==== 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 TRANSFERASE 23-JAN-08 3C1M . COMPND 2 MOLECULE: PROBABLE ASPARTOKINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: METHANOCALDOCOCCUS JANNASCHII; . AUTHOR X.LIU . 1868 12 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 69434.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1382 74.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 134 7.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 240 12.8 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 . 4 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 116 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 148 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 659 35.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 48 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 1 0 0 4 1 5 3 4 12 0 9 2 1 1 0 0 0 0 4 0 0 3 0 0 4 0 0 RESIDUES PER ALPHA HELIX . 2 2 8 4 12 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 . 5 0 20 4 1 5 4 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 4 0 0 0 3 1 0 0 0 1 1 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 2 A T 0 0 27 0, 0.0 222,-2.4 0, 0.0 223,-1.4 0.000 360.0 360.0 360.0 117.2 28.8 36.9 61.7 2 3 A T E -ab 34 224A 5 31,-2.8 33,-2.5 221,-0.2 2,-0.5 -0.944 360.0-159.1-117.7 130.8 31.2 34.0 61.5 3 4 A V E -ab 35 225A 0 221,-2.0 223,-3.7 -2,-0.4 2,-0.5 -0.952 12.6-168.2-104.6 129.9 30.7 30.4 62.3 4 5 A M E -ab 36 226A 0 31,-2.5 33,-2.7 -2,-0.5 2,-0.5 -0.977 1.1-166.9-120.3 117.4 33.9 28.5 62.9 5 6 A K E -ab 37 227A 11 221,-3.3 223,-3.6 -2,-0.5 2,-0.4 -0.914 0.5-164.8-111.6 130.9 33.8 24.7 63.1 6 7 A F E -ab 38 228A 0 31,-2.5 33,-2.1 -2,-0.5 223,-0.2 -0.950 10.9-141.7-119.2 132.9 36.7 22.6 64.4 7 8 A G > - 0 0 7 221,-1.4 4,-1.1 -2,-0.4 35,-0.2 -0.111 33.0 -88.4 -86.0-179.9 37.1 18.8 63.9 8 9 A G T 4 S+ 0 0 16 1,-0.2 34,-2.0 2,-0.2 3,-0.4 0.880 124.2 44.9 -60.7 -45.1 38.4 16.0 66.2 9 10 A T T >4 S+ 0 0 38 1,-0.2 3,-1.5 32,-0.2 -1,-0.2 0.845 107.4 60.8 -68.7 -31.7 42.1 16.2 65.2 10 11 A S T 34 S+ 0 0 0 1,-0.3 10,-0.3 218,-0.2 -1,-0.2 0.779 119.1 28.1 -64.7 -29.0 42.0 20.0 65.4 11 12 A V T 3< S+ 0 0 1 -4,-1.1 -1,-0.3 -3,-0.4 -2,-0.2 -0.156 87.3 125.9-118.0 33.6 41.1 19.7 69.1 12 13 A G S < S+ 0 0 17 -3,-1.5 2,-0.3 29,-0.2 -2,-0.1 0.437 76.2 11.3 -81.5 -1.8 42.9 16.3 69.5 13 14 A S S > S- 0 0 35 -3,-0.1 4,-2.3 -4,-0.1 5,-0.1 -0.934 85.2 -96.6-157.9 174.0 45.0 17.4 72.5 14 15 A G H > S+ 0 0 1 -2,-0.3 4,-2.1 1,-0.2 5,-0.2 0.876 122.8 52.7 -65.0 -43.8 45.3 20.3 74.9 15 16 A E H > S+ 0 0 155 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.854 111.7 48.7 -55.2 -38.2 48.0 22.1 72.9 16 17 A R H > S+ 0 0 98 2,-0.2 4,-2.9 1,-0.2 -2,-0.2 0.934 108.5 51.1 -71.8 -45.8 45.7 21.8 69.9 17 18 A I H X S+ 0 0 1 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.882 111.4 48.7 -55.7 -43.8 42.6 23.2 71.8 18 19 A R H X S+ 0 0 38 -4,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.903 110.6 50.3 -66.1 -42.6 44.6 26.2 72.9 19 20 A H H X S+ 0 0 68 -4,-1.9 4,-1.7 2,-0.2 -2,-0.2 0.932 111.2 49.7 -57.9 -45.8 45.9 26.8 69.4 20 21 A V H X S+ 0 0 0 -4,-2.9 4,-2.2 -10,-0.3 -2,-0.2 0.908 106.9 54.0 -59.0 -44.2 42.2 26.6 68.2 21 22 A A H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.843 106.8 53.8 -60.5 -35.3 41.2 29.1 70.9 22 23 A K H X S+ 0 0 110 -4,-1.8 4,-2.2 2,-0.2 -1,-0.2 0.868 106.8 49.8 -62.7 -42.3 43.9 31.4 69.5 23 24 A I H X S+ 0 0 15 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.900 114.1 46.1 -61.5 -42.2 42.5 31.2 66.0 24 25 A V H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.898 112.1 50.4 -66.6 -41.9 39.0 32.0 67.4 25 26 A T H X S+ 0 0 18 -4,-2.3 4,-0.7 2,-0.2 -2,-0.2 0.840 109.8 51.0 -68.4 -34.8 40.4 34.8 69.5 26 27 A K H >< S+ 0 0 109 -4,-2.2 3,-0.8 2,-0.2 4,-0.5 0.922 111.9 46.6 -64.5 -47.5 42.2 36.3 66.4 27 28 A R H >X S+ 0 0 30 -4,-2.1 4,-2.3 1,-0.2 3,-1.6 0.866 102.3 66.0 -62.3 -38.5 38.9 36.1 64.4 28 29 A K H 3< S+ 0 0 7 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.783 98.1 54.3 -52.2 -32.0 37.0 37.7 67.3 29 30 A K T << S+ 0 0 172 -3,-0.8 -1,-0.3 -4,-0.7 -2,-0.2 0.648 112.6 41.4 -81.3 -17.7 39.0 40.9 66.8 30 31 A E T <4 S+ 0 0 127 -3,-1.6 2,-0.3 -4,-0.5 -2,-0.2 0.698 131.2 22.0 -95.2 -29.9 38.1 41.2 63.1 31 32 A D < - 0 0 37 -4,-2.3 -1,-0.3 1,-0.1 -29,-0.1 -0.933 62.8-159.2-143.4 114.5 34.4 40.2 63.6 32 33 A D S S+ 0 0 97 -2,-0.3 2,-1.1 -3,-0.2 -4,-0.1 0.699 81.6 75.5 -68.7 -20.6 32.7 40.6 67.1 33 34 A D + 0 0 57 153,-0.1 -31,-2.8 2,-0.0 2,-0.4 -0.768 62.6 152.4 -97.6 91.8 30.1 38.0 66.1 34 35 A V E -a 2 0A 0 -2,-1.1 2,-0.4 -33,-0.2 -31,-0.2 -0.989 21.5-175.4-121.9 126.5 31.7 34.6 66.3 35 36 A V E -a 3 0A 0 -33,-2.5 -31,-2.5 -2,-0.4 2,-0.4 -0.965 15.4-149.4-113.0 135.4 30.0 31.3 