==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CELL CYCLE 28-AUG-12 4B8M . COMPND 2 MOLECULE: AURORA KINASE B-A; . SOURCE 2 ORGANISM_SCIENTIFIC: XENOPUS LAEVIS; . AUTHOR F.SESSA,F.VILLA . 635 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 32406.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 407 64.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 0.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 81 12.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.3 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 . 37 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 71 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 184 29.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 2.2 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 5 2 2 2 2 2 2 2 0 2 0 2 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 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 PARALLEL BRIDGES PER LADDER . 2 4 2 1 2 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 ANTIPARALLEL BRIDGES PER LADDER . 2 0 2 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 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 87 A K 0 0 128 0, 0.0 2,-0.1 0, 0.0 627,-0.1 0.000 360.0 360.0 360.0 155.5 11.2 25.1 3.5 2 88 A F - 0 0 19 625,-0.3 2,-0.3 71,-0.2 73,-0.3 -0.408 360.0-164.7 -85.7 158.3 12.2 22.0 1.5 3 89 A T > - 0 0 77 -2,-0.1 3,-1.9 71,-0.1 4,-0.1 -0.928 36.1-109.9-135.4 158.3 11.7 21.0 -2.1 4 90 A I G > S+ 0 0 57 -2,-0.3 3,-1.4 1,-0.3 5,-0.0 0.776 116.1 65.4 -59.5 -26.7 12.0 17.7 -4.0 5 91 A D G 3 S+ 0 0 118 1,-0.3 -1,-0.3 3,-0.1 22,-0.0 0.629 85.7 72.7 -72.3 -11.8 15.1 19.1 -5.7 6 92 A D G < S+ 0 0 55 -3,-1.9 21,-3.0 20,-0.1 2,-0.4 0.447 95.5 66.5 -76.1 -0.7 16.9 19.1 -2.3 7 93 A F E < S-A 26 0A 8 -3,-1.4 2,-0.6 19,-0.2 19,-0.2 -0.971 72.6-138.8-130.6 135.4 17.0 15.3 -2.5 8 94 A D E -A 25 0A 37 17,-2.9 17,-2.4 -2,-0.4 2,-0.5 -0.835 29.8-138.8 -80.6 120.9 18.8 12.7 -4.6 9 95 A I E +A 24 0A 73 -2,-0.6 15,-0.2 15,-0.2 591,-0.1 -0.762 25.0 178.0 -84.8 126.7 16.1 10.0 -5.3 10 96 A G E - 0 0 7 13,-3.3 -1,-0.2 -2,-0.5 14,-0.2 0.932 51.3 -44.0 -93.1 -62.5 17.7 6.5 -4.9 11 97 A R E -A 23 0A 75 12,-0.9 12,-3.1 585,-0.1 -1,-0.3 -0.964 60.2 -84.2-167.6 155.6 15.1 3.9 -5.5 12 98 A P E -A 22 0A 87 0, 0.0 