==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-AUG-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 11-AUG-11 3TDF . COMPND 2 MOLECULE: DIHYDRODIPICOLINATE SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ACINETOBACTER BAUMANNII; . AUTHOR M.KUMAR,S.KAUSHIK,M.SINHA,P.KAUR,R.TEWARI,S.SHARMA,T.P.SINGH . 582 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21435.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 431 74.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 74 12.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.7 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 . 2 0.3 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 . 32 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 61 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 221 38.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 17 2.9 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 3 0 1 2 0 5 2 2 2 1 6 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 6 6 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 PARALLEL BRIDGES PER LADDER . 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 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 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 1 A T 0 0 167 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -71.3 20.9 23.3 22.0 2 2 A I + 0 0 24 199,-0.0 2,-0.3 2,-0.0 36,-0.1 -0.470 360.0 168.6 -64.1 122.0 17.1 22.8 21.4 3 3 A Q + 0 0 96 -2,-0.3 2,-0.3 34,-0.1 198,-0.3 -0.925 23.0 29.6-134.2 160.3 15.4 22.2 24.8 4 4 A G E S-a 201 0A 6 196,-2.0 198,-2.2 -2,-0.3 2,-0.7 -0.672 99.9 -1.2 104.1-152.1 12.1 22.0 26.4 5 5 A S E -a 202 0A 0 -2,-0.3 32,-2.0 30,-0.3 33,-1.3 -0.733 59.6-175.4 -83.8 111.4 8.6 20.9 25.2 6 6 A I E -ab 203 38A 0 196,-2.9 198,-2.0 -2,-0.7 2,-0.3 -0.904 15.8-146.9-111.5 102.5 8.9 20.0 21.5 7 7 A V E -ab 204 39A 0 31,-1.8 33,-3.4 -2,-0.7 2,-1.4 -0.488 8.7-145.2 -73.8 131.7 5.5 19.1 20.1 8 8 A A E - b 0 40A 3 196,-2.8 33,-0.1 -2,-0.3 200,-0.1 -0.801 36.9-144.0 -89.0 90.7 5.3 16.5 17.4 9 9 A I - 0 0 1 -2,-1.4 34,-0.5 31,-1.2 33,-0.3 -0.332 0.1-126.2 -68.2 139.8 2.4 18.3 15.8 10 10 A V - 0 0 0 195,-0.1 36,-0.3 36,-0.1 -1,-0.1 -0.326 21.8-120.4 -67.5 161.4 -0.5 16.5 14.1 11 11 A T - 0 0 0 34,-0.5 10,-0.1 30,-0.1 -1,-0.0 -0.925 30.6-135.4-105.8 103.9 -1.3 17.4 10.5 12 12 A P - 0 0 0 0, 0.0 8,-2.8 0, 0.0 2,-0.3 -0.302 26.9-167.2 -59.2 140.2 -4.9 18.6 10.6 13 13 A M B -I 19 0B 0 252,-0.4 252,-1.2 250,-0.3 250,-0.3 -0.972 20.8-121.0-133.9 150.1 -7.0 17.2 7.9 14 14 A L > - 0 0 73 4,-3.4 3,-2.6 -2,-0.3 252,-0.1 -0.334 48.1 -92.3 -74.7 167.6 -10.4 17.8 6.3 15 15 A K T 3 S+ 0 0 146 1,-0.3 251,-0.3 250,-0.2 -1,-0.1 0.822 128.5 54.6 -55.3 -34.6 -13.0 15.0 6.3 16 16 A D T 3 S- 0 0 137 249,-0.1 -1,-0.3 