==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 02-MAR-05 1Z0Z . COMPND 2 MOLECULE: PROBABLE INORGANIC POLYPHOSPHATE/ATP-NAD KINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ARCHAEOGLOBUS FULGIDUS; . AUTHOR J.LIU,Y.LOU,H.YOKOTA,P.D.ADAMS,R.KIM,S.H.KIM,BERKELEY . 996 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 40668.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 688 69.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 96 9.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 236 23.7 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 . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 0.6 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 . 81 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 93 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 137 13.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 13 1.3 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 1 0 0 3 5 4 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 8 5 0 1 10 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 4 6 9 11 3 3 0 0 3 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 1 0 1 1 3 1 1 0 2 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 M 0 0 105 0, 0.0 25,-1.1 0, 0.0 2,-0.2 0.000 360.0 360.0 360.0 122.0 99.7 1.3 59.2 2 2 A R E -a 26 0A 66 23,-0.2 40,-1.3 37,-0.1 39,-1.2 -0.475 360.0-179.3 -86.4 145.5 101.5 4.6 59.4 3 3 A A E -ab 27 42A 0 23,-2.0 25,-1.3 38,-0.2 2,-0.4 -0.999 14.5-147.7-145.4 140.2 102.9 6.3 62.5 4 4 A A E -ab 28 43A 0 38,-1.9 40,-3.4 -2,-0.3 2,-0.5 -0.861 4.8-156.2-110.4 141.9 104.7 9.6 63.2 5 5 A V E -ab 29 44A 1 23,-2.1 25,-1.8 -2,-0.4 2,-0.4 -0.956 10.5-168.8-121.0 111.6 107.3 10.2 66.0 6 6 A V E +ab 30 45A 2 38,-1.2 40,-1.9 -2,-0.5 2,-0.3 -0.827 11.8 178.6-101.2 139.1 107.7 13.8 67.2 7 7 A Y E - b 0 46A 36 23,-1.8 40,-0.2 -2,-0.4 3,-0.1 -0.999 38.8-150.5-146.9 141.0 110.7 14.7 69.4 8 8 A K S S- 0 0 137 38,-1.4 2,-0.2 -2,-0.3 -1,-0.1 0.927 90.6 -11.8 -63.4 -51.0 112.3 17.7 71.2 9 9 A T S S- 0 0 98 37,-0.3 3,-0.3 0, 0.0 4,-0.2 -0.846 83.8 -81.7-144.3 177.9 115.8 16.0 71.0 10 10 A D S > S+ 0 0 132 -2,-0.2 3,-0.7 1,-0.2 4,-0.5 0.470 77.8 131.7 -64.6 -3.1 117.5 12.6 70.1 11 11 A G T 3 S- 0 0 52 1,-0.2 -1,-0.2 2,-0.1 3,-0.1 0.643 87.3 -20.7 -17.6 -78.2 116.8 11.3 73.6 12 12 A H T >> S+ 0 0 59 -3,-0.3 4,-1.2 1,-0.1 3,-0.9 0.173 95.5 121.1-129.4 13.9 115.3 7.8 73.1 13 13 A V H <> + 0 0 9 -3,-0.7 4,-1.8 1,-0.3 -2,-0.1 0.707 68.0 63.1 -64.9 -23.4 114.0 8.0 69.5 14 14 A K H 3> S+ 0 0 132 -4,-0.5 4,-1.3 1,-0.2 -1,-0.3 0.900 104.3 45.3 -68.4 -43.2 116.2 5.1 