==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-MAR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 18-JAN-10 2X2W . COMPND 2 MOLECULE: ACETYLGLUTAMATE KINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR F.GIL-ORTIZ,V.RUBIO . 516 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21372.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 398 77.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 71 13.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 37 7.2 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 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 47 9.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 46 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 164 31.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 21 4.1 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 2 0 0 2 5 1 0 4 0 0 2 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 4 3 5 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 . 3 1 4 0 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 ANTIPARALLEL BRIDGES PER LADDER . 1 0 2 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 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 0 160 0, 0.0 2,-0.3 0, 0.0 35,-0.1 0.000 360.0 360.0 360.0 166.1 -5.8 51.3 111.4 2 2 A M - 0 0 68 33,-0.1 3,-0.1 3,-0.0 0, 0.0 -0.952 360.0 -90.1-141.3 162.0 -4.9 55.0 111.3 3 3 A N - 0 0 62 -2,-0.3 171,-0.1 1,-0.1 170,-0.1 -0.284 62.2 -84.0 -65.1 157.7 -3.5 57.7 109.0 4 4 A P - 0 0 14 0, 0.0 171,-2.3 0, 0.0 2,-0.4 -0.167 35.3-142.8 -67.4 160.9 0.3 58.1 109.3 5 5 A L E -ab 38 175A 3 32,-2.1 34,-2.2 169,-0.2 2,-0.6 -0.996 4.9-150.0-121.9 128.9 2.0 60.3 111.8 6 6 A I E -ab 39 176A 0 169,-3.0 171,-2.3 -2,-0.4 2,-0.7 -0.902 7.7-163.5 -95.5 121.3 5.1 62.3 111.0 7 7 A I E -ab 40 177A 0 32,-3.1 34,-2.0 -2,-0.6 2,-0.5 -0.941 9.1-158.3-101.9 109.2 7.5 62.7 114.0 8 8 A K E -ab 41 178A 24 169,-2.9 171,-2.8 -2,-0.7 2,-0.5 -0.786 4.7-151.7 -91.0 131.0 9.8 65.6 113.2 9 9 A L E -ab 42 179A 0 32,-2.7 34,-1.2 -2,-0.5 171,-0.2 -0.891 8.6-147.8-109.2 123.4 13.1 65.6 115.2 10 10 A G >> - 0 0 7 169,-1.9 4,-1.3 -2,-0.5 3,-0.6 -0.432 29.2 -95.3 -87.9 163.1 14.9 68.8 116.0 11 11 A G H 3> S+ 0 0 25 1,-0.2 4,-1.5 2,-0.2 3,-0.3 0.806 116.0 53.7 -37.4 -59.9 18.7 69.5 116.4 12 12 A V H 34 S+ 0 0 57 1,-0.2 4,-0.3 2,-0.2 3,-0.3 0.885 107.6 52.9 -54.1 -42.4 19.1 69.3 120.2 13 13 A L H X4 S+ 0 0 0 -3,-0.6 3,-1.5 1,-0.2 7,-0.3 0.911 106.9 51.2 -58.2 -46.2 17.5 65.8 120.2 14 14 A L H 3< S+ 0 0 27 -4,-1.3 -1,-0.2 1,-0.3 -2,-0.2 0.785 107.0 55.8 -64.3 -27.3 19.8 64.4 117.6 15 15 A D T 3< S+ 0 0 