0.6 -0.970 27.2-131.2-133.1 149.2 8.0 63.8 -18.3 99 179 A D E > -b 10 0A 29 -2,-0.4 3,-2.5 -90,-0.2 -88,-0.1 -0.848 14.8-140.3-103.7 118.1 9.5 66.8 -19.9 100 180 A S T 3 S+ 0 0 0 -90,-2.6 -68,-0.3 -2,-0.6 -69,-0.1 0.682 96.0 70.5 -38.9 -37.2 7.8 70.2 -19.3 101 181 A A T 3 S+ 0 0 7 -91,-0.3 99,-2.3 1,-0.2 -1,-0.3 0.413 84.3 72.6 -77.8 4.2 8.3 71.3 -22.9 102 182 A R X + 0 0 30 -3,-2.5 3,-0.6 97,-0.2 -1,-0.2 -0.794 55.8 155.8-111.2 86.3 5.8 68.8 -24.1 103 183 A P T 3 + 0 0 3 0, 0.0 -1,-0.1 0, 0.0 -68,-0.1 0.697 63.1 66.2 -84.1 -19.0 2.6 70.5 -22.8 104 184 A L T 3 + 0 0 15 94,-0.4 92,-0.1 92,-0.2 95,-0.1 0.324 61.7 140.5 -93.7 11.2 0.3 68.7 -25.3 105 185 A V < - 0 0 5 -3,-0.6 2,-0.3 93,-0.1 -70,-0.0 -0.228 52.3-126.6 -55.0 125.9 0.6 65.1 -24.1 106 186 A N > - 0 0 50 1,-0.1 4,-2.1 88,-0.1 3,-0.2 -0.645 6.0-130.9 -74.9 143.9 -2.9 63.5 -24.4 107 187 A T H > S+ 0 0 41 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.864 109.3 57.1 -55.0 -46.7 -4.3 61.9 -21.3 108 188 A E H > S+ 0 0 128 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.904 107.7 47.0 -54.8 -39.3 -5.2 58.8 -23.4 109 189 A D H > S+ 0 0 14 -3,-0.2 4,-2.2 2,-0.2 5,-0.2 0.867 110.4 51.3 -73.9 -37.4 -1.5 58.4 -24.5 110 190 A V H X S+ 0 0 0 -4,-2.1 4,-3.2 2,-0.2 5,-0.2 0.958 109.5 52.2 -61.2 -46.0 -0.2 58.8 -20.9 111 191 A E H X S+ 0 0 57 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.890 110.7 48.4 -53.5 -45.2 -2.8 56.1 -19.8 112 192 A K H X S+ 0 0 86 -4,-1.7 4,-2.7 2,-0.2 -1,-0.2 0.906 112.7 46.0 -64.8 -44.5 -1.4 53.8 -22.6 113 193 A V H X S+ 0 0 0 -4,-2.2 4,-3.0 2,-0.2 5,-0.3 0.908 109.2 54.6 -74.2 -35.9 2.2 54.3 -21.7 114 194 A L H X S+ 0 0 2 -4,-3.2 4,-2.5 -5,-0.2 -1,-0.2 0.951 111.8 46.6 -53.4 -49.1 1.5 53.8 -18.0 115 195 A K H X S+ 0 0 101 -4,-2.2 4,-2.9 -5,-0.2 -2,-0.2 0.924 113.5 46.8 -58.1 -46.1 -0.1 50.5 -18.9 116 196 A D H X S+ 0 0 33 -4,-2.7 4,-3.2 2,-0.2 5,-0.4 0.916 112.4 49.9 -65.8 -38.1 2.7 49.5 -21.1 117 197 A G H X S+ 0 0 0 -4,-3.0 4,-2.3 1,-0.2 -2,-0.2 0.883 111.9 50.3 -69.3 -36.5 5.3 50.5 -18.4 118 198 A S H < S+ 0 0 58 -4,-2.5 -2,-0.2 -5,-0.3 -1,-0.2 0.970 116.2 39.6 -57.4 -52.3 3.4 48.5 -15.9 119 199 A A H < S+ 0 0 84 -4,-2.9 -2,-0.2 -5,-0.2 -3,-0.2 0.960 130.2 28.3 -65.3 -49.4 3.3 45.4 -18.1 120 