10,-0.3 0, 0.0 3,-0.1 -0.480 30.7-175.0 -67.1 138.1 11.5 3.0 -4.5 13 99 A L E - 0 0 64 8,-3.6 2,-0.3 1,-0.4 9,-0.2 0.767 66.3 -9.1 -98.9 -39.5 11.2 1.2 -1.2 14 100 A G E -A 21 0A 31 7,-1.4 7,-2.7 2,-0.0 -1,-0.4 -0.991 59.6-121.1-159.6 149.7 7.4 0.5 -1.3 15 101 A K - 0 0 192 -2,-0.3 2,-0.3 5,-0.2 5,-0.1 -0.623 32.7-165.9 -84.4 151.4 4.2 1.1 -3.2 16 102 A G - 0 0 43 -2,-0.2 4,-0.1 1,-0.0 -2,-0.0 -0.861 34.8-113.9-133.6 170.1 1.3 2.7 -1.4 17 103 A K S S+ 0 0 176 -2,-0.3 3,-0.1 1,-0.2 -1,-0.0 0.693 120.6 22.5 -74.4 -19.5 -2.4 3.3 -1.9 18 104 A F S S- 0 0 51 1,-0.4 21,-2.1 19,-0.1 2,-0.2 0.440 135.2 -26.3-127.3 -8.4 -1.8 7.1 -2.1 19 105 A G - 0 0 8 19,-0.2 -1,-0.4 23,-0.1 19,-0.2 -0.818 65.0 -89.1 163.0 162.0 1.9 7.3 -3.1 20 106 A N - 0 0 45 -2,-0.2 17,-3.0 -5,-0.1 2,-0.4 -0.370 25.9-131.2 -89.0 161.1 5.3 5.6 -3.0 21 107 A V E -AB 14 36A 33 -7,-2.7 -8,-3.6 15,-0.2 -7,-1.4 -0.937 26.6-165.8-110.2 136.7 8.1 5.6 -0.6 22 108 A Y E -AB 12 35A 63 13,-2.4 13,-2.6 -2,-0.4 2,-0.5 -0.949 27.2-120.2-125.6 140.7 11.7 6.3 -1.8 23 109 A L E +AB 11 34A 0 -12,-3.1 -13,-3.3 -2,-0.4 -12,-0.9 -0.696 49.8 176.6 -68.8 125.5 15.1 5.9 -0.5 24 110 A A E -AB 9 33A 0 9,-2.9 9,-3.1 -2,-0.5 2,-0.5 -0.949 29.4-144.3-137.7 154.1 16.4 9.5 -0.7 25 111 A R E -AB 8 32A 60 -17,-2.4 -17,-2.9 -2,-0.3 2,-0.4 -0.984 21.0-131.5-122.2 119.7 19.5 11.5 0.2 26 112 A E E >> -AB 7 31A 7 5,-2.8 4,-1.0 -2,-0.5 5,-1.0 -0.585 23.0-141.8 -66.3 122.6 19.2 15.1 1.4 27 113 A K T 45S+ 0 0 75 -21,-3.0 -1,-0.1 -2,-0.4 -20,-0.1 0.831 89.5 48.1 -63.5 -40.2 21.8 16.9 -0.7 28 114 A Q T 45S+ 0 0 135 -22,-0.4 -1,-0.2 1,-0.2 -21,-0.1 0.806 125.9 26.5 -78.4 -28.4 23.3 19.4 1.7 29 115 A N T 45S- 0 0 51 -3,-0.3 -1,-0.2 2,-0.1 -2,-0.2 0.374 96.1-131.6-107.3 0.8 24.0 17.0 4.6 30 116 A K T <5 + 0 0 101 -4,-1.0 2,-0.5 1,-0.2 -3,-0.2 0.862 52.4 161.5 42.4 43.1 24.3 13.9 2.4 31 117 A F E < -B 26 0A 14 -5,-1.0 -5,-2.8 581,-0.0 2,-0.4 -0.811 35.8-134.8 -99.7 126.0 21.8 12.4 4.9 32 118 A I E +B 25 0A 2 -2,-0.5 54,-0.5 -7,-0.2 2,-0.2 -0.655 40.0 142.8 -88.5 127.7 19.9 9.2 3.9 33 119 A M E -B 24 0A 0 -9,-3.1 -9,-2.9 -2,-0.4 2,-0.4 -0.808 47.3 -96.7-144.1-177.0 16.2 9.1 4.7 34 120 A A E -BC 23 84A 6 50,-3.3 50,-2.8 -2,-0.2 2,-0.5 -0.880 26.0-154.0-108.7 144.4 12.9 7.9 3.3 35 121 A L E -BC 22 83A 