1,-0.1 3,-0.1 0.313 124.0-104.7 -81.9 10.6 -11.8 13.8 2.9 17 17 A G S < S+ 0 0 10 -3,-2.6 -2,-0.1 1,-0.3 250,-0.1 0.322 74.4 142.0 85.2 -9.2 -8.2 13.6 4.2 18 18 A G - 0 0 23 1,-0.1 -4,-3.4 -5,-0.1 -1,-0.3 -0.355 65.0 -94.4 -59.8 145.7 -7.0 16.8 2.5 19 19 A V B -I 13 0B 8 -6,-0.2 2,-1.1 -3,-0.1 -6,-0.3 -0.471 31.5-135.5 -64.5 133.2 -4.6 18.8 4.7 20 20 A D > - 0 0 22 -8,-2.8 4,-2.1 1,-0.2 5,-0.2 -0.775 25.8-178.8 -92.6 89.3 -6.4 21.5 6.6 21 21 A W H > S+ 0 0 80 -2,-1.1 4,-2.3 1,-0.2 -1,-0.2 0.851 76.1 50.8 -63.3 -41.1 -4.1 24.5 6.1 22 22 A K H > S+ 0 0 146 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.910 111.9 47.5 -63.0 -45.1 -6.0 27.0 8.1 23 23 A S H > S+ 0 0 23 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.881 110.3 52.6 -66.6 -35.6 -6.2 24.8 11.1 24 24 A L H X S+ 0 0 1 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.947 108.6 50.8 -62.0 -47.8 -2.5 23.9 10.9 25 25 A E H X S+ 0 0 56 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.922 110.4 49.1 -55.2 -46.4 -1.7 27.6 10.9 26 26 A K H X S+ 0 0 115 -4,-2.2 4,-2.8 1,-0.2 -1,-0.2 0.912 108.3 53.3 -62.7 -45.2 -3.8 28.2 14.0 27 27 A L H X S+ 0 0 4 -4,-2.4 4,-2.8 2,-0.2 -1,-0.2 0.902 108.6 50.1 -52.8 -47.0 -2.2 25.3 15.9 28 28 A V H X S+ 0 0 0 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.921 112.5 45.8 -61.3 -46.5 1.3 26.6 15.2 29 29 A E H X S+ 0 0 56 -4,-2.0 4,-2.7 2,-0.2 -1,-0.2 0.911 112.8 52.0 -59.7 -44.3 0.3 30.1 16.5 30 30 A W H X S+ 0 0 61 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.922 109.4 49.3 -60.7 -43.5 -1.4 28.6 19.5 31 31 A H H X>S+ 0 0 0 -4,-2.8 5,-2.0 2,-0.2 4,-0.8 0.940 111.9 47.9 -62.2 -42.4 1.7 26.6 20.3 32 32 A I H ><5S+ 0 0 27 -4,-2.4 3,-0.9 1,-0.2 -2,-0.2 0.932 114.3 46.4 -65.0 -43.7 3.9 29.6 20.1 33 33 A E H 3<5S+ 0 0 130 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.851 110.3 54.0 -63.5 -38.0 1.6 31.6 22.2 34 34 A Q H 3<5S- 0 0 63 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.510 121.7 -97.4 -82.8 -6.7 1.2 28.8 24.8 35 35 A G T <<5 + 0 0 29 -3,-0.9 -30,-0.3 -4,-0.8 -3,-0.2 0.423 63.7 157.5 108.3 -0.8 5.0 28.3 25.4 36 36 A T < - 0 0 3 -5,-2.0 -1,-0.3 -6,-0.2 -30,-0.1 -0.346 30.3-153.4 -56.9 131.9 5.8 25.3 23.2 37 37 A N - 0 0 61 -32,-2.0 2,-0.3 1,-0.2 -31,-0.2 0.741 65.0 -1.6 -87.9 -25.2 9.6 25.5 22.6 38 38 A S E -b 6 0A 0 -33,-1.3 -31,-1.8 33,-0.1 2,-0.4 -0.979 60.7-135.4-159.5 157.3 9.9 23.7 19.3 39 39 A I E -bc 7 73A 0 33,-1.4 35,-2.9 -2,-0.3 2,-0.6 -0.992 5.9-150.7-121.3 130.3 7.7 21.9 16.7 40 40 A V E -bc 8 74A 0 -33,-3.4 -31,-1.2 -2,-0.4 3,-0.5 -0.896 22.0-149.9 -93.1 119.5 8.4 18.7 14.9 41 41 A A E - c 0 75A 0 33,-2.5 35,-3.4 -2,-0.6 60,-0.2 -0.739 69.4 -4.9 -93.5 135.0 6.8 18.8 11.5 42 42 A V S S+ 0 0 1 -2,-0.4 -1,-0.2 -33,-0.3 2,-0.1 0.924 88.3 