67.1 36 37 A V E -ac 4 188A 0 151,-3.1 153,-3.8 -2,-0.4 2,-0.4 -0.882 8.3-166.3-106.4 134.3 32.2 28.1 67.5 37 38 A V E -ac 5 189A 0 -33,-2.7 -31,-2.5 -2,-0.4 2,-0.4 -0.984 15.8-173.1-113.6 133.4 31.1 24.6 66.6 38 39 A V E -ac 6 190A 0 151,-2.3 153,-2.7 -2,-0.4 -31,-0.2 -0.967 14.4-147.1-132.3 142.5 33.3 21.8 67.9 39 40 A S - 0 0 0 -33,-2.1 3,-0.1 -2,-0.4 2,-0.1 -0.475 41.4 -80.5 -87.7 169.1 33.5 18.0 67.5 40 41 A A - 0 0 2 -2,-0.2 89,-0.2 1,-0.1 -29,-0.2 -0.385 64.1 -81.6 -58.4 146.2 34.6 15.5 70.0 41 42 A M S > S- 0 0 4 87,-0.5 3,-2.1 1,-0.2 4,-0.5 -0.199 71.6 -70.3 -45.6 141.4 38.4 15.0 70.5 42 43 A S T 3 S+ 0 0 35 -34,-2.0 -1,-0.2 1,-0.2 -35,-0.0 -0.085 117.5 4.3 -40.5 127.8 39.8 12.8 67.8 43 44 A E T 3> S+ 0 0 127 -3,-0.2 4,-1.8 1830,-0.1 -1,-0.2 0.282 98.5 107.3 80.9 -7.9 38.8 9.1 68.0 44 45 A V H <> S+ 0 0 0 -3,-2.1 4,-2.6 2,-0.2 5,-0.2 0.917 75.4 52.7 -70.0 -45.5 36.5 9.6 71.1 45 46 A T H > S+ 0 0 6 -4,-0.5 4,-2.4 1,-0.2 -1,-0.2 0.924 110.3 48.9 -55.2 -46.3 33.3 9.1 69.1 46 47 A N H > S+ 0 0 56 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.886 110.1 51.5 -59.4 -42.4 34.6 5.8 67.8 47 48 A A H X S+ 0 0 9 -4,-1.8 4,-2.7 2,-0.2 5,-0.2 0.887 109.2 50.4 -59.5 -43.7 35.6 4.8 71.3 48 49 A L H X S+ 0 0 0 -4,-2.6 4,-1.7 2,-0.2 -2,-0.2 0.920 110.0 51.2 -60.6 -46.4 32.0 5.6 72.5 49 50 A V H X S+ 0 0 37 -4,-2.4 4,-1.4 2,-0.2 -2,-0.2 0.931 113.6 44.0 -53.6 -50.6 30.6 3.5 69.7 50 51 A E H X S+ 0 0 117 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.906 112.9 48.9 -69.4 -41.1 32.8 0.5 70.6 51 52 A I H X S+ 0 0 3 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.767 107.5 58.4 -70.9 -24.9 32.3 0.6 74.4 52 53 A S H X S+ 0 0 0 -4,-1.7 4,-1.2 -5,-0.2 -1,-0.2 0.911 109.7 42.1 -60.2 -48.0 28.5 0.9 73.8 53 54 A Q H X S+ 0 0 81 -4,-1.4 4,-3.4 2,-0.2 5,-0.3 0.840 115.1 50.5 -73.1 -35.5 28.5 -2.4 71.9 54 55 A Q H X>S+ 0 0 57 -4,-2.0 4,-1.9 2,-0.2 5,-1.7 0.894 108.2 52.1 -67.8 -43.5 30.9 -4.0 74.5 55 56 A A H <5S+ 0 0 1 -4,-2.2 -2,-0.2 3,-0.2 -1,-0.2 0.813 118.1 40.4 -61.0 -31.1 28.6 -2.9 77.3 56 57 A L H <5S+ 0 0 40 -4,-1.2 -2,-0.2 -5,-0.1 -1,-0.2 0.943 123.3 33.7 -80.3 -55.3 25.7 -4.5 75.4 57 58 A D H <5S+ 0 0 112 -4,-3.4 -3,-0.2 1,-0.1 -2,-0.2 0.890 134.1 20.0 -75.6 -43.8 27.3 -7.7 74.1 58 59 A V T <5S- 0 0 90 -4,-1.9 -3,-0.2 -5,-0.3 -1,-0.1 0.772 81.5-153.8-100.2 -30.8 29.8 -8.7 76.9 59 60 A R < + 