0 -13,-2.6 -13,-2.4 -2,-0.4 2,-0.6 -0.967 2.4-160.4-120.7 113.8 10.5 10.1 1.3 36 122 A K E -BC 21 82A 68 46,-2.3 46,-2.8 -2,-0.5 2,-0.5 -0.850 12.6-158.6 -90.5 122.5 6.9 9.2 1.3 37 123 A V E - C 0 81A 11 -17,-3.0 2,-0.4 -2,-0.6 44,-0.2 -0.907 9.3-173.4-109.9 122.9 5.2 10.9 -1.6 38 124 A L E - C 0 80A 9 42,-3.4 42,-3.0 -2,-0.5 2,-0.5 -0.929 22.1-127.8-118.2 139.0 1.4 11.4 -1.5 39 125 A F E > - C 0 79A 78 -21,-2.1 4,-2.1 -2,-0.4 40,-0.2 -0.755 10.7-149.3 -88.5 122.6 -0.8 12.8 -4.3 40 126 A K H > S+ 0 0 20 38,-2.4 4,-1.9 -2,-0.5 -1,-0.1 0.850 95.2 48.3 -57.6 -42.7 -3.0 15.7 -3.3 41 127 A S H > S+ 0 0 78 37,-0.4 4,-2.9 2,-0.2 -1,-0.2 0.869 110.5 51.1 -69.0 -38.7 -5.9 14.9 -5.7 42 128 A Q H > S+ 0 0 67 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.903 110.7 48.8 -65.5 -42.1 -6.0 11.2 -4.7 43 129 A L H X>S+ 0 0 6 -4,-2.1 5,-2.1 2,-0.2 4,-0.6 0.893 114.3 46.4 -63.1 -41.1 -6.2 12.1 -1.0 44 130 A E H ><5S+ 0 0 116 -4,-1.9 3,-0.7 -5,-0.2 -2,-0.2 0.923 111.3 50.6 -68.3 -45.4 -9.0 14.6 -1.7 45 131 A K H 3<5S+ 0 0 177 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.875 113.6 45.4 -58.3 -41.6 -11.0 12.2 -3.9 46 132 A E H 3<5S- 0 0 123 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.577 109.0-129.0 -79.2 -11.9 -10.8 9.5 -1.3 47 133 A G T <<5 + 0 0 50 -3,-0.7 3,-0.2 -4,-0.6 -3,-0.2 0.811 68.9 127.4 68.7 34.6 -11.7 12.0 1.4 48 134 A V >< + 0 0 24 -5,-2.1 4,-2.4 -6,-0.2 5,-0.2 0.063 28.6 112.5-108.0 23.4 -8.8 11.1 3.7 49 135 A E H > S+ 0 0 48 -6,-0.3 4,-2.2 2,-0.2 -1,-0.1 0.916 81.2 41.8 -65.4 -47.5 -7.4 14.7 4.2 50 136 A H H > S+ 0 0 128 2,-0.2 4,-1.8 -3,-0.2 -1,-0.2 0.828 113.5 56.5 -68.8 -32.0 -8.2 15.1 7.9 51 137 A Q H > S+ 0 0 87 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.910 110.0 43.1 -61.5 -48.2 -7.1 11.5 8.5 52 138 A L H X S+ 0 0 16 -4,-2.4 4,-2.4 1,-0.2 5,-0.2 0.887 110.5 56.1 -68.0 -40.7 -3.7 12.2 7.0 53 139 A R H X S+ 0 0 88 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.882 107.8 49.9 -56.6 -39.7 -3.4 15.5 8.9 54 140 A R H X S+ 0 0 120 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.898 109.7 49.7 -67.7 -44.0 -4.0 13.6 12.1 55 141 A E H X S+ 0 0 47 -4,-1.8 4,-2.5 2,-0.2 5,-0.3 0.886 113.7 46.1 -61.4 -42.3 -1.3 11.0 11.4 56 142 A I H X S+ 0 0 1 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.908 