145.9 47.5 54.7 5.5 15.6 9.9 43 43 A G S >S- 0 0 7 -3,-0.5 5,-1.7 -34,-0.5 6,-0.1 -0.158 73.8 -71.3 -91.2-160.4 6.9 13.2 12.5 44 44 A T T > 5S+ 0 0 10 1,-0.2 3,-1.9 2,-0.2 5,-0.2 0.921 140.1 50.7 -60.9 -45.0 5.0 10.0 13.4 45 45 A T T 3 5S+ 0 0 4 1,-0.3 -34,-0.5 2,-0.1 -1,-0.2 0.781 105.6 58.4 -65.5 -26.8 2.3 12.0 15.1 46 46 A G T 3 5S- 0 0 0 -36,-0.3 -1,-0.3 -3,-0.1 -2,-0.2 0.277 116.0-114.9 -86.7 10.9 2.1 14.2 12.0 47 47 A E T X>5 + 0 0 7 -3,-1.9 3,-1.0 1,-0.1 4,-0.7 0.895 50.1 169.0 55.1 46.5 1.2 11.1 9.8 48 48 A A G >4 - 0 0 38 -2,-0.4 4,-2.4 1,-0.1 5,-0.2 -0.101 28.9 -99.2 -63.5 168.4 3.1 12.5 -0.1 53 53 A M H > S+ 0 0 96 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.897 125.7 48.3 -55.4 -45.9 6.6 14.0 -0.8 54 54 A E H > S+ 0 0 133 2,-0.2 4,-3.0 1,-0.2 -1,-0.2 0.909 111.8 49.9 -61.0 -42.9 5.0 17.3 -2.0 55 55 A E H > S+ 0 0 25 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.841 105.1 56.9 -68.6 -35.3 2.8 17.4 1.1 56 56 A H H X S+ 0 0 14 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.961 112.7 43.1 -53.1 -53.1 5.8 16.7 3.4 57 57 A T H X S+ 0 0 39 -4,-1.9 4,-3.3 2,-0.2 -2,-0.2 0.935 113.5 50.1 -59.2 -51.8 7.4 19.9 1.8 58 58 A Q H X S+ 0 0 66 -4,-3.0 4,-3.0 1,-0.2 -1,-0.2 0.914 112.7 46.7 -55.8 -49.3 4.1 21.9 2.0 59 59 A V H X S+ 0 0 0 -4,-2.9 4,-2.2 2,-0.2 5,-0.2 0.922 114.8 46.1 -61.3 -45.9 3.6 21.1 5.6 60 60 A I H X S+ 0 0 2 -4,-2.5 4,-2.4 -5,-0.2 5,-0.2 0.951 114.8 48.8 -59.1 -48.2 7.3 21.9 6.5 61 61 A K H X S+ 0 0 118 -4,-3.3 4,-2.5 1,-0.2 -2,-0.2 0.914 111.8 48.4 -59.0 -47.7 7.1 25.1 4.5 62 62 A E H X S+ 0 0 47 -4,-3.0 4,-2.6 2,-0.2 -1,-0.2 0.843 111.5 48.4 -62.3 -39.3 3.8 26.2 6.1 63 63 A I H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.920 114.0 46.8 -71.9 -39.8 5.0 25.6 9.7 64 64 A I H X S+ 0 0 39 -4,-2.4 4,-2.1 -5,-0.2 5,-0.5 0.915 113.0 50.0 -62.9 -44.7 8.2 27.4 9.1 65 65 A R H < S+ 0 0 139 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.956 115.3 41.7 -58.9 -55.0 6.3 30.3 7.4 66 66 A V H < S+ 0 0 13 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.820 112.6 54.3 -64.8 -33.6 3.8 30.7 10.3 67 67 A A H >< S- 0 0 1 -4,-2.3 3,-1.8 -5,-0.2 -1,-0.2 0.863 83.4-165.8 -68.7 -38.7 6.5 30.2 12.9 68 68 A N T 3< - 0 0 124 -4,-2.1 -3,-0.1 1,-0.3 -4,-0.1 0.873 66.9 -59.2 55.7 42.3 8.5 33.1 11.4 69 69 A K T 3 S+ 0 0 206 -5,-0.5 -1,-0.3 2,-0.2 -2,-0.1 0.597 105.5 122.5 62.8 18.1 11.7 32.1 13.4 70 70 A R S < S+ 0 0 107 -3,-1.8 -2,-0.1 1,-0.2 -1,-0.1 0.819 84.8 10.6 -75.3 -27.7 10.1 32.5 16.8 71 71 A I S S- 0 0 23 -4,-0.1 -1,-0.2 -32,-0.0 -2,-0.2 -0.994 93.1 -93.8-148.0 145.4 10.9 28.9 17.7 72 72 A P - 0 0 41 0, 0.0 -33,-1.4 0, 0.0 2,-0.5 -0.271 34.9-146.6 -60.0 144.6 13.1 26.3 16.0 73 73 A I E -c 39 0A 3 23,-0.2 25,-2.8 -35,-0.2 26,-1.0 -0.962 