200 A V H < S- 0 0 41 -4,-3.2 -3,-0.2 -5,-0.2 -2,-0.2 0.821 99.3-121.3 -87.5 -28.9 6.8 45.7 -19.5 121 201 A G S < S+ 0 0 2 -4,-2.3 35,-2.1 -5,-0.4 2,-0.3 0.030 92.6 36.2 106.3 -25.5 8.7 47.5 -16.7 122 202 A A E +E 155 0A 0 -6,-0.3 67,-2.4 33,-0.2 2,-0.3 -0.879 65.1 162.2-160.8 132.6 9.8 50.3 -18.9 123 203 A A E -Ef 154 189A 0 31,-2.5 31,-3.1 -2,-0.3 2,-0.3 -0.971 13.9-166.8-149.1 157.5 8.0 52.1 -21.8 124 204 A V E -Ef 153 190A 10 65,-2.3 67,-2.5 -2,-0.3 2,-0.4 -0.986 28.7-113.6-142.3 146.2 8.2 55.3 -23.7 125 205 A L E + f 0 191A 0 27,-1.6 25,-3.0 -2,-0.3 2,-0.3 -0.721 44.5 166.9 -80.2 139.3 5.8 57.0 -26.0 126 206 A G E -Ef 149 192A 0 65,-2.7 67,-3.3 -2,-0.4 23,-0.2 -0.889 25.9-150.0-144.4 166.6 6.9 57.2 -29.7 127 207 A V E -E 148 0A 1 21,-1.9 21,-4.1 -2,-0.3 2,-0.2 -0.982 40.7 -93.5-137.0 150.7 5.8 57.9 -33.2 128 208 A P E -E 147 0A 35 0, 0.0 19,-0.3 0, 0.0 2,-0.2 -0.508 49.5-114.0 -66.8 120.6 7.0 56.5 -36.5 129 209 A A - 0 0 32 17,-1.0 17,-0.2 -2,-0.2 4,-0.1 -0.472 23.0-158.5 -51.6 127.2 9.7 59.1 -37.7 130 210 A K + 0 0 165 -2,-0.2 -1,-0.1 2,-0.1 17,-0.0 0.778 66.2 84.1 -85.1 -27.9 8.3 60.6 -40.9 131 211 A A S S- 0 0 67 1,-0.1 2,-0.8 0, 0.0 -2,-0.0 -0.287 91.6-104.3 -66.2 157.1 11.7 61.8 -42.2 132 212 A T - 0 0 127 2,-0.0 2,-0.5 -2,-0.0 -1,-0.1 -0.767 45.9-170.1 -78.2 113.4 14.1 59.5 -44.1 133 213 A I + 0 0 95 -2,-0.8 2,-0.3 -4,-0.1 13,-0.1 -0.906 8.5 179.0-111.5 137.6 16.7 58.7 -41.5 134 214 A K - 0 0 133 -2,-0.5 2,-0.4 9,-0.0 -2,-0.0 -0.975 29.4-121.8-129.3 148.8 20.0 56.9 -42.3 135 215 A E - 0 0 135 -2,-0.3 8,-3.2 0, 0.0 2,-0.3 -0.758 31.2-162.5 -78.9 137.0 23.0 55.8 -40.2 136 216 A V B -H 142 0C 74 -2,-0.4 6,-0.2 6,-0.3 2,-0.1 -0.892 6.0-141.2-122.2 142.7 26.1 57.4 -41.5 137 217 A N > - 0 0 66 4,-2.1 3,-2.0 -2,-0.3 6,-0.0 -0.263 40.5 -82.6 -98.1-172.2 29.6 56.1 -40.7 138 218 A S T 3 S+ 0 0 115 1,-0.3 -1,-0.0 2,-0.1 -2,-0.0 0.619 127.3 58.8 -77.1 -7.6 32.7 58.1 -40.0 139 219 A D T 3 S- 0 0 125 2,-0.2 -1,-0.3 0, 0.0 3,-0.1 0.240 117.3-110.3-100.7 15.3 33.4 58.5 -43.7 140 220 A S S < S+ 0 0 103 -3,-2.0 2,-0.4 1,-0.3 -2,-0.1 0.706 75.2 134.9 67.7 25.1 30.1 60.3 -44.2 141 221 A L - 0 0 104 1,-0.0 -4,-2.1 -4,-0.0 -1,-0.3 -0.899 62.0-106.8-105.4 138.9 28.7 57.3 -46.1 142 222 A V B H 136 0C 85 -2,-0.4 -6,-0.3 -6,-0.2 -1,-0.0 -0.330 360.0 360.0 -53.0 127.2 25.2 55.8 -45.6 143 223 A V 0 0 103 -8,-3.2 -1,-0.2 -6,-0.0 -7,-0.1 0.808 360.0 360.0 -89.3 360.0 25.3 52.4 -43.9 144 ! 