68.3 15 15 A R H <> S+ 0 0 105 -3,-0.9 4,-0.9 2,-0.2 -1,-0.2 0.801 112.3 51.9 -71.6 -29.6 114.5 2.5 70.5 16 16 A I H X S+ 0 0 0 -4,-1.2 4,-2.2 2,-0.2 5,-0.2 0.853 106.5 54.7 -72.0 -36.7 111.0 3.8 69.6 17 17 A E H X S+ 0 0 51 -4,-1.8 4,-1.0 1,-0.2 -2,-0.2 0.853 114.7 39.7 -58.7 -38.6 112.0 3.5 65.9 18 18 A E H X S+ 0 0 101 -4,-1.3 4,-1.2 2,-0.2 -1,-0.2 0.595 110.8 59.6 -89.3 -14.5 112.8 -0.2 66.6 19 19 A A H X S+ 0 0 0 -4,-0.9 4,-0.6 2,-0.2 -2,-0.2 0.866 110.8 40.2 -77.9 -41.5 109.8 -0.6 68.9 20 20 A L H <>S+ 0 0 0 -4,-2.2 5,-0.8 2,-0.2 3,-0.3 0.785 110.4 59.4 -75.9 -31.4 107.4 0.3 66.1 21 21 A K H ><5S+ 0 0 134 -4,-1.0 3,-1.5 -5,-0.2 -2,-0.2 0.914 101.9 54.2 -64.6 -41.2 109.4 -1.7 63.5 22 22 A R H 3<5S+ 0 0 132 -4,-1.2 -1,-0.2 1,-0.3 -2,-0.2 0.799 107.0 53.4 -59.1 -29.3 108.9 -4.8 65.6 23 23 A L T 3<5S- 0 0 30 -4,-0.6 -1,-0.3 -3,-0.3 -2,-0.2 0.234 118.7-104.7 -96.3 13.6 105.1 -4.2 65.5 24 24 A E T < 5S+ 0 0 176 -3,-1.5 2,-0.4 1,-0.2 -3,-0.2 0.987 71.2 141.8 62.8 64.0 104.7 -3.9 61.6 25 25 A V < - 0 0 15 -5,-0.8 2,-0.2 -4,-0.1 -1,-0.2 -0.996 51.9-126.0-140.7 127.4 104.3 -0.1 61.5 26 26 A E E -a 2 0A 115 -25,-1.1 -23,-2.0 -2,-0.4 2,-0.4 -0.546 34.1-155.5 -70.5 137.7 105.7 2.4 58.9 27 27 A V E +a 3 0A 44 -2,-0.2 2,-0.3 -25,-0.2 -23,-0.2 -0.957 19.7 178.6-126.8 137.0 107.6 5.2 60.7 28 28 A E E -a 4 0A 89 -25,-1.3 -23,-2.1 -2,-0.4 2,-0.3 -0.989 24.3-129.9-132.2 144.1 108.5 8.8 59.8 29 29 A L E -a 5 0A 71 -2,-0.3 2,-0.3 -25,-0.2 -23,-0.2 -0.682 17.6-169.8-100.4 149.9 110.5 11.3 62.0 30 30 A F E +a 6 0A 24 -25,-1.8 -23,-1.8 -2,-0.3 -2,-0.0 -0.878 17.5 179.7-145.0 102.4 109.5 14.9 63.0 31 31 A N S S+ 0 0 113 -2,-0.3 -1,-0.1 -25,-0.2 -24,-0.1 0.954 87.2 22.8 -63.7 -49.0 111.8 17.4 64.7 32 32 A Q S S- 0 0 139 -26,-0.1 2,-0.2 23,-0.0 -1,-0.1 -0.860 94.2-105.3-115.7 152.2 109.0 20.0 64.6 33 33 A P + 0 0 31 0, 0.0 2,-0.3 0, 0.0 -2,-0.0 -0.535 40.5 179.8 -76.0 141.5 105.2 19.4 64.3 34 34 A S > - 0 0 38 -2,-0.2 3,-1.4 24,-0.0 24,-0.1 -0.843 45.4-104.1-133.5 171.9 103.5 20.0 61.0 35 35 A E G > S+ 0 0 127 1,-0.3 3,-1.0 -2,-0.3 25,-0.1 0.565 110.9 79.2 -74.9 -9.1 100.0 19.8 59.5 36 36 A E G > + 0 0 118 1,-0.2 3,-1.5 2,-0.1 -1,-0.3 0.520 67.9 87.7 -70.1 -10.0 101.2 16.6 57.7 37 37 A L G X S+ 0 0 0 -3,-1.4 3,-1.1 1,-0.3 -1,-0.2 0.760 74.9 67.4 -66.8 -21.6 100.8 14.8 61.0 38 38 A E G < S+ 0 0 39 -3,-1.0 -1,-0.3 1,-0.2 -2,-0.1 0.178 83.2 73.6 -88.6 22.5 97.2 14.0 60.1 39 39 A N G < S+ 0 0 110 -3,-1.5 2,-0.3 3,-0.1 -1,-0.2 0.236 88.1 80.3-103.5 8.8 98.3 11.8 57.2 40 40 A F S < S- 0 0 9 -3,-1.1 -37,-0.2 1,-0.1 3,-0.1 -0.876 79.2-131.4-119.9 