7.6-160.8-115.5 124.4 11.3 23.9 13.6 74 74 A I E -cd 40 99A 1 -35,-2.9 -33,-2.5 -2,-0.5 2,-0.5 -0.920 12.0-143.7-107.7 123.7 12.5 20.3 13.3 75 75 A A E -cd 41 100A 0 24,-2.8 26,-3.0 -2,-0.5 2,-0.5 -0.734 9.8-132.3 -92.0 128.7 11.4 18.4 10.2 76 76 A G E + d 0 101A 5 -35,-3.4 26,-0.2 -2,-0.5 -16,-0.1 -0.656 38.5 159.5 -71.6 122.8 10.6 14.7 10.3 77 77 A T + 0 0 0 24,-2.7 12,-0.3 -2,-0.5 11,-0.2 0.102 17.0 143.8-135.9 21.5 12.5 13.2 7.3 78 78 A G + 0 0 20 23,-0.7 2,-0.3 10,-0.1 26,-0.1 -0.160 15.2 162.6 -64.8 155.1 12.8 9.5 8.2 79 79 A A - 0 0 0 24,-0.5 6,-0.1 9,-0.0 -2,-0.1 -0.947 45.2-126.5-163.5 157.6 12.6 6.7 5.6 80 80 A N S S+ 0 0 8 -2,-0.3 2,-0.4 25,-0.2 3,-0.1 0.396 96.9 73.5 -93.7 3.8 13.5 3.1 5.5 81 81 A S S > S- 0 0 1 1,-0.1 4,-2.3 480,-0.1 5,-0.2 -0.971 74.3-148.6-111.0 130.0 15.6 3.8 2.4 82 82 A T H > S+ 0 0 6 478,-1.2 4,-1.9 -2,-0.4 5,-0.1 0.898 99.8 52.4 -64.4 -40.8 18.9 5.6 2.9 83 83 A R H > S+ 0 0 98 477,-0.4 4,-2.0 1,-0.2 -1,-0.2 0.932 112.0 45.4 -57.9 -47.1 18.7 7.3 -0.5 84 84 A E H > S+ 0 0 66 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.877 108.8 55.7 -68.6 -39.4 15.1 8.5 0.3 85 85 A A H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.877 107.6 51.0 -56.3 -40.7 16.1 9.7 3.8 86 86 A I H X S+ 0 0 30 -4,-1.9 4,-2.8 2,-0.2 -2,-0.2 0.949 110.0 48.7 -63.4 -48.5 18.8 11.9 2.1 87 87 A E H X S+ 0 0 85 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.916 113.6 45.4 -60.0 -47.8 16.4 13.4 -0.4 88 88 A L H X S+ 0 0 8 -4,-2.6 4,-2.4 -11,-0.2 -1,-0.2 0.901 114.1 49.5 -61.0 -41.9 13.8 14.3 2.3 89 89 A T H X S+ 0 0 0 -4,-2.2 4,-2.5 -12,-0.3 -2,-0.2 0.893 110.0 50.9 -69.2 -37.7 16.6 15.7 4.6 90 90 A K H X S+ 0 0 99 -4,-2.8 4,-2.7 2,-0.2 -1,-0.2 0.915 110.3 49.6 -62.5 -44.6 18.0 17.8 1.8 91 91 A A H X S+ 0 0 29 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.926 110.1 51.3 -61.1 -43.3 14.6 19.2 1.1 92 92 A A H X>S+ 0 0 3 -4,-2.4 5,-2.5 2,-0.2 4,-0.7 0.923 110.4 48.4 -60.9 -44.7 14.1 20.0 4.7 93 93 A K H ><5S+ 0 0 82 -4,-2.5 3,-1.6 1,-0.2 -2,-0.2 0.952 110.3 52.5 -56.0 -52.0 17.4 21.8 4.8 94 94 A D H 3<5S+ 0 0 129 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.798 105.6 54.8 -55.1 -33.0 16.4 23.7 1.7 95 95 A L H 3<5S- 0 0 44 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.2 0.589 122.5-104.5 -79.5 -10.4 13.2 24.8 3.3 96 96 A G T <<5 + 0 0 42 -3,-1.6 -23,-0.2 -4,-0.7 -3,-0.2 0.663 57.7 168.6 96.6 19.9 15.0 26.3 6.3 97 97 A A < - 0 0 8 -5,-2.5 -1,-0.2 -6,-0.2 -23,-0.2 -0.342 34.8-139.8 -60.3 149.8 14.3 23.6 8.8 98 98 A D S S- 0 0 81 -25,-2.8 2,-0.3 1,-0.3 -24,-0.2 0.726 77.9 -16.4 -83.3 -23.3 16.5 24.0 11.9 99 99 A A E -d 74 0A 3 -26,-1.0 -24,-2.8 29,-0.1 2,-0.4 -0.955 66.5-117.8-167.5 171.3 17.1 20.3 12.2 100 100 A A E -de 75 130A 0 29,-2.3 31,-2.5 -2,-0.3 2,-0.5 -0.938 11.9-146.3-124.6 143.8 15.7 16.9 11.0 101 101 A L E -de 76 131A 4 -26,-3.0 -24,-2.7 -2,-0.4 -23,-0.7 -0.955 18.6-172.3-108.8 123.1 14.2 14.1 12.9 102 102 A L E - e 0 132A 0 29,-2.9 31,-1.1 -2,-0.5 -26,-0.1 -0.885 11.7-151.4-126.9 103.3 15.0 10.6 11.4 103 103 A V E - e 0 133A 7 -2,-0.6 -24,-0.5 29,-0.2 31,-0.2 -0.309 39.5 -93.8 -58.9 147.5 13.4 7.5 12.8 104 104 A T - 0 0 0 29,-2.3 -1,-0.1 1,-0.1 37,-0.1 -0.446 59.1 -81.8 -60.3 142.0 15.5 4.3 12.3 105 105 A P - 0 0 0 0, 0.0 2,-0.2 0, 0.0 -25,-0.2 -0.189 56.6-148.0 -42.9 130.6 14.5 2.6 9.1 106 106 A Y + 0 0 25 -3,-0.1 2,-2.6 2,-0.1 34,-0.2 -0.653 62.5 11.6-105.7 162.0 11.4 0.5 9.9 107 107 A Y S S+ 0 0 9 32,-1.8 -1,-0.1 323,-0.7 325,-0.1 -0.206 112.5 69.9 71.0 -51.0 10.2 -2.8 8.5 108 108 A N S S- 0 0 8 -2,-2.6 -1,-0.2 323,-0.0 -2,-0.1 0.516 89.7-144.7 -81.2 -2.1 13.4 -3.8 6.7 109 109 A K - 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0 0 34 -25,-0.3 4,-1.1 1,-0.1 3,-1.1 -0.829 60.0-166.4-130.6 95.1 8.1 -19.2 7.7 480 188 B D H >> S+ 0 0 4 -2,-0.4 3,-0.7 1,-0.3 4,-0.6 0.836 85.8 62.7 -47.4 -45.7 10.4 -21.6 6.0 481 189 B E H 34 S+ 0 0 104 51,-0.3 -1,-0.3 1,-0.2 3,-0.2 0.866 120.6 22.1 -46.6 -47.0 11.3 -23.4 9.3 482 190 B T H X> S+ 0 0 19 -3,-1.1 4,-2.0 1,-0.1 3,-0.6 0.357 92.9 104.3-106.5 4.7 7.6 -24.5 9.8 483 191 B A H S+ 0 0 67 -3,-0.6 4,-1.7 2,-0.2 -2,-0.2 0.935 110.8 50.5 -65.7 -48.4 4.1 -28.5 8.7 486 194 B L H <>S+ 0 0 6 -4,-2.0 5,-2.4 1,-0.2 -2,-0.2 0.872 111.9 48.2 -59.6 -39.0 1.6 -25.8 7.7 487 195 B M H ><5S+ 0 0 0 -4,-2.5 3,-1.3 3,-0.2 -1,-0.2 0.872 108.4 52.4 -72.2 -36.7 1.3 -27.4 4.2 488 196 B L H 3<5S+ 0 0 29 -4,-1.9 -1,-0.2 -5,-0.3 -2,-0.2 0.809 109.2 53.8 -64.0 -26.9 0.8 -30.8 5.7 489 197 B L T 3<5S- 0 0 64 -4,-1.7 -1,-0.2 -5,-0.1 -2,-0.2 0.382 138.0 -79.5 -89.6 4.1 -2.0 -29.0 7.7 490 198 B G T < 5S+ 0 0 33 -3,-1.3 -15,-0.3 1,-0.3 -3,-0.2 0.493 78.2 145.8 118.0 3.6 -3.7 -27.6 4.6 491 199 B A < - 0 0 2 -5,-2.4 -1,-0.3 -6,-0.1 -15,-0.2 -0.485 48.2-133.5 -70.8 150.4 -1.7 -24.5 3.5 492 200 B D - 0 0 35 -17,-2.4 -196,-2.5 -2,-0.1 2,-0.3 0.586 68.1 -45.6 -82.6 -14.3 -1.5 -24.0 -0.3 493 201 B G E -jq 296 476C 0 -18,-0.7 -16,-2.4 -198,-0.3 2,-0.4 -0.987 57.1 -84.7 173.4-167.3 2.2 -23.3 -0.4 494 202 B N E -jq 297 477C 0 -198,-2.1 -196,-2.7 -2,-0.3 2,-1.1 -0.982 16.9-151.8-133.9 117.6 5.2 -21.6 0.9 495 203 B I E -j 298 0C 6 -18,-2.7 2,-0.3 -2,-0.4 -196,-0.2 -0.818 46.9-159.6 -90.4 102.0 6.2 -18.1 -0.0 496 204 B S E -j 299 0C 0 -198,-2.4 -196,-2.4 -2,-1.1 4,-0.1 -0.670 50.6-176.3-111.8 142.0 9.8 -19.0 0.6 497 205 B V S > S+ 0 0 12 -2,-0.3 3,-2.3 -198,-0.2 4,-0.3 0.866 96.7 54.6 -85.5 -49.0 13.2 -17.5 1.3 498 206 B T G >> S+ 0 0 0 1,-0.3 3,-2.2 2,-0.2 4,-2.1 0.845 93.7 70.9 -54.5 -33.5 15.1 -20.8 1.2 499 