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 0.0 145 230 A T 0 0 161 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 122.0 11.6 50.6 -38.6 146 231 A L - 0 0 105 -17,-0.2 -17,-1.0 -13,-0.1 2,-0.4 -0.698 360.0-165.5-101.2 146.2 12.5 53.8 -36.9 147 232 A W E - E 0 128A 83 -2,-0.3 2,-0.5 -19,-0.3 -17,-0.0 -0.983 20.0-128.1-128.8 139.8 10.5 55.6 -34.2 148 233 A E E - E 0 127A 97 -21,-4.1 -21,-1.9 -2,-0.4 2,-0.3 -0.779 30.9-133.3 -88.6 132.1 10.8 59.1 -32.8 149 234 A M E + E 0 126A 84 -2,-0.5 -23,-0.2 -23,-0.2 2,-0.1 -0.538 30.3 167.7 -89.5 138.0 11.0 59.0 -29.0 150 235 A Q E - 0 0 11 -25,-3.0 -1,-0.1 -2,-0.3 48,-0.1 -0.298 28.2 -61.2-119.7-154.0 8.9 61.3 -26.8 151 236 A T E S+ 0 0 2 46,-0.2 2,-0.2 -2,-0.1 -53,-0.2 -0.962 82.4 70.0-141.3 151.6 8.0 61.5 -23.1 152 237 A P E - 0 0 0 0, 0.0 -27,-1.6 0, 0.0 2,-0.4 0.386 55.8-166.3 -69.5 155.9 6.7 60.3 -20.7 153 238 A Q E -DE 97 124A 31 -56,-2.1 -56,-3.3 -29,-0.2 2,-0.5 -0.985 8.5-157.3-104.9 127.8 9.1 57.5 -20.0 154 239 A V E +DE 96 123A 0 -31,-3.1 -31,-2.5 -2,-0.4 2,-0.3 -0.949 21.4 163.2-117.4 112.8 7.5 55.1 -17.5 155 240 A I E -DE 95 122A 6 -60,-3.0 -60,-3.8 -2,-0.5 -33,-0.2 -0.978 43.3-110.9-133.9 139.3 9.9 52.9 -15.6 156 241 A K > - 0 0 78 -35,-2.1 4,-2.7 -2,-0.3 -62,-0.2 -0.579 33.8-129.1 -67.8 137.3 9.6 50.9 -12.4 157 242 A P H > S+ 0 0 4 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.909 105.1 56.7 -67.4 -40.7 11.7 52.7 -9.8 158 243 A E H > S+ 0 0 112 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.887 112.3 44.0 -50.2 -50.7 13.7 49.6 -8.8 159 244 A L H > S+ 0 0 25 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.947 111.0 52.8 -56.4 -55.4 14.8 49.1 -12.4 160 245 A L H X S+ 0 0 5 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.913 112.3 46.9 -50.9 -42.1 15.5 52.9 -12.9 161 246 A K H X S+ 0 0 104 -4,-2.9 4,-2.2 2,-0.2 -1,-0.2 0.862 108.6 52.6 -66.1 -44.9 17.7 52.7 -9.8 162 247 A K H X S+ 0 0 121 -4,-2.0 4,-1.0 -5,-0.2 -2,-0.2 0.925 112.9 48.7 -53.2 -43.9 19.5 49.5 -11.0 163 248 A G H X S+ 0 0 0 -4,-2.9 4,-1.4 