110.5 53.3 -67.5 -43.1 1.2 13.7 10.6 57 143 A E H < S+ 0 0 94 -4,-2.3 4,-0.4 -5,-0.2 -2,-0.2 0.934 116.2 39.2 -58.1 -46.6 0.3 15.7 13.7 58 144 A I H >< S+ 0 0 15 -4,-2.3 3,-1.4 1,-0.2 -2,-0.2 0.982 119.3 42.6 -69.1 -58.7 0.9 12.7 15.9 59 145 A Q H >< S+ 0 0 12 -4,-2.5 3,-1.3 1,-0.3 11,-0.5 0.839 108.6 58.3 -60.8 -36.0 4.0 11.2 14.3 60 146 A S T 3< S+ 0 0 23 -4,-2.3 -1,-0.3 -5,-0.3 -2,-0.2 0.592 106.0 50.3 -72.8 -10.1 5.8 14.5 13.7 61 147 A H T < S+ 0 0 115 -3,-1.4 2,-0.5 -4,-0.4 -1,-0.3 0.251 91.4 95.0-110.2 8.2 5.7 15.3 17.5 62 148 A L < + 0 0 5 -3,-1.3 2,-0.4 -4,-0.2 8,-0.4 -0.894 46.2 179.6-104.3 130.7 7.1 11.9 18.7 63 149 A R + 0 0 122 -2,-0.5 5,-0.1 6,-0.1 -3,-0.0 -0.850 26.6 129.1-133.5 96.2 10.8 11.5 19.4 64 150 A H > - 0 0 24 3,-0.5 3,-2.0 -2,-0.4 -2,-0.0 -0.994 61.6-122.5-148.2 142.8 11.8 8.0 20.5 65 151 A P T 3 S+ 0 0 44 0, 0.0 4,-0.1 0, 0.0 -1,-0.0 0.706 115.0 46.6 -59.7 -20.3 14.5 5.6 19.4 66 152 A N T 3 S+ 0 0 1 47,-0.1 80,-2.4 79,-0.1 2,-0.4 0.155 98.9 78.7-110.7 19.4 11.8 2.9 18.7 67 153 A I B < S-e 146 0B 2 -3,-2.0 -3,-0.5 78,-0.3 2,-0.2 -0.998 90.5-112.0-124.2 127.1 9.4 5.2 16.9 68 154 A L - 0 0 8 78,-2.8 2,-0.2 -2,-0.4 -6,-0.1 -0.397 40.2-126.1 -59.5 124.1 10.1 5.9 13.2 69 155 A R - 0 0 33 -2,-0.2 16,-2.8 -4,-0.1 2,-0.6 -0.507 14.2-154.8 -79.7 138.4 11.0 9.6 13.1 70 156 A M E -D 84 0A 7 -11,-0.5 14,-0.2 -8,-0.4 3,-0.1 -0.968 12.4-173.4-107.6 108.6 9.3 12.2 10.8 71 157 A Y E - 0 0 23 12,-2.2 2,-0.3 -2,-0.6 13,-0.1 0.851 57.3 -50.7 -72.2 -39.1 11.9 14.8 10.4 72 158 A N E -D 83 0A 10 11,-1.0 11,-2.5 2,-0.0 2,-0.3 -0.939 51.3-132.6-178.7-176.4 9.7 17.3 8.5 73 159 A Y E +D 82 0A 20 -2,-0.3 2,-0.3 9,-0.2 -71,-0.2 -0.977 16.4 177.8-155.9 159.1 7.4 17.6 5.5 74 160 A F E -D 81 0A 5 7,-2.0 7,-3.2 -2,-0.3 2,-0.3 -0.932 11.0-148.4-153.8 173.4 6.7 19.8 2.5 75 161 A H E -D 80 0A 17 -2,-0.3 5,-0.2 -73,-0.3 2,-0.2 -0.974 6.9-171.1-146.2 159.6 4.5 20.0 -0.5 76 162 A D - 0 0 47 3,-2.3 -73,-0.0 -2,-0.3 5,-0.0 -0.542 57.0 -60.5-128.8-157.8 4.4 21.3 -4.1 77 163 A R S S+ 0 0 185 -2,-0.2 3,-0.0 1,-0.2 561,-0.0 0.850 129.9 10.7 -57.8 -40.3 1.7 21.7 -6.7 78 164 A K S S+ 0 0 117 1,-0.1 -38,-2.4 -38,-0.1 -37,-0.4 0.575 119.2 56.9-116.7 -16.1 0.6 18.0 -6.9 79 165 A R E -C 39 0A 93 -40,-0.2 -3,-2.3 -39,-0.1 2,-0.4 -0.892 53.1-148.1-133.2 149.9 2.3 16.2 -4.0 80 166 A I E -CD 38 75A 0 -42,-3.0 -42,-3.4 -2,-0.3 2,-0.5 -0.957 24.7-157.5-109.6 134.9 2.8 16.0 -0.2 81 167 A Y E -CD 37 74A 8 -7,-3.2 -7,-2.0 -2,-0.4 2,-0.5 -0.966 5.8-160.4-119.6 128.3 6.2 14.7 0.9 82 168 A L E -CD 36 73A 9 -46,-2.8 -46,-2.3 -2,-0.5 2,-0.8 -0.932 11.7-146.0-110.0 124.3 7.0 13.2 4.2 83 169 A M E +CD 35 72A 0 -11,-2.5 -12,-2.2 -2,-0.5 -11,-1.0 -0.813 32.0 177.5 -92.6 108.5 10.6 13.1 5.4 84 170 A L E -CD 34 70A 16 -50,-2.8 -50,-3.3 -2,-0.8 -14,-0.2 -0.810 35.4 -97.4-117.8 148.7 11.0 9.9 7.3 85 171 A E - 0 0 32 -16,-2.8 2,-0.5 -2,-0.3 -52,-0.2 -0.372 41.9-122.1 -54.4 134.2 13.7 8.0 9.1 86 172 A F - 0 0 25 -54,-0.5 -1,-0.1 -2,-0.1 -54,-0.0 -0.756 16.5-155.3 -85.8 126.0 15.2 5.2 7.0 87 173 A A > - 0 0 8 -2,-0.5 3,-1.8 1,-0.1 51,-0.3 -0.867 7.3-163.6-103.5 97.7 14.9 1.8 8.6 88 174 A P T 3 S+ 0 0 45 0, 0.0 51,-0.2 0, 0.0 -1,-0.1 0.715 83.4 51.4 -62.5 -28.5 17.7 -0.1 6.9 89 175 A R T 3 S- 0 0 132 49,-1.7 50,-0.2 1,-0.2 51,-0.1 0.479 97.7-156.3 -90.9 -3.8 16.6 -3.6 7.8 90 176 A G E < +F 138 0B 24 -3,-1.8 48,-1.8 48,-0.7 2,-0.3 -0.260 43.9 16.9 78.2-150.2 13.0 -3.1 6.5 91 177 A E E > -F 137 0B 66 46,-0.2 4,-1.2 1,-0.1 3,-0.3 -0.429 48.6-154.5 -74.0 126.4 9.7 -4.7 7.4 92 178 A L H > S+ 0 0 0 44,-2.2 4,-2.5 41,-0.4 3,-0.3 0.892 96.6 59.4 -61.4 -39.7 9.5 -6.8 10.6 93 179 A Y H > S+ 0 0 77 40,-0.6 4,-2.3 43,-0.5 -1,-0.2 0.854 101.7 53.9 -61.3 -34.8 6.7 -8.8 9.1 94 180 A K H > S+ 0 0 106 -3,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.870 109.7 48.0 -64.5 -37.8 9.0 -10.0 6.2 95 181 A E H X S+ 0 0 38 -4,-1.2 4,-2.0 -3,-0.3 -2,-0.2 0.884 111.2 49.6 -70.2 -42.7 11.5 -11.2 8.8 96 182 A L H X S+ 0 0 9 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.927 112.5 47.7 -61.1 -44.7 8.9 -13.0 10.8 97 183 A Q H < S+ 0 0 157 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.888 110.8 52.5 -62.8 -40.5 7.6 -14.7 7.6 98 184 A K H < S+ 0 0 147 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.858 120.4 31.9 -63.6 -39.5 11.1 -15.6 6.6 99 185 A H H < S- 0 0 105 -4,-2.0 2,-1.4 1,-0.1 -2,-0.2 0.624 94.2-139.4 -93.8 -16.7 11.9 -17.3 10.0 100 186 A G S < S+ 0 0 40 -4,-2.1 2,-0.3 -5,-0.2 -1,-0.1 -0.381 80.0 8.6 83.9 -56.7 8.4 -18.6 10.8 101 187 A R