207 B A G 34 S+ 0 0 0 1,-0.3 -1,-0.3 2,-0.2 -2,-0.1 0.738 83.1 74.2 -59.1 -21.9 13.7 -21.5 -2.3 500 208 B N G <4 S+ 0 0 0 -3,-2.3 -1,-0.3 1,-0.2 -2,-0.2 0.809 114.7 18.8 -54.8 -35.2 16.0 -18.8 -3.5 501 209 B I T <4 S+ 0 0 3 -3,-2.2 -2,-0.2 -4,-0.3 -1,-0.2 0.568 135.5 38.1-115.5 -17.6 19.0 -21.1 -3.1 502 210 B A X + 0 0 8 -4,-2.1 4,-2.4 1,-0.1 5,-0.2 -0.491 66.7 150.9-129.1 61.3 17.3 -24.5 -3.0 503 211 B P H > S+ 0 0 3 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.924 73.5 46.8 -65.2 -42.4 14.5 -24.2 -5.6 504 212 B K H > S+ 0 0 96 1,-0.2 4,-1.7 2,-0.2 5,-0.2 0.962 115.3 46.5 -61.6 -50.4 14.4 -27.9 -6.6 505 213 B A H > S+ 0 0 27 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.860 114.3 46.3 -59.7 -42.1 14.4 -29.1 -3.0 506 214 B M H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 5,-0.2 0.882 108.8 55.7 -73.0 -36.6 11.8 -26.7 -1.9 507 215 B S H X S+ 0 0 20 -4,-2.6 4,-2.0 -5,-0.2 -1,-0.2 0.860 111.5 46.1 -58.1 -34.0 9.6 -27.5 -4.9 508 216 B E H X S+ 0 0 85 -4,-1.7 4,-2.3 2,-0.2 5,-0.3 0.901 109.9 52.0 -78.8 -40.2 9.8 -31.1 -3.8 509 217 B V H X S+ 0 0 0 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.888 112.7 45.7 -60.8 -43.0 9.0 -30.3 -0.2 510 218 B C H X S+ 0 0 0 -4,-2.4 4,-2.8 2,-0.2 5,-0.3 0.933 110.8 53.4 -66.4 -46.3 5.9 -28.4 -1.1 511 219 B A H X S+ 0 0 61 -4,-2.0 4,-2.0 -5,-0.2 -2,-0.2 0.943 114.7 40.1 -53.2 -48.5 4.7 -31.0 -3.6 512 220 B V H <>S+ 0 0 19 -4,-2.3 5,-2.6 1,-0.2 9,-0.2 0.872 115.3 51.3 -73.9 -33.3 4.9 -33.8 -1.0 513 221 B A H ><5S+ 0 0 0 -4,-2.0 3,-1.2 -5,-0.3 -1,-0.2 0.898 110.7 48.4 -68.3 -39.5 3.6 -31.7 1.9 514 222 B I H 3<5S+ 0 0 49 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.890 107.4 56.3 -65.9 -36.7 0.6 -30.6 -0.3 515 223 B A T 3<5S- 0 0 74 -4,-2.0 -1,-0.3 -5,-0.3 -2,-0.2 0.510 116.5-121.6 -70.8 -6.1 0.1 -34.3 -1.1 516 224 B K T < 5 + 0 0 100 -3,-1.2 2,-1.4 1,-0.2 -3,-0.2 0.720 60.4 150.5 70.2 26.1 -0.1 -34.8 2.7 517 225 B D >< - 0 0 60 -5,-2.6 4,-2.3 1,-0.2 -1,-0.2 -0.703 22.1-176.8 -89.1 87.2 2.8 -37.3 2.6 518 226 B E H > S+ 0 0 105 -2,-1.4 4,-2.4 1,-0.2 -1,-0.2 0.859 76.6 48.0 -53.7 -43.9 4.0 -36.5 6.2 519 227 B Q H > S+ 0 0 113 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.934 112.5 46.7 -70.0 -44.0 7.1 -38.8 6.1 520 228 B Q H > S+ 0 0 99 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.900 112.6 52.6 -59.8 -38.0 8.3 -37.6 2.7 521 229 B A H X S+ 0 0 0 -4,-2.3 4,-2.3 -9,-0.2 5,-0.3 0.939 110.7 46.1 -65.8 -48.4 7.8 -34.0 3.9 522 230 B K H X S+ 0 0 83 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.911 115.8 47.1 -54.5 -46.8 9.8 -34.6 7.1 523 231 B T H X S+ 0 0 68 -4,-2.5 4,-1.3 2,-0.2 -2,-0.2 0.929 115.4 41.1 -68.1 -50.8 12.6 -36.3 5.2 524 232 B L H < S+ 0 0 40 -4,-2.7 4,-0.5 1,-0.2 -1,-0.2 0.868 117.3 