2,-0.2 3,-0.2 0.849 106.8 52.4 -68.0 -41.4 20.1 51.5 -14.2 164 249 A F H X S+ 0 0 9 -4,-2.1 4,-2.6 -5,-0.2 3,-0.3 0.936 111.1 49.3 -59.2 -39.6 21.4 54.6 -12.5 165 250 A E H X S+ 0 0 113 -4,-2.2 4,-1.7 1,-0.2 -2,-0.2 0.673 106.2 54.4 -82.3 -12.0 23.9 52.5 -10.6 166 251 A L H X S+ 0 0 52 -4,-1.0 4,-1.3 -3,-0.2 5,-0.2 0.762 113.1 43.4 -87.5 -27.9 25.1 50.6 -13.7 167 252 A V H < S+ 0 0 24 -4,-1.4 -2,-0.2 -3,-0.3 -3,-0.1 0.878 114.0 51.8 -75.9 -43.6 25.9 54.0 -15.4 168 253 A K H < S+ 0 0 115 -4,-2.6 -2,-0.2 -5,-0.2 -3,-0.2 0.909 109.9 48.2 -60.9 -47.9 27.4 55.3 -12.1 169 254 A S H < S+ 0 0 92 -4,-1.7 -1,-0.2 -5,-0.1 -2,-0.2 0.977 134.4 6.7 -52.7 -62.2 29.7 52.3 -11.7 170 255 A E S < S- 0 0 143 -4,-1.3 2,-0.3 -5,-0.1 -3,-0.1 0.630 100.2-107.6 -90.5-114.2 31.0 52.4 -15.3 171 256 A G + 0 0 43 -5,-0.2 -1,-0.1 1,-0.1 -3,-0.1 -0.997 49.3 87.6-168.6 167.2 29.9 55.4 -17.6 172 257 A L - 0 0 57 -2,-0.3 2,-0.3 1,-0.1 -1,-0.1 0.680 16.4-173.4 108.7 123.7 28.1 57.1 -20.4 173 258 A E + 0 0 44 1,-0.1 -1,-0.1 5,-0.0 -95,-0.1 -0.845 24.7 148.8-143.1 104.9 24.8 59.0 -21.2 174 259 A V 0 0 107 -2,-0.3 -1,-0.1 5,-0.1 5,-0.0 0.887 360.0 360.0-103.8 -52.7 24.3 59.9 -24.9 175 260 A T 0 0 122 4,-0.1 4,-0.1 0, 0.0 -2,-0.0 0.134 360.0 360.0 34.7 360.0 20.6 59.9 -25.9 176 ! 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 0.0 177 262 A D 0 0 149 0, 0.0 2,-0.4 0, 0.0 6,-0.1 0.000 360.0 360.0 360.0 71.7 19.9 55.5 -27.3 178 263 A V + 0 0 3 4,-0.1 2,-0.4 -5,-0.1 -5,-0.0 -0.967 360.0 148.8-104.3 107.9 20.8 56.3 -23.9 179 264 A S >> - 0 0 27 -2,-0.4 3,-0.9 -4,-0.1 4,-0.9 -0.801 63.3-117.3 -88.1 149.7 18.0 55.9 -21.7 180 265 A I T 34 S+ 0 0 14 -2,-0.4 -14,-0.1 1,-0.2 4,-0.0 0.816 120.3 57.3 -40.9 -31.1 19.8 54.8 -18.5 181 266 A V T >4 S+ 0 0 4 1,-0.2 3,-1.3 2,-0.2 4,-0.3 0.654 85.8 73.4 -90.2 -17.2 17.6 51.7 -19.2 182 267 A E G X4 S+ 0 0 103 -3,-0.9 3,-1.0 1,-0.2 -1,-0.2 0.997 96.3 53.2 -46.8 -62.4 18.9 51.0 -22.7 183 268 A Y G 3< S+ 0 0 99 -4,-0.9 -1,-0.2 1,-0.2 -2,-0.2 0.505 95.0 79.7 -49.3 -8.5 22.1 49.7 -21.0 184 269 A L G < S- 0 0 22 -3,-1.3 -1,-0.2 2,-0.2 -2,-0.1 0.678 86.0-130.1 -87.6 -25.2 20.1 47.3 -18.8 185 270 A K S < S+ 0 0 207 -3,-1.0 -1,-0.1 1,-0.4 -2,-0.1 -0.029 75.9 114.5 80.7 -24.7 19.1 44.1 -20.7 186 