S S- 0 0 124 -2,-1.4 2,-0.3 -6,-0.1 96,-0.2 -0.984 78.3-116.3-150.0 154.9 8.8 -17.6 14.4 102 188 A F - 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0 0 14 0, 0.0 3,-1.2 0, 0.0 -9,-0.1 -0.358 38.7-115.7 -66.9 153.7 28.6 60.7 40.3 483 288 B P T 3 S+ 0 0 2 0, 0.0 19,-0.3 0, 0.0 -33,-0.1 0.699 108.1 41.3 -66.7 -24.7 25.7 61.4 37.8 484 289 B F T 3 S+ 0 0 0 -35,-0.3 11,-0.2 17,-0.1 12,-0.2 0.168 75.8 149.0-114.5 18.9 25.6 65.2 38.1 485 290 B D < + 0 0 71 -3,-1.2 3,-0.1 10,-0.1 -4,-0.0 -0.256 20.1 162.9 -50.7 131.9 29.3 66.0 38.2 486 291 B S - 0 0 18 1,-0.1 6,-0.1 2,-0.0 -2,-0.1 -0.973 50.5-115.6-150.4 158.8 29.9 69.4 36.6 487 292 B P S S+ 0 0 141 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.895 100.2 44.5 -63.1 -39.3 32.7 72.1 36.4 488 293 B S S > S- 0 0 48 1,-0.1 4,-1.9 -3,-0.1 5,-0.1 -0.747 75.6-132.5-110.2 152.4 30.5 74.6 38.2 489 294 B H H > S+ 0 0 102 -2,-0.3 4,-3.2 2,-0.2 5,-0.2 0.877 108.4 58.7 -64.0 -39.8 28.2 74.4 41.3 490 295 B T H > S+ 0 0 106 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.900 108.1 45.7 -58.3 -41.3 25.4 76.2 39.4 491 296 B E H > S+ 0 0 64 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.904 112.4 50.0 -68.3 -42.5 25.5 73.5 36.8 492 297 B T H X S+ 0 0 5 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.946 111.9 48.5 -60.5 -48.2 25.6 70.7 39.4 493 298 B H H X S+ 0 0 59 -4,-3.2 4,-2.5 1,-0.2 5,-0.2 0.942 112.7 49.1 -54.2 -50.6 22.6 72.3 41.2 494 299 B R H X S+ 0 0 99 -4,-2.4 4,-1.5 -5,-0.2 -1,-0.2 0.886 111.4 48.3 -56.3 -43.6 20.7 72.6 37.9 495 300 B R H <>S+ 0 0 31 -4,-2.5 5,-3.0 -11,-0.2 4,-0.3 0.887 112.1 49.1 -69.9 -39.1 21.4 69.0 37.0 496 301 B I H ><5S+ 0 0 0 -4,-2.5 3,-1.4 3,-0.2 -2,-0.2 0.971 113.6 44.2 -60.3 -55.4 20.3 67.6 40.4 497 302 B V H 3<5S+ 0 0 23 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.726 120.7 41.1 -71.3 -19.9 17.0 69.6 40.5 498 303 B N T 3<5S- 0 0 103 -4,-1.5 -1,-0.3 -5,-0.2 3,-0.2 0.347 106.2-128.3-100.6 4.6 16.2 68.7 36.9 499 304 B V T < 5 - 0 0 33 -3,-1.4 2,-2.2 -4,-0.3 -3,-0.2 0.931 33.2-172.0 45.7 54.0 17.4 65.1 37.3 500 305 B D < - 0 0 35 -5,-3.0 2,-0.3 -6,-0.1 -1,-0.2 -0.466 7.6-179.0 -80.0 73.4 19.6 65.6 34.3 501 306 B L - 0 0 39 -2,-2.2 2,-0.4 -3,-0.2 -17,-0.1 -0.589 17.6-178.2 -78.2 130.9 20.8 61.9 33.9 502 307 B K - 0 0 136 -2,-0.3 -2,-0.1 -19,-0.3 -1,-0.1 -0.751 17.2-159.6-126.1 81.4 23.1 61.1 31.1 503 308 B F - 0 0 51 -2,-0.4 -2,-0.0 1,-0.1 9,-0.0 -0.408 20.7-117.9 -62.4 128.9 23.6 57.3 31.4 504 309 B P > - 0 0 21 0, 0.0 3,-1.7 0, 0.0 -1,-0.1 -0.390 21.5-116.5 -63.7 147.8 26.8 56.1 29.8 505 310 B P T 3 S+ 0 0 132 0, 0.0 -2,-0.1 0, 0.0 0, 0.0 0.658 108.3 69.5 -58.6 -17.2 26.3 53.6 26.9 506 311 B F T 3 S+ 0 0 109 2,-0.0 2,-0.2 -27,-0.0 -3,-0.0 0.605 76.2 100.5 -82.1 -9.7 28.1 50.9 28.9 507 312 B L S < S- 0 0 14 -3,-1.7 2,-0.0 1,-0.1 -28,-0.0 -0.528 74.6-119.2 -75.3 141.4 25.4 50.4 31.5 508 313 B S > - 0 0 36 -2,-0.2 4,-2.0 1,-0.1 5,-0.2 -0.310 22.8-112.8 -71.2 160.0 23.0 47.5 31.2 509 314 B D H > S+ 0 0 130 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.903 116.2 55.1 -58.0 -43.2 19.2 48.0 30.9 510 315 B G H > S+ 0 0 24 2,-0.2 4,-2.1 1,-0.2 27,-0.2 0.900 108.1 46.4 -59.8 -45.7 18.7 46.5 34.4 511 316 B S H > S+ 0 0 1 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.915 112.7 49.3 -65.0 -44.2 21.1 48.9 36.2 512 317 B K H X S+ 0 0 65 -4,-2.0 4,-2.8 2,-0.2 -2,-0.2 0.881 109.1 54.5 -61.0 -40.1 19.6 52.0 34.4 513 318 B D H X S+ 0 0 62 -4,-2.4 4,-1.4 2,-0.2 -2,-0.2 0.953 110.6 45.0 -57.4 -49.7 16.1 50.8 35.3 514 319 B L H X S+ 0 0 0 -4,-2.1 4,-1.2 1,-0.2 3,-0.4 0.938 115.9 45.4 -62.0 -48.7 17.0 50.6 39.0 515 320 B I H >X S+ 0 0 0 -4,-2.5 4,-3.0 1,-0.2 3,-0.6 0.911 111.2 53.2 -61.7 -43.6 18.8 54.0 39.1 516 321 B S H 3< S+ 0 0 47 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.770 109.0 50.6 -64.9 -24.5 16.0 55.7 37.1 517 322 B K H 3< S+ 0 0 85 -4,-1.4 10,-1.9 -3,-0.4 -1,-0.2 0.710 115.1 42.0 -86.0 -21.5 13.5 54.4 39.6 518 323 B L H << S+ 0 0 0 -4,-1.2 2,-1.9 -3,-0.6 -2,-0.2 0.841 102.2 68.0 -88.2 -40.6 15.5 55.7 42.6 519 324 B L < + 0 0 5 -4,-3.0 2,-0.4 -5,-0.2 -1,-0.2 -0.458 68.5 145.1 -83.4 68.4 16.5 59.1 41.2 520 325 B R - 0 0 91 -2,-1.9 6,-0.1 -3,-0.2 -21,-0.1 -0.901 48.9-142.4-104.9 135.3 13.0 60.6 41.2 521 326 B Y S S+ 0 0 82 -2,-0.4 -67,-0.2 1,-0.1 -1,-0.1 0.924 91.8 66.4 -56.3 -48.6 12.6 64.3 41.9 522 327 B H S > S- 0 0 98 1,-0.2 3,-1.7 -3,-0.1 4,-0.4 -0.689 83.5-144.0 -81.6 112.4 9.3 63.7 43.8 523 328 B P G > S+ 0 0 27 0, 0.0 3,-2.1 0, 0.0 -1,-0.2 0.861 93.4 56.8 -49.2 -48.1 10.3 61.8 46.9 524 329 B P G 