0 0 112 -5,-1.7 2,-0.6 1,-0.2 -4,-0.2 0.884 30.1 160.8 56.7 47.8 28.4 -6.7 79.9 60 61 A D > - 0 0 79 -6,-0.4 4,-1.2 1,-0.1 -1,-0.2 -0.901 25.1-164.9-101.0 118.6 31.7 -6.4 81.8 61 62 A I H > S+ 0 0 77 -2,-0.6 4,-1.5 1,-0.2 -1,-0.1 0.778 87.7 50.8 -75.8 -31.9 31.5 -3.6 84.4 62 63 A A H > S+ 0 0 66 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.746 106.9 56.7 -76.4 -25.7 35.3 -3.3 85.1 63 64 A K H > S+ 0 0 67 2,-0.2 4,-1.2 1,-0.2 -2,-0.2 0.827 107.3 47.4 -72.5 -35.7 35.8 -3.1 81.3 64 65 A V H X S+ 0 0 2 -4,-1.2 4,-2.3 2,-0.2 -2,-0.2 0.855 108.8 57.1 -64.4 -38.8 33.4 -0.1 81.3 65 66 A G H X S+ 0 0 21 -4,-1.5 4,-1.6 1,-0.2 -2,-0.2 0.811 103.3 51.9 -62.8 -34.2 35.5 1.2 84.3 66 67 A D H X S+ 0 0 110 -4,-1.4 4,-2.0 2,-0.2 -1,-0.2 0.856 108.3 51.8 -70.6 -37.5 38.7 1.1 82.2 67 68 A F H X S+ 0 0 17 -4,-1.2 4,-2.5 2,-0.2 5,-0.2 0.931 106.8 52.8 -61.7 -47.3 37.0 3.1 79.5 68 69 A I H X S+ 0 0 5 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.900 109.9 48.6 -56.2 -42.4 36.0 5.7 82.0 69 70 A K H X S+ 0 0 132 -4,-1.6 4,-2.5 2,-0.2 -1,-0.2 0.877 110.9 50.5 -65.5 -40.3 39.6 6.0 83.2 70 71 A F H X S+ 0 0 90 -4,-2.0 4,-1.7 2,-0.2 -2,-0.2 0.873 114.5 44.1 -61.1 -41.5 40.8 6.3 79.6 71 72 A I H X S+ 0 0 0 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.875 114.7 49.2 -73.3 -39.6 38.2 9.1 78.9 72 73 A R H X S+ 0 0 70 -4,-2.7 4,-2.8 -5,-0.2 5,-0.2 0.938 111.8 47.1 -65.2 -48.2 39.0 10.9 82.2 73 74 A E H X S+ 0 0 141 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.900 112.1 51.0 -62.9 -43.9 42.7 10.9 81.7 74 75 A K H X S+ 0 0 61 -4,-1.7 4,-2.0 -5,-0.2 -1,-0.2 0.935 116.0 40.0 -56.1 -50.8 42.4 12.1 78.1 75 76 A H H X S+ 0 0 0 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.832 113.5 53.1 -76.9 -32.0 40.2 15.0 79.1 76 77 A Y H X S+ 0 0 73 -4,-2.8 4,-2.2 2,-0.2 -1,-0.2 0.904 110.5 49.6 -61.8 -43.2 42.0 15.9 82.3 77 78 A K H X S+ 0 0 130 -4,-2.3 4,-2.2 -5,-0.2 -2,-0.2 0.914 109.1 51.1 -62.2 -46.3 45.2 16.1 80.2 78 79 A A H X S+ 0 0 2 -4,-2.0 4,-1.1 2,-0.2 -1,-0.2 0.875 109.8 51.5 -57.5 -41.5 43.6 18.4 77.6 79 80 A I H X S+ 0 0 9 -4,-1.8 4,-1.9 2,-0.2 3,-0.5 0.943 111.7 45.2 -60.6 -51.2 42.4 20.7 80.4 80 81 A E H < S+ 0 0 119 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.848 118.4 43.1 -61.7 -38.1 45.9 21.0 82.0 81 82 A E H < S+ 0 0 96 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.565 118.1 