271 A H S S- 0 0 71 -5,-0.2 -1,-0.4 1,-0.1 -2,-0.2 -0.581 76.7-101.9 -69.6 139.4 15.6 44.7 -19.5 187 272 A P - 0 0 77 0, 0.0 2,-0.5 0, 0.0 -65,-0.1 -0.283 24.5-150.7 -61.4 141.7 13.2 45.4 -22.3 188 273 A V - 0 0 54 -67,-0.1 2,-0.3 -2,-0.0 -65,-0.2 -0.966 11.3-154.6-114.6 118.0 11.8 48.9 -23.3 189 274 A Y E -f 123 0A 112 -67,-2.4 -65,-2.3 -2,-0.5 2,-0.6 -0.654 6.2-144.5 -85.8 146.2 8.4 49.0 -24.9 190 275 A V E -f 124 0A 51 -2,-0.3 2,-0.4 -67,-0.2 -65,-0.2 -0.957 11.9-155.8-117.9 111.0 7.4 51.9 -27.2 191 276 A S E -f 125 0A 1 -67,-2.5 -65,-2.7 -2,-0.6 2,-0.4 -0.763 27.3-111.8 -85.4 133.2 3.8 52.9 -26.9 192 277 A Q E +f 126 0A 102 -2,-0.4 -65,-0.2 -67,-0.2 -67,-0.1 -0.537 45.9 177.4 -74.1 121.1 2.5 54.6 -30.0 193 278 A G - 0 0 12 -67,-3.3 2,-0.4 -2,-0.4 -1,-0.1 -0.040 28.2 -80.2-101.3-151.5 1.7 58.2 -29.3 194 279 A S > - 0 0 37 -67,-0.1 3,-2.0 -2,-0.1 -1,-0.1 -0.922 21.1-129.9-126.7 140.3 0.5 61.2 -31.2 195 280 A Y T 3 S+ 0 0 105 -2,-0.4 -68,-0.1 1,-0.3 -1,-0.1 0.582 105.0 69.3 -68.4 -8.8 2.4 63.6 -33.5 196 281 A T T 3 + 0 0 52 1,-0.2 2,-2.8 -92,-0.1 -1,-0.3 0.572 69.5 90.4 -85.4 -12.9 0.9 66.4 -31.5 197 282 A N < + 0 0 0 -3,-2.0 -1,-0.2 -94,-0.1 -46,-0.2 -0.413 66.7 162.5 -77.2 58.6 3.0 65.6 -28.5 198 283 A I - 0 0 30 -2,-2.8 -94,-0.4 7,-0.1 2,-0.3 -0.419 40.7-118.6 -75.4 160.7 5.5 68.0 -30.0 199 284 A K - 0 0 90 -97,-0.1 2,-0.6 -2,-0.1 -97,-0.2 -0.824 26.0-125.9 -97.8 145.5 8.3 69.5 -27.9 200 285 A V + 0 0 4 -99,-2.3 -98,-0.0 -2,-0.3 -172,-0.0 -0.829 59.1 118.6-104.2 113.1 8.3 73.3 -27.5 201 286 A T + 0 0 67 -2,-0.6 -1,-0.1 1,-0.5 -183,-0.0 0.493 64.3 49.4-130.9 -72.2 11.6 75.1 -28.4 202 287 A T S >> S- 0 0 80 1,-0.1 3,-3.0 4,-0.0 4,-1.3 -0.542 82.3-121.7 -69.0 141.5 11.2 77.6 -31.3 203 288 A P H 3> S+ 0 0 84 0, 0.0 4,-2.4 0, 0.0 -1,-0.1 0.566 116.1 69.7 -65.5 -1.6 8.3 80.1 -31.1 204 289 A D H 3> S+ 0 0 122 2,-0.2 4,-0.8 3,-0.2 -4,-0.0 0.689 96.2 52.0 -83.4 -21.6 7.3 78.4 -34.4 205 290 A D H X> S+ 0 0 33 -3,-3.0 4,-5.0 2,-0.2 3,-0.5 0.958 110.4 45.8 -65.2 -59.6 6.6 75.5 -32.2 206 291 A L H 3X S+ 0 0 28 -4,-1.3 4,-3.4 2,-0.3 5,-0.3 0.923 109.5 54.0 -47.4 -50.1 4.4 77.7 -30.0 207 292 A L H 3X S+ 0 0 51 -4,-2.4 4,-1.7 1,-0.2 -1,-0.3 0.906 117.5 39.5 -49.0 -38.6 2.9 79.0 -33.2 208 293 A L H