80 -4,-1.5 2,-0.5 -3,-0.3 -1,-0.3 0.506 97.3 76.7 -81.7 -5.1 22.8 65.8 119.6 16 16 A S <> - 0 0 29 -3,-1.5 4,-2.2 -4,-0.3 5,-0.1 -0.932 55.3-167.3-120.1 116.5 21.8 63.8 122.8 17 17 A E H > S+ 0 0 126 -2,-0.5 4,-2.4 1,-0.2 5,-0.1 0.800 94.5 56.0 -67.8 -30.2 22.3 60.1 123.2 18 18 A E H > S+ 0 0 118 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.946 108.7 44.9 -63.6 -53.3 20.0 60.2 126.3 19 19 A A H > S+ 0 0 0 1,-0.2 4,-2.8 2,-0.2 -2,-0.2 0.912 113.3 52.2 -58.7 -42.8 17.1 61.7 124.2 20 20 A L H X S+ 0 0 1 -4,-2.2 4,-2.9 -7,-0.3 5,-0.3 0.935 108.7 48.5 -62.3 -47.2 17.8 59.2 121.4 21 21 A E H X S+ 0 0 74 -4,-2.4 4,-1.9 1,-0.2 -1,-0.2 0.874 114.4 47.4 -60.0 -37.8 17.7 56.2 123.8 22 22 A R H X S+ 0 0 98 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.894 112.9 48.9 -70.1 -40.4 14.4 57.5 125.3 23 23 A L H X S+ 0 0 1 -4,-2.8 4,-2.7 2,-0.2 -2,-0.2 0.953 114.3 43.3 -62.2 -52.7 12.9 58.2 121.8 24 24 A F H X S+ 0 0 3 -4,-2.9 4,-2.2 2,-0.2 -2,-0.2 0.847 114.1 50.6 -69.2 -33.1 13.8 54.8 120.4 25 25 A S H X S+ 0 0 53 -4,-1.9 4,-2.8 -5,-0.3 -1,-0.2 0.932 111.5 49.7 -62.9 -45.3 12.6 53.0 123.6 26 26 A A H X S+ 0 0 7 -4,-2.5 4,-2.8 1,-0.2 -2,-0.2 0.913 109.7 51.5 -57.2 -43.7 9.4 55.0 123.3 27 27 A L H X S+ 0 0 0 -4,-2.7 4,-2.3 2,-0.2 -1,-0.2 0.905 110.7 47.6 -62.7 -41.2 9.1 53.9 119.7 28 28 A V H X S+ 0 0 43 -4,-2.2 4,-1.3 2,-0.2 -2,-0.2 0.952 112.9 48.8 -62.9 -48.5 9.5 50.3 120.6 29 29 A N H >X S+ 0 0 91 -4,-2.8 4,-0.7 1,-0.2 3,-0.6 0.930 113.0 47.1 -57.3 -48.7 6.9 50.6 123.5 30 30 A Y H >X S+ 0 0 0 -4,-2.8 4,-2.1 1,-0.2 3,-1.2 0.923 110.1 53.1 -58.8 -44.8 4.4 52.3 121.2 31 31 A R H 3< S+ 0 0 96 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.697 98.9 64.0 -69.3 -19.8 4.9 49.7 118.4 32 32 A E H << S+ 0 0 157 -4,-1.3 -1,-0.3 -3,-0.6 -2,-0.2 0.775 121.2 19.8 -70.2 -28.0 4.2 46.9 120.8 33 33 A S H << S+ 0 0 86 -3,-1.2 2,-0.3 -4,-0.7 -2,-0.2 0.545 118.0 65.1-115.8 -14.7 0.6 48.1 121.3 34 34 A H < - 0 0 57 -4,-2.1 -1,-0.1 -5,-0.2 214,-0.0 -0.911 48.9-163.9-131.0 151.0 -0.1 50.3 118.4 35 35 A Q + 0 0 103 -2,-0.3 -33,-0.1 2,-0.1 -1,-0.1 0.485 44.0 129.9-106.7 -12.5 -0.4 49.9 114.6 36 36 A R - 0 0 16 1,-0.1 2,-0.2 -35,-0.1 -33,-0.1 -0.210 63.5-112.2 -60.3 133.3 -0.2 53.4 113.3 37 37 A P - 0 0 27 0, 0.0 -32,-2.1 0, 0.0 2,-0.4 -0.458 37.3-159.9 -62.8 131.7 2.2 54.1 110.4 38 38 A L E -a 5 0A 8 -34,-0.2 2,-0.4 103,-0.2 -32,-0.2 -0.923 13.0-175.0-119.4 141.5 5.1 56.3 111.7 39 39 A V E -a 6 0A 0 -34,-2.2 -32,-3.1 -2,-0.4 2,-0.4 -0.995 12.8-148.6-132.1 133.9 7.5 58.4 109.6 40 40 A I E -ac 7 144A 2 103,-3.0 105,-3.5 -2,-0.4 2,-0.4 -0.895 