49.5 -65.3 -39.5 13.0 -33.9 2.3 525 233 B N H >X S+ 0 0 11 -4,-2.3 3,-2.0 -5,-0.3 4,-0.8 0.915 102.8 62.0 -65.8 -42.5 12.7 -30.8 4.7 526 234 B N H >< S+ 0 0 124 -4,-2.4 3,-1.0 1,-0.3 4,-0.4 0.875 96.1 59.9 -49.0 -44.6 15.2 -32.3 7.1 527 235 B K T 3< S+ 0 0 147 -4,-1.3 -1,-0.3 1,-0.2 -2,-0.2 0.723 119.5 27.3 -57.1 -26.3 17.9 -32.1 4.3 528 236 B I T X> S+ 0 0 8 -3,-2.0 4,-1.3 -4,-0.5 3,-0.8 0.262 88.2 109.1-120.3 11.2 17.4 -28.3 4.1 529 237 B A T << S+ 0 0 24 -3,-1.0 4,-0.5 -4,-0.8 -2,-0.1 0.819 75.9 55.5 -59.3 -36.9 16.3 -27.5 7.6 530 238 B N T >> S+ 0 0 115 -4,-0.4 4,-2.8 1,-0.2 3,-0.6 0.792 101.5 58.7 -71.0 -27.2 19.5 -25.8 8.6 531 239 B L H <> S+ 0 0 2 -3,-0.8 4,-2.0 1,-0.3 -1,-0.2 0.914 97.3 59.3 -68.0 -39.4 19.2 -23.4 5.7 532 240 B H H 3< S+ 0 0 5 -4,-1.3 -51,-0.3 1,-0.2 -1,-0.3 0.738 114.7 39.9 -55.6 -24.7 15.9 -22.2 7.0 533 241 B N H X4 S+ 0 0 81 -3,-0.6 3,-1.6 -4,-0.5 -2,-0.2 0.906 113.6 47.2 -91.0 -52.8 17.9 -21.2 10.1 534 242 B I H >< S+ 0 0 38 -4,-2.8 3,-1.6 1,-0.3 4,-0.2 0.723 99.0 70.5 -63.9 -26.5 21.2 -19.8 8.8 535 243 B L T 3< S+ 0 0 0 -4,-2.0 9,-0.5 1,-0.3 -1,-0.3 0.513 102.5 45.6 -71.0 -4.9 19.4 -17.6 6.2 536 244 B F T < S+ 0 0 91 -3,-1.6 -1,-0.3 -5,-0.1 -2,-0.2 0.024 70.6 114.7-123.1 22.9 18.1 -15.5 9.1 537 245 B C S < S+ 0 0 39 -3,-1.6 2,-0.3 2,-0.1 -2,-0.1 0.824 97.8 15.1 -62.9 -30.0 21.4 -15.2 11.0 538 246 B E S S- 0 0 32 -4,-0.2 -1,-0.1 -3,-0.1 27,-0.1 -0.893 122.0 -60.5-130.1 165.0 21.0 -11.5 10.1 539 247 B S S > S- 0 0 31 -2,-0.3 3,-2.7 -430,-0.3 -428,-0.1 -0.180 76.2 -80.9 -50.8 123.6 17.8 -9.9 8.8 540 248 B N T 3 S+ 0 0 10 1,-0.3 -1,-0.1 2,-0.2 -4,-0.1 -0.409 114.2 31.3 -55.3 137.6 16.6 -11.4 5.5 541 249 B P T 3> S+ 0 0 1 0, 0.0 4,-2.2 0, 0.0 -1,-0.3 -0.872 103.4 79.9 -96.6 26.9 17.5 -10.8 2.7 542 250 B I H <> S+ 0 0 2 -3,-2.7 4,-1.8 1,-0.2 23,-0.5 0.970 101.1 37.1 -57.7 -58.2 21.0 -10.1 4.0 543 251 B P H > S+ 0 0 0 0, 0.0 4,-3.0 0, 0.0 -1,-0.2 0.907 115.0 54.2 -61.9 -41.8 22.1 -13.8 4.3 544 252 B V H > S+ 0 0 0 -9,-0.5 4,-2.3 1,-0.2 -2,-0.2 0.865 107.3 49.8 -65.9 -35.9 20.3 -15.1 1.2 545 253 B K H X S+ 0 0 11 -4,-2.2 4,-1.5 2,-0.2 -1,-0.2 0.923 112.6 48.1 -64.0 -41.8 21.9 -12.5 -1.1 546 254 B W H X S+ 0 0 19 -4,-1.8 4,-2.5 -5,-0.3 -2,-0.2 0.924 108.7 54.6 -62.4 -42.8 25.3 -13.5 0.3 547 255 B A H X S+ 0 0 0 -4,-3.0 4,-0.6 1,-0.2 -2,-0.2 0.938 108.1 48.6 -55.8 -47.6 24.4 -17.2 -0.2 548 256 B L H <>S+ 0 0 0 -4,-2.3 5,-2.5 1,-0.2 6,-0.8 0.800 109.0 54.1 -63.4 -28.9 23.6 -16.6 -3.9 549 257 B H H ><5S+ 0 0 61 -4,-1.5 3,-1.9 1,-0.2 -1,-0.2 0.916 104.6 52.9 -71.4 -41.3 26.9 -14.7 -4.3 550 258 B E H 3<5S+ 0 0 50 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.636 106.7 55.1 -63.0 -14.5 28.7 -17.7 -2.9 551 259 B M T 3<5S- 0 0 40 -4,-0.6 -1,-0.3 -3,-0.3 -2,-0.2 