43.7 -88.2 -10.0 47.5 21.6 78.6 82 83 A A H < S+ 0 0 1 -4,-1.1 2,-0.4 -3,-0.5 -2,-0.2 0.768 109.1 51.2-102.8 -32.6 44.9 24.0 77.2 83 84 A I < - 0 0 3 -4,-1.9 -1,-0.2 -5,-0.2 56,-0.1 -0.934 49.2-171.9-119.6 128.2 44.2 26.4 80.1 84 85 A K + 0 0 160 -2,-0.4 2,-0.3 55,-0.1 -1,-0.1 0.810 64.1 91.6 -82.1 -36.7 46.7 28.3 82.2 85 86 A S > - 0 0 35 1,-0.2 4,-2.4 2,-0.0 5,-0.1 -0.475 62.0-155.3 -68.8 125.9 44.2 29.6 84.8 86 87 A E H > S+ 0 0 133 -2,-0.3 4,-2.4 2,-0.2 5,-0.2 0.873 96.0 53.1 -62.6 -39.8 43.8 27.4 87.8 87 88 A E H > S+ 0 0 154 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.898 112.0 43.4 -67.9 -42.1 40.3 28.8 88.4 88 89 A I H > S+ 0 0 25 2,-0.2 4,-3.0 1,-0.2 5,-0.3 0.909 112.9 52.6 -66.6 -43.8 39.1 28.1 84.9 89 90 A K H X S+ 0 0 16 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.908 111.7 47.4 -55.7 -46.0 40.8 24.6 85.0 90 91 A E H X S+ 0 0 116 -4,-2.4 4,-1.8 2,-0.2 -1,-0.2 0.922 112.8 48.2 -59.0 -49.5 38.9 23.9 88.2 91 92 A E H X S+ 0 0 93 -4,-2.2 4,-1.2 1,-0.2 -2,-0.2 0.876 115.2 44.1 -64.9 -38.7 35.6 25.2 86.7 92 93 A V H X S+ 0 0 0 -4,-3.0 4,-2.7 2,-0.2 -2,-0.2 0.897 109.4 56.2 -71.5 -41.3 36.0 23.1 83.5 93 94 A K H X S+ 0 0 87 -4,-2.7 4,-2.4 -5,-0.3 -2,-0.2 0.875 104.1 55.3 -59.2 -37.7 37.1 20.0 85.4 94 95 A K H X S+ 0 0 130 -4,-1.8 4,-1.6 2,-0.2 -1,-0.2 0.898 109.6 45.3 -60.2 -43.9 33.8 20.2 87.4 95 96 A I H X S+ 0 0 53 -4,-1.2 4,-1.9 2,-0.2 -2,-0.2 0.950 112.8 50.7 -62.6 -50.1 31.8 20.2 84.2 96 97 A I H X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.867 108.6 53.1 -56.9 -40.7 33.9 17.3 82.8 97 98 A D H X S+ 0 0 32 -4,-2.4 4,-2.8 2,-0.2 -1,-0.2 0.859 105.0 53.4 -63.3 -43.0 33.3 15.3 86.0 98 99 A S H X S+ 0 0 54 -4,-1.6 4,-2.4 -3,-0.2 -1,-0.2 0.927 112.1 46.1 -55.9 -46.2 29.5 15.7 85.8 99 100 A R H X S+ 0 0 50 -4,-1.9 4,-3.3 2,-0.2 -2,-0.2 0.922 112.8 48.2 -65.0 -46.9 29.6 14.3 82.3 100 101 A I H X S+ 0 0 0 -4,-2.4 4,-2.8 2,-0.2 -1,-0.2 0.900 110.9 52.1 -61.9 -44.0 31.9 11.4 83.1 101 102 A E H X S+ 0 0 117 -4,-2.8 4,-2.1 2,-0.2 -2,-0.2 0.963 114.4 42.7 -48.1 -59.3 29.6 10.6 86.2 102 103 A E H X S+ 0 0 49 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.896 114.0 51.6 -57.6 -46.7 26.5 10.6 83.9 103 104 A L H X S+ 0 0 0 -4,-3.3 4,-1.9 1,-0.2 -1,-0.2 0.896 109.0 50.5 -57.2 -46.6 28.4 8.6 81.2 104 105 A E H X S+ 0 0 64 -4,-2.8 4,-1.7 1,-0.2 -1,-0.2 0.900 110.1 49.7 -61.2 -43.1 29.5 6.0 83.6 105 106 A K H X S+ 0 0 73 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.932 109.9 50.9 -61.8 -45.9 26.0 5.5 85.0 106 107 A V H X S+ 0 0 1 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.889 111.2 47.2 -58.5 -44.8 24.5 5.1 81.5 107 108 A L H X S+ 0 0 0 -4,-1.9 4,-1.5 2,-0.2 -1,-0.2 0.808 110.7 51.3 -71.2 -31.1 27.0 2.5 80.5 108 109 A I H X S+ 0 0 23 -4,-1.7 4,-2.4 2,-0.2 -1,-0.2 0.856 108.7 53.5 -72.0 -35.3 26.5 0.6 83.7 109 110 A G H X S+ 0 0 0 -4,-2.3 4,-2.8 1,-0.2 5,-0.3 0.919 106.2 52.3 -59.3 -46.0 22.8 0.7 82.9 110 111 A V H X>S+ 0 0 0 -4,-2.1 4,-1.7 1,-0.2 5,-0.8 0.861 112.0 45.0 -60.0 -40.1 23.4 -0.8 79.5 111 112 A A H <5S+ 0 0 2 -4,-1.5 -1,-0.2 2,-0.2 -2,-0.2 0.885 114.1 49.7 -72.4 -40.4 25.4 -3.7 81.0 112 113 A Y H <5S+ 0 0 55 -4,-2.4 -2,-0.2 1,-0.2 -3,-0.2 0.941 120.8 33.1 -61.1 -52.7 22.8 -4.3 83.7 113 114 A L H <5S- 0 0 26 -4,-2.8 -2,-0.2 2,-0.2 -1,-0.2 0.756 95.5-138.3 -77.7 -26.1 19.8 -4.3 81.3 114 115 A G T <5 + 0 0 24 -4,-1.7 2,-0.3 -5,-0.3 -3,-0.2 0.843 65.9 115.6 67.7 34.4 21.6 -5.9 78.4 115 116 A E < - 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0 0 2 3,-0.3 -2,-0.4 1,-0.1 -28,-0.1 -0.976 64.2-150.3-126.4 140.2 -25.1 13.2 65.2 1845 444 D E S S+ 0 0 84 -2,-0.4 -29,-1.7 1,-0.2 -28,-0.4 0.749 102.4 21.3 -68.5 -27.4 -26.4 16.3 67.2 1846 445 D V S S+ 0 0 0 -31,-0.2 -34,-2.0 -32,-0.2 2,-0.4 0.379 108.6 81.9-127.5 1.9 -29.9 15.8 65.8 1847 446 D N E -F 1811 0K 4 -36,-0.2 -5,-0.4 -559,-0.1 2,-0.4 -0.936 37.1-179.7-129.7 134.6 -30.3 12.2 64.6 1848 447 D I E -F 1810 0K 1 -38,-2.2 -38,-2.7 -2,-0.4 2,-0.3 -0.999 20.1-175.4-119.9 127.0 -31.1 8.7 65.8 1849 448 D S E +FG18091840K 0 -9,-1.9 -9,-2.9 -2,-0.4 2,-0.3 -0.888 6.5 168.4-120.7 153.6 -31.2 5.9 63.2 1850 449 D F E -FG18081839K 0 -42,-2.1 -42,-2.8 -2,-0.3 2,-0.4 -0.986 27.3-120.8-160.0 159.0 -32.1 2.2 63.5 1851 450 D V E +FG18071838K 0 -13,-2.3 -14,-2.9 -2,-0.3 -13,-0.9 -0.865 31.4 163.1-110.8 135.6 -32.8 -0.8 61.4 1852 451 D I E -F 1806 0K 0 -46,-1.9 -46,-2.4 -2,-0.4 -16,-0.1 -0.880 49.0 -68.4-135.5 171.2 -36.0 -2.9 61.3 1853 452 D D E > -F 1805 0K 28 -18,-0.4 3,-1.8 -2,-0.3 -48,-0.3 -0.398 43.1-124.7 -58.9 136.9 -37.6 -5.4 59.0 1854 453 D E G > S+ 0 0 51 -50,-1.6 3,-1.7 1,-0.3 4,-0.3 0.862 108.6 62.9 -50.6 -42.5 -38.8 -3.9 55.7 1855 454 D K G 3 S+ 0 0 155 -51,-0.3 4,-0.3 1,-0.3 -1,-0.3 0.702 101.5 