3 S+ 0 0 83 0, 0.0 -3,-0.0 0, 0.0 -2,-0.0 0.679 99.6 62.7 -61.8 -16.3 7.2 59.5 47.2 525 330 B Q G < S+ 0 0 99 -3,-1.7 -4,-0.1 2,-0.1 -6,-0.1 0.627 78.7 112.7 -77.4 -14.5 7.9 58.2 43.7 526 331 B R S < S- 0 0 6 -3,-2.1 -8,-0.2 -4,-0.4 -9,-0.1 -0.318 82.1-100.7 -67.3 138.0 11.2 56.7 44.7 527 332 B L - 0 0 34 -10,-1.9 -1,-0.1 -13,-0.2 5,-0.1 -0.401 43.9-117.7 -55.2 121.4 11.5 52.9 44.6 528 333 B P >> - 0 0 54 0, 0.0 4,-1.4 0, 0.0 3,-0.6 -0.236 21.9-109.8 -60.6 155.7 11.1 51.7 48.2 529 334 B L H 3> S+ 0 0 11 1,-0.3 4,-2.2 2,-0.2 3,-0.2 0.853 121.8 56.7 -52.1 -39.6 14.1 49.8 49.8 530 335 B K H 3> S+ 0 0 128 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.908 105.8 51.4 -57.1 -42.2 12.0 46.6 49.6 531 336 B G H <4 S+ 0 0 17 -3,-0.6 4,-0.4 1,-0.2 -1,-0.2 0.764 106.6 53.8 -68.6 -28.3 11.7 47.2 45.9 532 337 B V H >< S+ 0 0 1 -4,-1.4 3,-0.9 -3,-0.2 6,-0.2 0.930 109.5 46.7 -67.9 -48.9 15.5 47.6 45.6 533 338 B M H 3< S+ 0 0 45 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.831 118.8 42.7 -63.6 -31.1 16.1 44.3 47.2 534 339 B E T 3< S+ 0 0 128 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.454 84.1 126.1 -90.6 -6.8 13.4 42.7 45.0 535 340 B H <> - 0 0 7 -3,-0.9 4,-2.8 -4,-0.4 3,-0.4 -0.308 67.6-125.9 -59.1 133.5 14.6 44.5 41.8 536 341 B P H > S+ 0 0 93 0, 0.0 4,-2.3 0, 0.0 5,-0.1 0.832 109.9 50.6 -50.7 -37.3 15.2 41.9 38.9 537 342 B W H > S+ 0 0 12 -27,-0.2 4,-1.6 2,-0.2 5,-0.2 0.891 112.2 46.0 -70.3 -40.6 18.7 43.3 38.3 538 343 B V H > S+ 0 0 0 -3,-0.4 4,-2.7 -6,-0.2 -1,-0.2 0.934 114.6 48.0 -63.5 -46.7 19.7 43.1 42.1 539 344 B K H < S+ 0 0 139 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.908 114.5 46.1 -61.2 -43.1 18.2 39.6 42.3 540 345 B A H < S+ 0 0 61 -4,-2.3 -1,-0.2 -5,-0.3 -2,-0.2 0.824 125.1 28.6 -69.0 -31.8 20.0 38.4 39.2 541 346 B N H < S+ 0 0 23 -4,-1.6 -151,-0.3 -5,-0.1 -2,-0.2 0.666 87.2 107.0-112.0 -20.1 23.4 39.9 40.1 542 347 B S < - 0 0 16 -4,-2.7 -155,-0.1 -153,-0.3 -156,-0.1 -0.406 36.1-178.0 -63.8 134.7 23.8 40.0 43.9 543 348 B R + 0 0 149 -157,-0.5 -1,-0.1 -2,-0.1 -153,-0.1 -0.319 24.8 170.3-121.5 44.7 26.2 37.5 45.4 544 349 B R - 0 0 51 -155,-0.1 2,-0.4 1,-0.0 -153,-0.0 -0.303 16.5-164.8 -66.7 137.6 25.5 38.6 48.9 545 350 B V - 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