0.322 116.1-118.6 -99.1 -0.5 26.9 -19.8 -5.6 552 260 B G T < 5S+ 0 0 67 -3,-1.9 -3,-0.2 2,-0.2 -2,-0.1 0.664 83.7 115.4 71.2 18.7 28.3 -17.4 -8.2 553 261 B L S - 0 0 36 -2,-0.3 3,-2.1 4,-0.1 -217,-0.1 -0.661 40.1 -80.7 -95.9 132.8 21.0 -1.2 -0.7 560 268 B L T 3 S+ 0 0 63 -2,-0.4 -478,-1.2 1,-0.4 -477,-0.4 -0.265 113.6 41.9 -54.6 143.3 21.5 0.8 2.5 561 269 B P T 3 S+ 0 0 0 0, 0.0 -450,-0.4 0, 0.0 -1,-0.4 -0.992 114.6 69.1 -78.7 0.2 20.3 0.6 5.2 562 270 B L S < S- 0 0 5 -3,-2.1 -4,-0.1 -452,-0.1 -453,-0.1 -0.510 72.3-159.9 -75.5 155.1 20.8 -3.1 4.5 563 271 B T - 0 0 18 -2,-0.1 3,-0.1 -3,-0.1 -4,-0.1 -0.932 27.1 -86.6-134.3 154.8 24.4 -4.3 4.4 564 272 B P - 0 0 60 0, 0.0 3,-0.1 0, 0.0 -22,-0.1 -0.309 69.7 -75.4 -59.1 145.5 26.4 -7.3 2.9 565 273 B L - 0 0 0 -23,-0.5 5,-0.1 1,-0.1 -27,-0.0 -0.167 62.1 -98.8 -45.7 129.0 26.4 -10.3 5.3 566 274 B A > - 0 0 25 -3,-0.1 3,-2.6 1,-0.1 4,-0.4 -0.256 33.2-111.6 -57.3 135.1 28.9 -9.5 8.1 567 275 B E G > S+ 0 0 158 1,-0.3 3,-1.3 2,-0.2 4,-0.5 0.743 111.8 59.8 -32.2 -43.2 32.2 -11.1 7.5 568 276 B Q G 3 S+ 0 0 134 1,-0.3 -1,-0.3 2,-0.2 -2,-0.1 0.607 102.4 52.4 -75.0 -16.1 31.9 -13.6 10.4 569 277 B Y G <> S+ 0 0 74 -3,-2.6 4,-1.7 2,-0.1 -1,-0.3 0.478 89.1 81.7 -94.5 -6.6 28.8 -15.3 9.1 570 278 B R H <> S+ 0 0 57 -3,-1.3 4,-2.2 -4,-0.4 -2,-0.2 0.928 92.2 43.7 -70.8 -46.1 30.3 -16.0 5.7 571 279 B E H > S+ 0 0 86 -4,-0.5 4,-2.2 2,-0.2 -1,-0.2 0.925 113.6 50.4 -65.3 -49.8 32.2 -19.2 6.5 572 280 B P H > S+ 0 0 55 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.866 112.3 49.7 -55.3 -36.3 29.3 -20.7 8.6 573 281 B L H X S+ 0 0 0 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.917 108.9 50.1 -68.3 -45.5 27.0 -20.0 5.6 574 282 B R H X S+ 0 0 70 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.870 110.9 51.6 -60.3 -35.2 29.4 -21.6 3.1 575 283 B N H X S+ 0 0 70 -4,-2.2 4,-2.8 2,-0.2 -1,-0.2 0.867 108.7 49.2 -67.2 -41.0 29.6 -24.6 5.4 576 284 B A H X S+ 0 0 16 -4,-1.7 4,-2.4 2,-0.2 -2,-0.2 0.852 111.5 50.1 -65.4 -39.1 25.7 -24.9 5.6 577 285 B L H <>S+ 0 0 0 -4,-2.2 5,-2.7 2,-0.2 6,-0.9 0.893 112.3 46.7 -65.5 -42.7 25.6 -24.6 1.8 578 286 B K H ><5S+ 0 0 112 -4,-2.1 3,-1.1 3,-0.2 -2,-0.2 0.938 111.9 51.0 -65.3 -47.5 28.2 -27.4 1.4 579 287 B D H 3<5S+ 0 0 134 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.925 111.1 47.4 -51.8 -52.0 26.4 -29.6 4.0 580 288 B A T 3<5S- 0 0 35 -4,-2.4 -1,-0.3 -5,-0.1 -2,-0.2 0.546 115.6-119.0 -68.3 -9.7 23.1 -29.2 2.1 581 289 B G T < 5S+ 0 0 59 -3,-1.1 -3,-0.2 -4,-0.4 -2,-0.1 0.692 78.4 126.0 77.6 20.7 24.9 -30.0 -1.1 582 290 B I < 0 0 41 -5,-2.7 -4,-0.2 -6,-0.2 -5,-0.1 0.905 360.0 360.0 -76.7 -41.8 24.1 -26.6 -2.7 583 291 B I 0 0 99 -6,-0.9 -2,-0.2 -9,-0.2 -1,-0.1 -0.835 360.0 360.0-124.8 360.0 27.8 -25.9 -3.4