51.8 -57.0 -23.0 -42.3 -5.2 56.3 1856 455 D D G <> S+ 0 0 19 -3,-1.8 4,-2.8 1,-0.2 -1,-0.3 0.394 77.2 103.6 -98.8 1.5 -42.7 -3.1 59.5 1857 456 D L H <> S+ 0 0 14 -3,-1.7 4,-2.8 -4,-0.3 5,-0.2 0.896 83.1 42.6 -53.0 -51.7 -41.7 0.2 57.9 1858 457 D L H > S+ 0 0 68 -4,-0.3 4,-3.0 -3,-0.2 5,-0.2 0.939 115.3 47.2 -64.7 -50.5 -45.2 1.7 57.7 1859 458 D N H > S+ 0 0 67 -4,-0.3 4,-2.4 1,-0.2 -1,-0.2 0.916 114.9 48.4 -59.0 -42.0 -46.4 0.6 61.1 1860 459 D C H X S+ 0 0 0 -4,-2.8 4,-2.3 2,-0.2 -2,-0.2 0.938 113.2 45.3 -63.9 -48.8 -43.2 1.9 62.6 1861 460 D V H X S+ 0 0 1 -4,-2.8 4,-2.3 -5,-0.2 -2,-0.2 0.929 113.6 50.9 -60.6 -44.7 -43.3 5.3 60.9 1862 461 D R H X S+ 0 0 107 -4,-3.0 4,-2.7 2,-0.2 -2,-0.2 0.928 111.6 46.6 -57.5 -48.4 -47.0 5.7 61.7 1863 462 D K H X S+ 0 0 42 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.896 112.6 49.3 -62.8 -44.3 -46.5 4.9 65.4 1864 463 D L H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 5,-0.4 0.870 112.9 48.9 -61.5 -37.2 -43.5 7.3 65.7 1865 464 D H H X>S+ 0 0 0 -4,-2.3 5,-2.0 -5,-0.2 4,-1.9 0.896 110.5 49.5 -70.4 -42.5 -45.6 9.9 64.0 1866 465 D E H <>S+ 0 0 105 -4,-2.7 5,-2.2 3,-0.2 -2,-0.2 0.949 115.8 44.1 -55.9 -52.3 -48.6 9.4 66.3 1867 466 D K H <5S+ 0 0 93 -4,-2.5 -2,-0.2 3,-0.2 -1,-0.2 0.873 126.6 23.9 -64.6 -45.2 -46.3 9.6 69.4 1868 467 D F H <5S+ 0 0 6 -4,-2.1 -158,-0.2 -5,-0.2 -3,-0.2 0.742 132.0 25.8-100.2 -27.2 -44.2 12.6 68.5 1869 468 D I T <5S+ 0 0 19 -4,-1.9 -3,-0.2 -5,-0.4 -2,-0.1 0.853 127.4 32.7-109.3 -43.7 -46.1 14.8 66.1 1870 469 D E T < 0 0 77 -5,-2.0 -3,-0.2 -4,-0.1 -4,-0.2 0.849 360.0 360.0 -83.4 -39.6 -49.8 14.2 66.5 1871 470 D K < 0 0 177 -5,-2.2 -4,-0.2 -6,-0.3 -5,-0.1 0.987 360.0 360.0 56.7 360.0 -49.8 13.5 70.3 1872 !* 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 1873 471 A D 0 0 40 0, 0.0 -1828,-0.2 0, 0.0 -1827,-0.2 0.000 360.0 360.0 360.0 360.0 31.2 13.1 65.5 1874 !* 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 1875 472 B D 0 0 42 0, 0.0 -1202,-0.2 0, 0.0 -1362,-0.1 0.000 360.0 360.0 360.0 360.0 -0.2 -7.1 14.4 1876 !* 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 1877 472 C D 0 0 46 0, 0.0 -734,-1.8 0, 0.0 -733,-0.4 0.000 360.0 360.0 360.0 360.0 -2.0 -10.8 87.1 1878 !* 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 1879 472 D D 0 0 43 0, 0.0 -268,-2.0 0, 0.0 -267,-0.3 0.000 360.0 360.0 360.0 360.0 -32.8 13.9 37.8