10.8-172.8-101.0 135.5 10.5 60.3 111.0 41 41 A V E +ac 8 145A 0 -34,-2.0 -32,-2.7 -2,-0.4 2,-0.3 -0.990 15.1 177.3-119.7 136.9 11.6 63.6 109.4 42 42 A H E -ac 9 146A 0 103,-2.3 105,-1.0 -2,-0.4 -32,-0.1 -0.980 23.5-164.1-139.8 151.9 14.9 65.1 110.7 43 43 A G - 0 0 9 -34,-1.2 105,-0.1 -2,-0.3 117,-0.1 -0.071 16.9-145.8 -97.0-149.5 17.2 68.0 110.1 44 44 A G + 0 0 6 -2,-0.1 2,-1.6 103,-0.1 -1,-0.2 0.173 29.0 159.0-139.0 -76.7 20.7 68.1 111.5 45 45 A G S > S+ 0 0 34 1,-0.2 4,-2.7 -31,-0.1 5,-0.2 -0.641 74.9 47.0 83.6 -80.1 22.0 71.5 112.6 46 46 A C H > S+ 0 0 37 -2,-1.6 4,-3.0 1,-0.2 -1,-0.2 0.911 110.6 48.2 -66.9 -49.6 24.7 70.5 115.0 47 47 A V H > S+ 0 0 49 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.881 114.6 49.3 -58.2 -38.1 26.5 67.8 112.9 48 48 A V H > S+ 0 0 1 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.945 112.8 46.2 -63.6 -48.9 26.5 70.2 110.0 49 49 A D H X S+ 0 0 62 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.866 109.1 55.6 -63.9 -37.7 27.9 73.1 112.1 50 50 A E H X S+ 0 0 113 -4,-3.0 4,-2.3 1,-0.2 -1,-0.2 0.907 110.3 45.9 -58.0 -43.3 30.5 70.7 113.6 51 51 A L H X S+ 0 0 24 -4,-1.7 4,-1.5 2,-0.2 -2,-0.2 0.842 110.7 50.7 -74.0 -34.4 31.8 69.9 110.1 52 52 A M H <>S+ 0 0 3 -4,-2.0 5,-2.4 2,-0.2 4,-0.4 0.869 110.5 52.2 -66.8 -41.3 31.8 73.5 108.9 53 53 A K H ><5S+ 0 0 148 -4,-2.3 3,-1.7 1,-0.2 -2,-0.2 0.962 109.8 48.1 -53.6 -55.8 33.8 74.3 112.0 54 54 A G H 3<5S+ 0 0 38 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.769 112.8 47.4 -60.2 -31.3 36.3 71.5 111.2 55 55 A L T 3<5S- 0 0 21 -4,-1.5 -1,-0.3 2,-0.1 -2,-0.2 0.404 107.8-123.8 -88.8 1.3 36.7 72.6 107.6 56 56 A N T < 5 + 0 0 145 -3,-1.7 -3,-0.2 -4,-0.4 -2,-0.1 0.903 58.6 153.4 49.7 44.8 37.2 76.3 108.6 57 57 A L < - 0 0 50 -5,-2.4 2,-0.3 -6,-0.1 -1,-0.2 -0.877 44.2-123.8-100.7 134.3 34.3 77.2 106.3 58 58 A P - 0 0 76 0, 0.0 2,-0.8 0, 0.0 -5,-0.0 -0.630 11.6-145.0 -82.3 135.3 32.3 80.3 107.2 59 59 A V - 0 0 66 -2,-0.3 2,-0.2 9,-0.0 9,-0.1 -0.872 29.0-175.4 -99.3 104.5 28.5 79.9 107.7 60 60 A K - 0 0 134 -2,-0.8 7,-1.1 7,-0.3 2,-0.3 -0.494 10.6-153.4 -99.9 166.0 27.0 83.2 106.3 61 61 A K B -H 66 0B 128 5,-0.2 2,-0.4 -2,-0.2 5,-0.2 -0.981 10.5-157.3-141.7 152.3 23.4 84.5 106.3 62 62 A K S S- 0 0 110 3,-1.9 3,-0.2 -2,-0.3 -2,-0.0 -0.914 84.4 -18.4-132.5 103.2 21.3 86.9 104.2 63 63 A N S S- 0 0 151 -2,-0.4 3,-0.1 1,-0.2 -1,-0.1 0.895 128.6 -47.7 66.6 45.1 18.3 88.4 106.0 64 64 A G S S+ 0 0 66 1,-0.2 2,-0.3 0, 0.0 -1,-0.2 0.631 116.4 105.6 77.3 16.3 18.1 85.8 108.9 65 65 A L S S- 0 0 88 -3,-0.2 -3,-1.9 1,-0.0 -1,-0.2 -0.946 71.6-104.7-129.8 