149.9 99.3 9.1 59.8 41 41 A D S S- 0 0 77 -39,-1.2 2,-0.3 -2,-0.3 -38,-0.2 0.865 88.7 -1.1 -68.2 -39.8 97.2 6.6 61.7 42 42 A F E -b 3 0A 0 -40,-1.3 -38,-1.9 21,-0.2 2,-0.4 -0.920 63.4-136.0-144.8 175.9 98.8 7.5 65.0 43 43 A I E -bc 4 65A 0 21,-2.2 23,-3.2 -2,-0.3 2,-0.6 -0.999 2.7-158.7-137.1 132.2 101.4 9.8 66.6 44 44 A V E -bc 5 66A 0 -40,-3.4 -38,-1.2 -2,-0.4 2,-0.3 -0.891 17.2-162.0-117.3 97.7 104.0 9.0 69.3 45 45 A S E -bc 6 67A 0 21,-2.5 23,-2.2 -2,-0.6 2,-0.5 -0.609 2.4-163.6 -82.8 140.0 105.0 12.3 70.9 46 46 A V E +bc 7 68A 4 -40,-1.9 -38,-1.4 -2,-0.3 -37,-0.3 -0.921 61.8 45.3-134.4 103.1 108.3 12.3 72.9 47 47 A G E S- c 0 69A 10 21,-1.7 24,-1.1 -2,-0.5 23,-0.7 -0.122 98.1 -80.8 164.8 -52.0 109.1 15.0 75.4 48 48 A G > - 0 0 9 20,-0.3 4,-1.5 21,-0.2 26,-0.1 -0.957 63.3 -42.9 153.0-173.2 106.2 15.7 77.6 49 49 A D H > S+ 0 0 43 24,-0.4 4,-1.8 -2,-0.3 3,-0.2 0.885 129.6 55.2 -53.0 -46.8 102.9 17.6 78.0 50 50 A G H > S+ 0 0 25 1,-0.2 4,-1.6 2,-0.2 3,-0.3 0.927 105.0 52.7 -54.0 -49.3 104.3 20.7 76.4 51 51 A T H > S+ 0 0 8 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.846 107.3 53.0 -54.7 -38.3 105.3 18.6 73.3 52 52 A I H X S+ 0 0 0 -4,-1.5 4,-2.1 -3,-0.2 -1,-0.2 0.870 105.8 52.6 -68.5 -37.0 101.7 17.3 73.0 53 53 A L H X S+ 0 0 15 -4,-1.8 4,-1.1 -3,-0.3 -1,-0.2 0.869 107.1 52.1 -68.9 -34.9 100.2 20.8 73.1 54 54 A R H < S+ 0 0 115 -4,-1.6 4,-0.2 2,-0.2 -1,-0.2 0.735 109.1 52.1 -71.4 -25.6 102.4 21.9 70.2 55 55 A I H >< S+ 0 0 0 -4,-1.0 3,-2.0 -3,-0.2 -2,-0.2 0.934 105.3 52.5 -72.2 -51.3 101.3 18.9 68.2 56 56 A L H >< S+ 0 0 1 -4,-2.1 3,-1.6 1,-0.3 -2,-0.2 0.763 98.4 66.9 -56.7 -30.3 97.7 19.6 68.6 57 57 A Q T 3< S+ 0 0 29 -4,-1.1 -1,-0.3 1,-0.3 -2,-0.2 0.674 102.4 47.1 -66.5 -19.4 98.2 23.1 67.3 58 58 A K T < S+ 0 0 65 -3,-2.0 2,-0.4 -4,-0.2 -1,-0.3 0.243 106.2 79.9-101.9 14.2 99.1 21.7 63.9 59 59 A L < + 0 0 6 -3,-1.6 3,-0.2 1,-0.1 53,-0.2 -0.973 30.7 157.6-129.0 125.3 96.0 19.3 64.0 60 60 A K S S+ 0 0 122 -2,-0.4 2,-0.4 1,-0.4 -1,-0.1 0.716 90.1 42.0 -91.9 -78.3 92.3 19.8 63.3 61 61 A R S S- 0 0 160 1,-0.1 -1,-0.4 168,-0.0 168,-0.1 -0.565 93.9-150.1 -62.8 121.1 91.6 16.1 62.6 62 62 A C - 0 0 15 -2,-0.4 3,-0.1 166,-0.2 -24,-0.1 -0.874 8.2-151.6-110.5 107.0 93.6 14.5 65.3 63 63 A P - 0 0 13 0, 0.0 167,-0.2 0, 0.0 -21,-0.2 -0.549 49.7 -76.3 -68.7 142.8 95.1 11.0 64.8 64 64 A P - 0 0 16 0, 0.0 -21,-2.2 0, 0.0 2,-0.6 -0.059 50.0-141.7 -43.0 134.1 95.5 9.2 68.2 65 65 A I E -c 43 0A 0 165,-1.3 2,-0.3 -23,-0.2 -21,-0.2 -0.918 14.7-169.1-109.1 118.0 98.4 10.4 70.3 66 66 A F E -c 44 0A 4 -23,-3.2 -21,-2.5 -2,-0.6 2,-0.4 -0.775 19.1-151.6 -88.7 152.4 100.6 8.1 72.3 67 67 A G E -c 45 0A 0 -2,-0.3 11,-2.5 -23,-0.2 12,-1.8 -0.831 15.4-168.7-142.1 91.4 102.8 10.1 74.7 68 68 A I E -cd 46 79A 1 -23,-2.2 -21,-1.7 -2,-0.4 2,-0.5 -0.669 21.0-145.7 -71.9 136.4 106.2 9.1 75.9 69 69 A N E -c 47 0A 20 10,-1.6 -21,-0.2 -2,-0.3 5,-0.1 -0.945 19.1-178.1-111.7 119.0 107.3 11.5 78.7 70 70 A T + 0 0 66 -23,-0.7 -1,-0.2 -2,-0.5 -22,-0.2 0.956 64.6 54.8 -78.0 -57.0 111.0 12.4 79.0 71 71 A G S S- 0 0 64 -24,-1.1 3,-0.1 2,-0.1 -23,-0.1 0.854 103.4 -79.3 -46.0 -84.3 111.0 14.7 82.1 72 72 A R S S+ 0 0 150 1,-0.3 2,-0.3 0, 0.0 -3,-0.1 0.039 100.8 23.9-154.1 -58.7 109.7 14.1 85.6 73 73 A V + 0 0 45 171,-0.0 -24,-0.4 2,-0.0 -1,-0.3 -0.841 52.5 160.3-125.4 153.9 105.8 14.7 85.3 74 74 A G - 0 0 2 -2,-0.3 -5,-0.1 -26,-0.1 170,-0.0 -0.698 17.5-172.6-173.2 123.3 103.0 14.6 82.7 75 75 A L S S+ 0 0 33 -2,-0.2 -1,-0.1 1,-0.2 165,-0.1 0.719 90.7 48.2 -86.7 -27.7 99.2 14.3 82.8 76 76 A L S S+ 0 0 12 155,-0.0 -1,-0.2 77,-0.0 161,-0.0 0.613 97.7 94.6 -88.7 -9.5 98.4 14.0 79.1 77 77 A T - 0 0 4 1,-0.1 -9,-0.2 -11,-0.1 -3,-0.1 -0.147 57.7-154.9 -89.7 173.5 101.0 11.3 78.5 78 78 A H - 0 0 29 -11,-2.5 2,-0.2 1,-0.2 -10,-0.2 0.718 64.0 -2.2-117.3 -38.3 100.9 7.5 78.5 79 79 A A B -d 68 0A 11 -12,-1.8 -10,-1.6 9,-0.0 -1,-0.2 -0.773 53.3-124.4-145.4-176.6 104.3 6.1 79.3 80 80 A S >> - 0 0 32 -2,-0.2 4,-0.9 -12,-0.2 3,-0.6 -0.827 38.3-103.4-127.0 173.1 108.0 6.6 80.1 81 81 A P T 34 S+ 0 0 12 0, 0.0 4,-0.3 0, 0.0 3,-0.3 0.838 116.9 67.2 -64.2 -34.1 111.3 5.3 78.5 82 82 A E T 34 S+ 0 0 172 1,-0.2 -3,-0.0 2,-0.1 3,-0.0 0.826 125.6 5.6 -49.9 -37.8 111.6 2.8 81.4 83 83 A N T <> S+ 0 0 74 -3,-0.6 4,-1.5 2,-0.1 3,-0.5 0.145 90.7 112.0-141.4 21.4 108.5 1.0 80.2 84 84 A F H X S+ 0 0 1 -4,-0.9 4,-2.5 -3,-0.3 5,-0.3 0.835 71.4 67.6 -72.5 -32.4 107.2 2.4 76.8 85 85 A E H > S+ 0 0 68 -4,-0.3 4,-1.0 1,-0.2 -1,-0.2 0.850 107.5 41.2 -55.5 -37.1 108.1 -0.7 74.8 86 86 A V H > S+ 0 0 83 -3,-0.5 4,-1.5 2,-0.2 -1,-0.2 0.935 115.5 47.6 -73.4 -49.5 105.4 -2.6 76.7 87 87 A E H X S+ 0 0 55 -4,-1.5 4,-1.7 1,-0.2 -2,-0.2 0.717 110.1 53.0 -72.2 -22.2 102.7 0.1 76.8 88 88 A L H X S+ 0 0 1 -4,-2.5 4,-2.4 2,-0.2 5,-0.3 0.880 103.9 56.1 -76.2 -43.7 103.1 0.8 73.0 89 89 A K H X S+ 0 0 76 -4,-1.0 4,-1.1 -5,-0.3 -2,-0.2 0.877 113.6 42.3 -52.1 -41.9 102.6 -2.9 72.2 90 90 A K H X S+ 0 0 101 -4,-1.5 4,-2.0 2,-0.2 5,-0.4 0.906 111.6 55.3 -69.3 -45.0 99.3 -2.6 74.1 91 91 A A H X S+ 0 0 14 -4,-1.7 4,-1.6 1,-0.2 5,-0.4 0.902 114.1 36.6 -60.1 -49.8 98.3 0.8 72.7 92 92 A V H < S+ 0 0 16 -4,-2.4 -1,-0.2 2,-0.2 -2,-0.2 0.806 113.5 