148.8 18.4 82.8 106.6 66 66 A R B -H 61 0B 51 -2,-0.3 2,-0.4 -5,-0.2 -5,-0.2 -0.222 25.6-142.7 -66.6 156.3 21.2 80.3 105.9 67 67 A V - 0 0 27 -7,-1.1 -7,-0.3 54,-0.1 53,-0.2 -0.995 11.5-170.9-123.6 126.0 23.2 80.3 102.6 68 68 A T B -i 120 0C 0 51,-2.2 53,-3.6 -2,-0.4 5,-0.1 -0.831 16.5-156.4-117.0 90.5 24.4 77.1 101.0 69 69 A P >> - 0 0 44 0, 0.0 3,-2.1 0, 0.0 4,-1.4 -0.162 32.0-103.3 -61.2 160.3 26.8 78.0 98.1 70 70 A A T 34 S+ 0 0 72 1,-0.3 4,-0.5 2,-0.2 3,-0.4 0.867 119.5 57.9 -48.9 -41.7 27.3 75.6 95.2 71 71 A D T 34 S+ 0 0 130 1,-0.2 -1,-0.3 2,-0.1 4,-0.1 0.385 113.7 33.9 -82.1 3.4 30.7 74.6 96.7 72 72 A Q T <> S+ 0 0 16 -3,-2.1 4,-2.6 2,-0.1 5,-0.2 0.456 85.2 91.5-133.0 -1.6 29.3 73.3 100.0 73 73 A I H X S+ 0 0 7 -4,-1.4 4,-2.7 -3,-0.4 5,-0.2 0.881 90.5 55.9 -55.3 -35.7 25.9 71.9 99.3 74 74 A D H > S+ 0 0 74 -4,-0.5 4,-1.8 2,-0.2 -1,-0.2 0.884 108.5 45.2 -64.6 -40.1 27.8 68.6 98.9 75 75 A I H > S+ 0 0 33 -3,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.926 115.0 47.8 -67.4 -44.7 29.4 68.8 102.4 76 76 A I H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 5,-0.3 0.906 109.4 52.7 -63.6 -42.9 26.0 69.8 103.9 77 77 A T H X>S+ 0 0 0 -4,-2.7 4,-1.6 -5,-0.2 5,-1.1 0.916 108.1 53.3 -58.5 -43.3 24.3 66.9 102.2 78 78 A G H X>S+ 0 0 4 -4,-1.8 5,-2.3 3,-0.2 4,-0.8 0.942 111.8 43.3 -54.3 -51.4 26.9 64.6 103.6 79 79 A A H <>S+ 0 0 3 -4,-2.2 5,-2.3 3,-0.2 -2,-0.2 0.899 127.2 28.9 -64.9 -41.5 26.3 65.8 107.2 80 80 A L H <>S+ 0 0 7 -4,-2.6 5,-1.5 3,-0.2 -3,-0.2 0.961 129.1 33.0 -86.1 -61.0 22.5 65.8 107.0 81 81 A A H <5S+ 0 0 0 -4,-1.6 -3,-0.2 -5,-0.3 -2,-0.1 0.729 134.5 29.6 -73.9 -24.5 21.5 63.2 104.4 82 82 A G T XS+ 0 0 2 -4,-2.2 5,-2.7 2,-0.2 -2,-0.2 0.938 109.8 48.9 -61.2 -46.0 16.7 51.9 114.8 93 93 A K H ><5S+ 0 0 32 -4,-2.2 3,-1.5 1,-0.2 -2,-0.2 0.885 108.1 53.9 -61.5 -41.5 18.8 48.8 114.1 94 94 A K H 3<5S+ 0 0 76 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.861 111.8 45.9 -59.3 -37.4 20.0 48.6 117.8 95 95 A H T 3<5S- 0 0 30 -4,-1.6 -1,-0.3 -3,-0.2 -2,-0.2 0.220 117.8-111.4 -93.3 12.3 16.4 48.7 118.9 96 96 A Q T < 5 + 0 0 143 -3,-1.5 2,-0.5 1,-0.2 -3,-0.2 0.729 67.7 145.0 69.6 23.7 15.2 46.0 116.3 97 97 A I < - 0 0 10 -5,-2.7 2,-1.3 -6,-0.2 -1,-0.2 -0.833 51.8-131.4 -97.9 129.1 13.1 48.5 114.3 98 98 A A + 0 0 47 -2,-0.5 44,-2.5 42,-0.2 2,-0.3 -0.671 42.1 170.1 -79.5 94.6 13.0 47.9 110.5 99 99 A A E -d 142 0A 13 -2,-1.3 267,-0.8 42,-0.2 2,-0.4 -0.702 24.2-155.2-104.3 156.9 13.7 51.5 109.3 100 100 A V E -d 143 0A 2 42,-1.9 44,-2.5 -2,-0.3 2,-0.3 -0.989 16.4-134.9-132.9 125.0 14.5 52.7 105.8 101 101 A