57.3 -74.4 -32.0 98.5 -0.2 69.0 93 93 A E H < S+ 0 0 141 -4,-1.1 -2,-0.2 -5,-0.3 -1,-0.2 0.885 117.4 30.8 -73.7 -39.9 97.2 -3.7 69.4 94 94 A K H < S- 0 0 149 -4,-2.0 -1,-0.2 -5,-0.1 -2,-0.2 0.895 87.1-158.9 -78.0 -45.3 93.8 -2.8 71.0 95 95 A F < + 0 0 73 -4,-1.6 2,-0.3 -5,-0.4 -3,-0.1 0.870 29.4 159.4 58.0 43.6 93.6 0.5 69.2 96 96 A E - 0 0 100 -5,-0.4 137,-1.5 137,-0.1 2,-0.3 -0.759 17.2-171.2 -92.1 142.5 91.2 1.9 71.8 97 97 A V - 0 0 39 -2,-0.3 2,-0.3 135,-0.3 135,-0.2 -0.878 17.9-155.9-134.1 157.8 90.9 5.7 72.0 98 98 A E - 0 0 21 -2,-0.3 133,-1.9 2,-0.0 2,-0.4 -0.929 12.5-147.2-128.2 161.2 89.4 8.6 74.0 99 99 A R E -E 230 0B 152 -2,-0.3 131,-0.2 131,-0.2 -2,-0.0 -0.991 7.5-168.2-136.6 126.9 88.5 12.1 73.0 100 100 A F E -E 229 0B 5 129,-1.9 129,-2.7 -2,-0.4 70,-0.1 -0.952 34.1-107.9-113.9 132.3 88.6 15.4 75.0 101 101 A P - 0 0 11 0, 0.0 2,-0.4 0, 0.0 125,-0.1 -0.096 23.0-147.9 -60.5 154.0 87.0 18.5 73.6 102 102 A R - 0 0 1 123,-0.2 123,-2.2 49,-0.0 125,-0.3 -0.995 12.1-148.3-123.9 128.8 88.9 21.4 72.2 103 103 A V E -FG 113 224C 0 10,-2.0 10,-2.1 -2,-0.4 2,-0.4 -0.386 8.8-144.3 -89.5 171.5 87.5 25.0 72.5 104 104 A S E -FG 112 223C 25 119,-2.0 119,-1.5 8,-0.2 2,-0.2 -0.999 5.7-133.7-144.9 139.2 88.0 27.9 70.2 105 105 A C E - G 0 222C 2 6,-0.6 117,-0.2 3,-0.5 6,-0.2 -0.510 12.1-140.8 -84.0 156.2 88.4 31.6 70.5 106 106 A S S S+ 0 0 65 115,-0.8 -1,-0.1 -2,-0.2 116,-0.1 0.795 103.6 47.7 -87.5 -30.0 86.5 34.0 68.2 107 107 A A S S+ 0 0 41 1,-0.2 -1,-0.1 114,-0.2 108,-0.1 0.627 113.4 48.8 -84.4 -15.8 89.4 36.4 67.8 108 108 A M S > S- 0 0 13 1,-0.2 3,-0.8 3,-0.1 -3,-0.5 -0.791 84.9-169.4-120.8 85.3 91.9 33.5 67.0 109 109 A P T 3 + 0 0 102 0, 0.0 2,-0.4 0, 0.0 -1,-0.2 0.796 67.3 19.3 -64.4 -54.2 89.7 31.8 64.5 110 110 A D T 3 S+ 0 0 140 -6,-0.1 2,-0.3 2,-0.0 -4,-0.1 -0.649 93.8 95.6-113.4 77.2 91.3 28.5 63.7 111 111 A V < - 0 0 21 -3,-0.8 -6,-0.6 -2,-0.4 2,-0.3 -0.909 59.8-152.8-151.5 135.4 93.7 27.5 66.6 112 112 A L E -F 104 0C 20 -2,-0.3 2,-0.4 -56,-0.2 -8,-0.2 -0.859 2.6-141.1-118.5 154.4 92.1 25.3 69.2 113 113 A A E +F 103 0C 0 -10,-2.1 -10,-2.0 -2,-0.3 4,-0.1 -0.925 19.2 178.2-121.0 135.3 92.8 24.8 72.9 114 114 A L S S+ 0 0 0 -2,-0.4 40,-0.5 -12,-0.2 39,-0.3 0.758 91.5 30.1 -96.5 -38.9 92.8 21.6 75.0 115 115 A N S S- 0 0 26 1,-0.3 36,-2.1 38,-0.2 39,-0.5 0.947 121.1 -52.4 -87.4 -65.3 93.8 23.3 78.3 116 116 A E E -K 150 0D 12 34,-0.3 93,-1.9 37,-0.1 2,-0.5 -0.988 27.3-117.3-164.7 174.4 92.4 26.9 78.2 117 117 A I E -KL 149 208D 0 32,-1.2 32,-1.1 -2,-0.3 91,-0.2 -0.926 40.5-164.7-121.2 96.8 91.9 30.2 76.6 118 118 A A E -KL 148 207D 1 89,-2.6 89,-2.4 -2,-0.5 2,-0.5 -0.577 11.0-153.4 -84.2 153.0 93.6 32.7 79.0 119 119 A V E +KL 147 206D 0 28,-2.4 28,-2.1 87,-0.2 87,-0.2 -0.902 27.3 174.2-128.7 99.2 92.9 36.4 78.7 120 120 A L E -KL 146 205D 9 85,-0.8 85,-1.4 -2,-0.5 2,-0.3 -0.498 37.0 -88.1-108.8 169.9 95.9 38.3 80.1 121 121 A S E - 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0 0 12 -5,-1.2 -23,-0.2 -4,-0.4 2,-0.2 -0.996 55.6-129.9-131.6 127.9 122.5 18.2 136.7 526 26 C E E -g 502 0G 119 -25,-1.7 -23,-2.6 -2,-0.4 2,-0.3 -0.548 26.9-146.3 -79.0 146.2 120.1 16.3 139.0 527 27 C V E -g 503 0G 33 -2,-0.2 2,-0.3 -25,-0.2 -23,-0.2 -0.806 18.2-175.1-118.4 148.9 117.2 14.5 137.3 528 28 C E E -g 504 0G 80 -25,-0.7 -23,-1.6 -2,-0.3 2,-0.2 -0.926 22.5-133.9-144.9 122.8 113.5 13.8 138.2 529 29 C L E -g 505 0G 74 -2,-0.3 2,-0.4 -25,-0.2 -23,-0.2 -0.526 16.4-167.9 -80.6 136.9 111.2 11.6 136.1 530 30 C F E -g 506 0G 22 -25,-1.9 -23,-2.0 -2,-0.2 -1,-0.0 -0.844 13.5-174.7-132.4 96.4 107.7 12.8 135.3 531 31 C N S S+ 0 0 105 -2,-0.4 -1,-0.1 1,-0.2 -25,-0.0 0.759 85.5 15.0 -58.8 -31.6 105.2 10.3 133.8 532 32 C Q S S- 0 0 137 23,-0.0 -1,-0.2 -26,-0.0 -24,-0.1 -0.983 95.2 -97.9-141.9 141.6 102.7 13.2 133.5 533 33 C P + 0 0 33 0, 0.0 2,-0.3 0, 0.0 22,-0.1 -0.003 45.7 178.5 -50.9 158.9 103.2 17.0 133.7 534 34 C S > - 0 0 45 21,-0.1 3,-1.9 1,-0.0 4,-0.2 -0.991 48.5-103.3-161.9 159.0 102.5 18.8 136.9 535 35 C E G > S+ 0 0 151 -2,-0.3 3,-1.1 1,-0.3 25,-0.1 0.684 112.6 74.7 -58.9 -19.9 102.4 22.1 138.8 536 36 C E G > S+ 0 0 101 1,-0.2 3,-1.3 2,-0.1 -1,-0.3 0.550 72.9 81.1 -72.2 -9.6 105.6 20.8 140.5 537 37 C L G X S+ 0 0 0 -3,-1.9 3,-1.0 1,-0.3 -1,-0.2 0.769 74.8 74.1 -69.8 -25.5 107.6 21.5 137.3 538 38 C E G < S+ 0 0 50 -3,-1.1 -1,-0.3 20,-0.3 -2,-0.1 0.681 85.0 68.1 -56.6 -20.4 107.9 25.1 138.3 539 39 C N G < S+ 0 0 100 -3,-1.3 2,-0.3 -4,-0.1 -1,-0.3 -0.030 86.6 86.1 -94.7 30.7 110.5 24.0 141.0 540 40 C F S < S- 0 0 9 -3,-1.0 -37,-0.2 1,-0.1 3,-0.1 -0.980 77.1-130.0-134.0 144.3 113.1 23.0 138.4 541 41 C D S S- 0 0 72 -39,-1.2 2,-0.3 -2,-0.3 -38,-0.2 0.753 91.2 -12.4 -65.1 -28.4 115.9 25.0 136.6 542 42 C F E -h 503 0G 0 -40,-0.7 -38,-2.0 21,-0.2 2,-0.4 -0.978 63.6-127.6-160.4 174.9 114.7 23.6 133.3 543 43 C I E -hi 504 565G 0 21,-2.4 23,-3.0 -2,-0.3 2,-0.6 -0.968 4.7-159.1-128.1 140.8 112.5 20.9 131.7 544 44 C V E -hi 505 566G 0 -40,-2.2 -38,-1.9 -2,-0.4 2,-0.2 -0.968 15.2-163.6-117.6 108.2 113.2 18.3 129.1 545 45 C S E -hi 506 567G 0 21,-1.9 23,-1.2 -2,-0.6 2,-0.3 -0.597 4.3-154.9 -81.7 153.8 110.0 17.2 127.4 546 46 C V E +hi 507 568G 9 -40,-1.2 -38,-0.9 -2,-0.2 -37,-0.3 -0.775 58.2 34.4-137.3 89.0 110.2 13.9 125.4 547 47 C G S S- 0 0 2 21,-1.3 23,-0.2 -2,-0.3 -2,-0.1 -0.970 92.3 -29.3 166.5-151.1 107.6 13.6 122.6 548 48 C G S > S- 0 0 8 -2,-0.3 4,-0.6 21,-0.2 20,-0.1 0.070 73.2 -81.0 -77.6-168.3 105.8 15.8 120.1 549 49 C D H > S+ 0 0 41 24,-0.3 4,-1.9 1,-0.2 3,-0.2 0.735 128.9 63.1 -60.7 -29.4 104.7 19.4 120.2 550 50 C G H > S+ 0 0 17 2,-0.2 4,-2.9 1,-0.2 5,-0.3 0.876 91.1 60.7 -67.8 -41.2 101.8 18.2 122.3 551 51 C T H > S+ 0 0 10 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.822 110.1 46.3 -51.7 -32.2 104.0 17.0 125.1 552 52 C I H X S+ 0 0 0 -4,-0.6 4,-2.2 -3,-0.2 3,-0.4 0.938 110.5 48.0 -76.9 -49.8 105.1 20.7 125.3 553 53 C L H X S+ 0 0 14 -4,-1.9 4,-0.8 1,-0.3 -2,-0.2 0.851 111.7 53.2 -63.3 -32.6 101.7 22.3 125.1 554 54 C R H < S+ 0 0 116 -4,-2.9 -1,-0.3 1,-0.2 -2,-0.2 0.822 107.5 51.4 -68.2 -36.4 100.5 19.8 127.8 555 55 C I H >< S+ 0 0 0 -4,-0.9 3,-2.1 -3,-0.4 4,-0.3 0.928 104.2 55.9 -64.7 -46.2 103.5 20.9 130.0 556 56 C L H >< S+ 0 0 2 -4,-2.2 3,-0.7 1,-0.3 -1,-0.2 0.690 93.3 69.4 -67.9 -18.5 102.7 24.6 129.7 557 57 C Q T 3< S+ 0 0 31 -4,-0.8 -1,-0.3 1,-0.2 -2,-0.2 0.620 103.9 44.5 -69.1 -13.6 99.1 24.1 131.0 558 58 C K T < S+ 0 0 91 -3,-2.1 2,-0.4 -4,-0.2 -20,-0.3 0.422 104.7 77.6-109.3 0.4 100.7 23.3 134.4 559 59 C L < + 0 0 5 -3,-0.7 3,-0.2 -4,-0.3 -24,-0.1 -0.890 36.2 163.0-110.6 138.1 103.2 26.2 134.4 560 60 C K S S+ 0 0 93 1,-0.7 2,-0.4 -2,-0.4 -1,-0.2 0.616 86.6 36.8-106.3 -72.9 102.5 29.9 135.1 561 61 C R S S- 0 0 150 166,-0.0 -1,-0.7 168,-0.0 166,-0.1 -0.677 96.1-146.5 -71.3 132.9 106.1 31.0 135.7 562 62 C C - 0 0 14 -2,-0.4 3,-0.1 166,-0.3 -24,-0.1 -0.903 14.0-155.1-120.5 111.6 108.0 28.9 133.1 563 63 C P - 0 0 15 0, 0.0 167,-0.3 0, 0.0 -21,-0.2 -0.496 51.9 -73.5 -72.0 154.9 111.5 27.5 133.4 564 64 C P - 0 0 13 0, 0.0 -21,-2.4 0, 0.0 2,-0.5 -0.139 48.0-143.3 -52.5 140.1 113.2 26.9 130.0 565 65 C I E -ij 543 731G 0 165,-1.4 167,-1.4 -23,-0.2 2,-0.5 -0.936 11.9-167.3-112.0 128.9 112.0 23.9 128.0 566 66 C F E -i 544 0G 2 -23,-3.0 -21,-1.9 -2,-0.5 2,-0.4 -0.976 19.2-155.0-107.1 123.8 114.2 21.7 125.9 567 67 C G E -i 545 0G 0 -2,-0.5 11,-2.0 9,-0.2 12,-1.3 -0.846 13.5-162.0-108.5 136.0 112.1 19.5 123.6 568 68 C I E -ik 546 579G 0 -23,-1.2 -21,-1.3 -2,-0.4 2,-0.6 -0.901 17.6-143.5-116.9 99.9 113.1 16.2 122.1 569 69 C N - 0 0 19 10,-1.4 -21,-0.2 -2,-0.6 5,-0.1 -0.498 18.1-170.2 -62.4 109.1 110.8 15.3 119.2 570 70 C T - 0 0 67 -2,-0.6 -1,-0.1 -23,-0.2 -23,-0.0 0.991 64.7 -24.0 -74.8 -81.4 110.3 11.5 119.5 571 71 C G S S+ 0 0 46 9,-0.1 -24,-0.1 2,-0.1 0, 0.0 