G E +d 144 0A 0 -2,-0.4 2,-0.3 42,-0.2 44,-0.2 -0.635 32.8 164.7 -82.3 132.9 16.5 55.9 105.2 102 102 A L E -d 145 0A 1 42,-2.8 44,-2.5 -2,-0.3 2,-0.3 -0.902 26.6-146.2-134.6 163.8 15.2 58.4 102.6 103 103 A F E > -d 146 0A 2 -2,-0.3 3,-1.5 42,-0.2 6,-0.3 -0.788 45.0 -92.4-118.7 176.6 15.7 62.0 101.5 104 104 A L T 3 S+ 0 0 0 44,-2.3 6,-2.1 42,-0.5 5,-0.5 0.759 120.8 59.0 -63.8 -27.8 13.0 64.2 100.1 105 105 A G T > S+ 0 0 14 43,-0.4 3,-2.5 3,-0.2 2,-0.3 0.676 74.7 107.6 -75.4 -20.2 13.7 63.3 96.5 106 106 A D G X S- 0 0 0 -3,-1.5 3,-1.3 1,-0.3 253,-0.2 -0.483 106.2 -7.5 -63.8 123.6 13.2 59.5 96.9 107 107 A G G 3 S- 0 0 13 251,-0.8 25,-0.3 -2,-0.3 22,-0.3 0.682 115.6 -84.5 58.9 22.2 9.9 58.9 95.1 108 108 A D G < S+ 0 0 56 -3,-2.5 21,-2.7 20,-0.1 -1,-0.2 0.878 77.6 163.4 46.3 42.0 9.5 62.7 94.7 109 109 A S < + 0 0 1 -3,-1.3 19,-1.2 -5,-0.5 2,-0.4 0.876 69.4 18.1 -58.3 -44.7 8.0 62.5 98.2 110 110 A V E S-J 127 0D 2 -6,-2.1 2,-0.3 17,-0.2 -1,-0.3 -0.995 83.9-138.7-128.9 124.3 8.5 66.3 98.7 111 111 A K E -J 126 0D 69 15,-1.9 15,-2.2 -2,-0.4 2,-0.4 -0.601 21.0-161.4 -82.6 141.8 9.1 68.5 95.6 112 112 A V E -J 125 0D 4 38,-0.6 40,-0.4 -2,-0.3 2,-0.3 -0.983 13.0-177.6-131.9 134.5 11.7 71.2 96.0 113 113 A T E -J 124 0D 67 11,-1.6 11,-2.9 -2,-0.4 2,-0.5 -0.852 45.1 -87.9-119.7 162.0 12.4 74.4 94.1 114 114 A Q E -J 123 0D 84 -2,-0.3 9,-0.2 9,-0.2 3,-0.2 -0.605 35.4-154.2 -72.6 122.9 15.3 76.9 94.6 115 115 A L S S- 0 0 78 7,-2.8 2,-0.3 -2,-0.5 -1,-0.2 0.964 70.3 -8.0 -62.6 -54.4 14.1 79.4 97.2 116 116 A D >> - 0 0 64 6,-0.5 3,-1.4 4,-0.3 4,-0.8 -0.982 54.0-135.2-154.2 127.4 16.2 82.4 96.2 117 117 A E G >4 S+ 0 0 169 -2,-0.3 3,-1.0 1,-0.3 -1,-0.1 0.872 108.7 57.4 -49.1 -40.4 19.1 82.8 93.8 118 118 A E G 34 S+ 0 0 99 1,-0.2 -1,-0.3 -3,-0.1 -3,-0.0 0.746 103.8 51.4 -66.4 -26.7 20.9 84.8 96.5 119 119 A L G <4 S- 0 0 3 -3,-1.4 -51,-2.2 1,-0.3 2,-0.3 0.551 94.7-154.5 -88.7 -9.7 20.8 81.9 99.0 120 120 A G B << +i 68 0C 16 -3,-1.0 2,-1.6 -4,-0.8 -4,-0.3 -0.557 68.9 14.8 75.7-126.4 22.2 79.3 96.6 121 121 A H S S+ 0 0 23 -53,-3.6 37,-3.0 -2,-0.3 2,-0.5 -0.230 88.5 125.1 -88.2 51.4 21.2 75.7 97.3 122 122 A V E - k 0 158D 19 -2,-1.6 -7,-2.8 -6,-0.3 -6,-0.5 -0.932 47.4-149.9-105.4 129.3 18.4 76.4 99.7 123 123 A G E -Jk 114 159D 3 35,-2.2 37,-0.5 -2,-0.5 2,-0.5 -0.671 12.0-138.1-103.4 153.8 15.1 74.7 98.7 124 124 A L E -J 113 0D 73 -11,-2.9 -11,-1.6 -2,-0.3 2,-0.2 -0.957 29.0-135.1-106.3 122.6 11.4 75.5 99.2 125 125 A A E +J 112 0D 20 -2,-0.5 -13,-0.2 -13,-0.2 39,-0.0 -0.485 27.9 169.4 -77.9 142.6 9.3 72.4 100.0 126 126 A Q E -J 111 0D 93 -15,-2.2 -15,-1.9 -2,-0.2 41,-0.1 -0.975 45.5 -78.8-144.5 158.7 6.0 71.6 98.5 127 127 A P E +J 110 0D 68 0, 0.0 -17,-0.2 0, 0.0 41,-0.1 -0.231 53.7 175.0 -59.0 143.3 3.9 68.4 98.6 128 128 A G - 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0 0 37 -2,-0.3 2,-0.6 1,-0.1 70,-0.1 -0.396 34.3-127.9 -67.1 143.1 42.3 45.8 78.7 444 185 B I - 0 0 8 8,-0.3 8,-3.0 68,-0.2 2,-0.3 -0.878 31.2-151.5 -91.8 122.2 44.3 42.8 79.5 445 186 B L B -Z 451 0J 90 -2,-0.6 6,-0.2 23,-0.2 2,-0.1 -0.742 3.8-139.6-102.0 143.4 46.2 41.8 76.4 446 187 B D > - 0 0 65 4,-2.4 3,-2.1 -2,-0.3 -1,-0.1 -0.235 46.2 -81.8 -82.6-178.1 47.3 38.4 75.3 447 188 B G T 3 S+ 0 0 91 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.607 131.6 54.8 -64.5 -13.3 50.7 37.6 73.6 448 189 B K T 3 S- 0 0 178 2,-0.2 -1,-0.3 0, 0.0 3,-0.1 0.119 119.4-107.5-103.7 15.9 49.2 38.7 70.3 449 190 B G S < S+ 0 0 44 -3,-2.1 2,-0.4 1,-0.2 -2,-0.1 0.639 76.1 131.2 73.2 17.0 48.1 42.2 71.6 450 191 B Q - 0 0 119 1,-0.0 -4,-2.4 -7,-0.0 -1,-0.2 -0.829 64.4-104.9-105.9 141.7 44.4 41.4 71.6 451 192 B R B -Z 445 0J 96 -2,-0.4 2,-1.0 -6,-0.2 -6,-0.2 -0.405 26.5-131.6 -62.9 130.7 42.1 42.1 74.6 452 193 B I - 0 0 28 -8,-3.0 -8,-0.3 1,-0.2 62,-0.2 -0.786 25.3-174.6 -84.1 103.8 41.2 38.9 76.5 453 194 B A + 0 0 29 -2,-1.0 61,-2.2 1,-0.2 2,-0.3 0.811 67.1 17.8 -73.9 -31.9 37.4 39.4 76.8 454 195 B E E +s 514 0F 90 59,-0.2 2,-0.3 -3,-0.1 -1,-0.2 -0.996 68.4 162.4-144.9 135.0 36.7 36.3 79.0 455 196 B M E -s 515 0F 6 59,-2.5 61,-3.1 -2,-0.3 2,-0.0 -0.993 34.1-110.4-150.7 151.3 39.0 34.2 81.2 456 197 B T E > -s 516 0F 63 -2,-0.3 4,-2.5 59,-0.2 5,-0.1 -0.276 34.6-109.9 -72.4 166.2 38.8 31.7 84.1 457 198 B A H > S+ 0 0 6 59,-0.5 4,-3.1 2,-0.2 5,-0.2 0.925 122.0 50.8 -60.3 -47.6 40.0 32.5 87.6 458 199 B A H > S+ 0 0 61 2,-0.2 4,-3.4 1,-0.2 -1,-0.2 0.902 110.4 49.2 -55.9 -45.0 42.9 30.1 87.2 459 200 B K H > S+ 0 0 82 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.918 111.5 49.3 -62.3 -43.7 43.8 31.8 83.9 460 201 B A H X S+ 0 0 0 -4,-2.5 4,-1.5 2,-0.2 -2,-0.2 0.920 113.4 46.7 -60.7 -44.4 43.6 35.2 85.7 461 202 B E H X S+ 0 0 71 -4,-3.1 4,-2.9 2,-0.2 3,-0.3 0.943 111.4 51.1 -63.2 -48.9 45.8 33.8 88.5 462 203 B Q H X S+ 0 0 89 -4,-3.4 4,-2.5 1,-0.2 -2,-0.2 0.917 109.3 51.3 -49.6 -48.7 48.3 32.3 86.0 463 204 B L H <>S+ 0 0 13 -4,-2.6 5,-2.1 1,-0.2 6,-1.7 0.801 111.5 47.2 -66.2 -29.3 48.5 35.7 84.2 464 205 B I H ><5S+ 0 0 39 -4,-1.5 3,-1.6 -3,-0.3 -2,-0.2 0.929 111.9 49.5 -72.5 -48.2 49.3 37.5 87.5 465 206 B E H 3<5S+ 0 0 146 -4,-2.9 -2,-0.2 1,-0.3 -3,-0.2 0.888 112.9 48.4 -54.2 -41.5 51.9 34.9 88.4 466 207 B Q T 3<5S- 0 0 136 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.2 0.180 115.3-112.0 -93.9 15.1 53.5 35.2 85.0 467 208 B G T < 5S+ 0 0 46 -3,-1.6 -3,-0.2 2,-0.2 -4,-0.1 0.601 84.7 117.3 72.1 14.2 53.6 39.1 85.0 468 209 B I S + 0 0 68 -2,-0.6 3,-1.4 -3,-0.1 4,-0.2 -0.733 29.4 6.6-133.9 171.0 50.6 44.2 86.1 471 212 B D T > S- 0 0 140 1,-0.2 3,-1.4 -2,-0.2 4,-0.4 -0.164 121.8 -8.3 57.3-139.0 50.4 47.5 88.1 472 213 B G T 3> S+ 0 0 47 1,-0.3 4,-1.2 2,-0.2 3,-0.4 0.647 124.5 72.4 -67.9 -16.4 47.0 48.6 89.3 473 214 B M H <> S+ 0 0 14 -3,-1.4 4,-2.7 1,-0.2 5,-0.3 0.717 82.7 69.4 -72.9 -21.4 45.1 45.9 87.4 474 215 B I H <> S+ 0 0 58 -3,-1.4 4,-2.0 -4,-0.2 -1,-0.2 0.921 102.4 45.6 -59.1 -43.8 46.4 43.2 89.8 475 216 B V H > S+ 0 0 103 -4,-0.4 4,-1.9 -3,-0.4 -1,-0.2 0.907 114.2 48.2 -63.4 -43.7 44.1 44.7 92.5 476 217 B K H X S+ 0 0 64 -4,-1.2 4,-1.7 1,-0.2 -2,-0.2 0.865 112.7 46.2 -72.3 -38.3 41.1 45.0 90.1 477 218 B V H X S+ 0 0 0 -4,-2.7 4,-2.8 2,-0.2 -1,-0.2 0.874 109.9 54.9 -69.6 -39.6 41.4 41.5 88.7 478 219 B N H X S+ 0 0 58 -4,-2.0 4,-2.4 -5,-0.3 -2,-0.2 0.890 107.9 50.5 -61.2 -37.7 41.8 40.0 92.2 479 220 B A H X S+ 0 0 23 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.932 114.1 42.8 -63.1 -47.1 38.5 41.8 93.2 480 221 B A H X S+ 0 0 0 -4,-1.7 4,-2.9 2,-0.2 -2,-0.2 0.879 113.4 53.4 -67.1 -38.1 36.6 40.3 90.2 481 222 B L H X S+ 0 0 1 -4,-2.8 4,-2.4 2,-0.2 -2,-0.2 0.935 110.3 45.6 -62.7 -50.2 38.2 36.9 90.7 482 223 B D H X S+ 0 0 88 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.896 113.9 51.1 -60.4 -39.2 37.2 36.7 94.4 483 224 B A H X S+ 0 0 2 -4,-2.0 4,-2.8 2,-0.2 5,-0.3 0.945 110.3 47.8 -63.6 -49.3 33.7 37.9 93.4 484 225 B A H X S+ 0 0 0 -4,-2.9 4,-2.6 2,-0.2 5,-0.4 0.892 113.3 47.9 -59.6 -43.2 33.3 35.3 90.6 485 226 B R H < S+ 0 0 121 -4,-2.4 -1,-0.2 2,-0.2 -2,-0.2 0.936 114.3 46.9 -63.0 -45.9 34.4 32.5 92.9 486 227 B T H < S+ 0 0 104 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.894 122.1 35.0 -59.0 -45.2 32.0 33.7 95.7 487 228 B L H < S- 0 0 35 -4,-2.8 -2,-0.2 2,-0.2 -1,-0.2 0.760 91.6-137.9 -86.1 -29.9 29.1 34.0 93.3 488 229 B G S < S+ 0 0 50 -4,-2.6 29,-0.2 1,-0.3 -3,-0.1 0.653 75.0 95.0 72.1 15.1 29.6 31.2 90.9 489 230 B R S S- 0 0 78 -5,-0.4 -1,-0.3 -6,-0.2 -2,-0.2 -0.929 88.6 -88.5-125.7 157.7 28.7 33.4 88.0 490 231 B P - 0 0 52 0, 0.0 -55,-0.5 0, 0.0 2,-0.4 -0.352 37.3-151.2 -64.5 147.2 31.0 35.5 85.8 491 232 B V E -rT 435 515F 0 24,-2.1 24,-2.8 -57,-0.1 2,-0.4 -0.984 9.3-142.3-121.5 126.5 31.9 39.0 87.0 492 233 B D E -rT 436 514F 16 -57,-1.9 -55,-3.4 -2,-0.4 2,-0.4 -0.762 8.8-162.8 -94.0 136.4 