0.303 117.6 55.3 -86.7-131.9 108.6 10.2 116.3 572 72 C R S S- 0 0 167 1,-0.1 2,-0.3 -24,-0.0 -3,-0.0 0.273 86.6 -85.1 71.5-171.2 106.6 13.0 114.6 573 73 C V + 0 0 82 0, 0.0 -24,-0.3 0, 0.0 2,-0.3 -0.930 46.3 169.1-140.9 144.0 107.4 16.5 113.3 574 74 C G - 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0 0 28 -123,-2.0 -123,-0.1 2,-0.1 -1,-0.1 -0.105 12.8-116.8 -86.0 177.5 114.9 52.3 103.6 976 226 D E S S+ 0 0 163 1,-0.2 -1,-0.1 -125,-0.1 -123,-0.1 0.752 97.3 53.9 -84.1 -27.8 116.0 55.4 105.4 977 227 D F S S- 0 0 66 -168,-0.1 -1,-0.2 -125,-0.1 -125,-0.1 -0.942 71.7-166.3-120.8 113.1 113.2 57.8 104.4 978 228 D P - 0 0 33 0, 0.0 -166,-0.5 0, 0.0 2,-0.3 -0.245 29.7 -89.0 -88.4 175.6 109.5 56.8 105.1 979 229 D A E - M 0 850K 0 -129,-2.3 -129,-1.0 -168,-0.1 2,-0.4 -0.629 40.3-152.3 -77.0 145.9 106.1 58.1 103.9 980 230 D V E + M 0 849K 5 -2,-0.3 -165,-1.0 -167,-0.3 2,-0.3 -0.981 20.3 165.4-132.2 118.7 104.6 60.8 106.1 981 231 D F E -kM 815 848K 0 -133,-1.7 -133,-2.8 -2,-0.4 -165,-0.2 -0.876 44.4 -96.8-120.6 156.5 100.9 61.5 106.6 982 232 D F E - M 0 847K 2 -167,-1.5 2,-0.3 -2,-0.3 -135,-0.3 -0.419 63.6 -81.7 -61.4 153.0 99.0 63.5 109.1 983 233 D K - 0 0 88 -137,-0.9 2,-0.9 -142,-0.1 -1,-0.1 -0.442 37.1-152.4 -68.6 121.9 97.7 61.2 111.9 984 234 D N > - 0 0 22 -2,-0.3 3,-1.7 1,-0.2 4,-0.3 -0.824 7.0-169.8 -91.1 100.9 94.4 59.3 111.1 985 235 D E T 3 S+ 0 0 107 -2,-0.9 4,-0.3 1,-0.3 3,-0.2 0.768 91.2 44.6 -58.0 -25.7 92.7 58.7 114.5 986 236 D K T 3> S+ 0 0 122 1,-0.1 4,-2.5 2,-0.1 -1,-0.3 0.066 78.8 110.5-109.7 22.4 90.3 56.4 112.6 987 237 D R H <> S+ 0 0 18 -3,-1.7 4,-0.6 2,-0.2 -1,-0.1 0.953 85.1 39.0 -60.7 -53.6 92.9 54.5 110.5 988 238 D F H >> S+ 0 0 19 -4,-0.3 3,-1.1 2,-0.2 4,-0.5 0.951 116.5 50.4 -62.6 -53.0 92.5 51.2 112.4 989 239 D R H >> S+ 0 0 123 1,-0.3 3,-0.9 -4,-0.3 4,-0.5 0.929 113.6 44.4 -52.6 -51.9 88.7 51.5 112.8 990 240 D N H 3X S+ 0 0 67 -4,-2.5 4,-1.1 1,-0.2 -1,-0.3 0.572 92.5 86.7 -72.8 -8.8 88.1 52.2 109.0 991 241 D L H < S+ 0 0 40 -4,-1.1 3,-0.9 2,-0.2 -2,-0.2 0.849 107.1 50.9 -85.8 -43.4 87.2 49.6 103.5 995 245 D V H >< S+ 0 0 0 -4,-1.6 3,-1.3 -5,-0.2 -2,-0.2 0.844 104.7 60.3 -56.8 -35.7 88.8 46.2 102.8 996 246 D R T 3< S+ 0 0 95 -4,-1.1 -1,-0.2 1,-0.3 -2,-0.2 0.657 107.8 44.4 -74.1 -14.1 85.3 44.7 102.6 997 247 D S T < S+ 0 0 44 -3,-0.9 2,-0.4 -4,-0.2 -1,-0.3 -0.145 77.7 136.2-120.1 34.7 84.5 47.0 99.7 998 248 D I < 0 0 8 -3,-1.3 -814,-1.7 1,-0.1 -3,-0.1 -0.740 360.0 360.0 -79.6 131.6 87.7 46.5 97.7 999 249 D G 0 0 29 -2,-0.4 -856,-0.2 -816,-0.2 -1,-0.1 0.138 360.0 360.0-159.6 360.0 86.8 46.1 94.1