32.7 41.7 84.5 493 234 B I E +rT 437 513F 3 20,-3.0 20,-2.9 -2,-0.4 2,-0.3 -0.936 26.8 155.6-103.1 136.3 35.3 44.4 84.9 494 235 B A E -r 438 0F 4 -57,-1.8 -55,-2.1 -2,-0.4 2,-0.4 -0.989 39.6-107.2-159.4 158.2 35.0 47.3 82.5 495 236 B S > - 0 0 10 -2,-0.3 3,-0.8 -57,-0.2 -55,-0.2 -0.713 8.4-149.7 -92.4 139.1 35.8 51.0 82.2 496 237 B W T 3 S+ 0 0 8 -57,-0.4 3,-0.2 -2,-0.4 -1,-0.1 0.648 89.9 79.5 -74.5 -16.3 33.3 53.8 82.5 497 238 B R T 3 S+ 0 0 123 -58,-0.2 2,-0.9 1,-0.2 -1,-0.2 0.734 84.9 60.5 -65.1 -23.9 35.4 55.8 80.1 498 239 B H X + 0 0 90 -3,-0.8 3,-1.1 1,-0.2 4,-0.3 -0.652 63.7 160.9-103.2 73.7 34.0 54.0 77.1 499 240 B A G > + 0 0 11 -2,-0.9 3,-0.8 1,-0.3 -1,-0.2 0.732 65.7 68.3 -72.7 -22.4 30.4 54.9 77.7 500 241 B E G 3 S+ 0 0 133 1,-0.2 4,-0.3 -3,-0.2 -1,-0.3 0.815 103.1 46.7 -61.2 -29.3 29.4 54.1 74.1 501 242 B Q G <> S+ 0 0 65 -3,-1.1 4,-2.3 1,-0.2 -1,-0.2 0.503 88.3 90.2 -89.9 -7.5 30.1 50.4 74.9 502 243 B L H <> S+ 0 0 4 -3,-0.8 4,-3.2 -4,-0.3 5,-0.3 0.915 82.6 51.3 -64.1 -45.3 28.1 50.3 78.2 503 244 B P H > S+ 0 0 26 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.909 111.9 48.6 -59.9 -38.7 24.7 49.3 76.8 504 245 B A H 4>S+ 0 0 35 -4,-0.3 5,-2.3 2,-0.2 -2,-0.2 0.919 111.9 50.3 -61.6 -44.7 26.3 46.4 75.0 505 246 B L H ><5S+ 0 0 7 -4,-2.3 3,-1.4 1,-0.2 -1,-0.2 0.915 111.8 46.5 -57.7 -46.3 28.1 45.5 78.3 506 247 B F H 3<5S+ 0 0 1 -4,-3.2 -1,-0.2 1,-0.3 -2,-0.2 0.851 106.1 60.9 -66.0 -31.9 24.8 45.7 80.2 507 248 B N T 3<5S- 0 0 90 -4,-2.2 -1,-0.3 -5,-0.3 -2,-0.2 0.319 131.6 -91.4 -77.7 6.2 23.2 43.6 77.4 508 249 B G T < 5S+ 0 0 39 -3,-1.4 -3,-0.2 1,-0.3 -2,-0.1 0.578 80.2 139.8 99.9 12.7 25.7 40.8 78.2 509 250 B M < - 0 0 87 -5,-2.3 2,-2.2 -6,-0.1 -1,-0.3 -0.760 56.1-128.2 -89.3 129.1 28.6 41.6 75.9 510 251 B P + 0 0 24 0, 0.0 4,-0.2 0, 0.0 -5,-0.1 -0.430 46.7 156.0 -78.9 76.5 32.1 41.1 77.5 511 252 B M + 0 0 49 -2,-2.2 -16,-0.1 -10,-0.1 -17,-0.1 0.591 69.2 20.6 -81.0 -11.8 33.4 44.5 76.6 512 253 B G S S- 0 0 10 -59,-0.2 2,-0.4 -3,-0.2 -18,-0.2 0.346 121.2 -43.7-116.0-112.7 36.0 44.7 79.3 513 254 B T E - T 0 493F 2 -20,-2.9 -20,-3.0 -70,-0.1 2,-0.5 -0.972 50.4-161.4-129.1 116.6 37.4 41.6 81.2 514 255 B R E -sT 454 492F 37 -61,-2.2 -59,-2.5 -2,-0.4 2,-0.7 -0.873 6.6-152.7 -96.3 124.2 35.0 38.9 82.3 515 256 B I E -sT 455 491F 0 -24,-2.8 -24,-2.1 -2,-0.5 -59,-0.2 -0.890 19.8-144.6 -96.4 118.0 36.3 36.6 85.0 516 257 B L E s 456 0F 49 -61,-3.1 -59,-0.5 -2,-0.7 -27,-0.1 -0.383 360.0 360.0 -82.5 158.7 34.4 33.3 84.6 517 258 B A 0 0 92 -29,-0.2 -1,-0.1 -61,-0.1 -32,-0.1 -0.338 360.0 360.0 -68.8 360.0 33.4 31.0 87.4