==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CELL CYCLE/TRANSFERASE 16-APR-08 2VRX . COMPND 2 MOLECULE: SERINE/THREONINE-PROTEIN KINASE 12-A; . SOURCE 2 ORGANISM_SCIENTIFIC: XENOPUS LAEVIS; . AUTHOR F.GIRDLER,F.SESSA,S.PATERCOLI,F.VILLA,E.RIDGWAY,A.MUSACCHIO, . 627 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 31848.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 399 63.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 0.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 82 13.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 0.5 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 . 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 . 38 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 68 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 183 29.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 1.8 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 6 1 3 1 2 2 2 1 1 2 0 2 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 2 4 2 1 2 4 1 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 0 145 0, 0.0 2,-0.1 0, 0.0 620,-0.1 0.000 360.0 360.0 360.0 155.3 11.9 25.1 3.4 2 88 A F - 0 0 20 618,-0.3 2,-0.3 71,-0.2 73,-0.3 -0.439 360.0-173.8 -84.0 154.4 12.6 21.9 1.5 3 89 A T > - 0 0 73 -2,-0.1 3,-1.7 71,-0.1 4,-0.1 -0.909 41.7-103.3-134.6 166.6 11.7 20.9 -2.1 4 90 A I G > S+ 0 0 57 -2,-0.3 3,-1.7 1,-0.3 -2,-0.0 0.816 117.9 65.7 -59.3 -33.1 12.1 17.6 -4.0 5 91 A D G 3 S+ 0 0 117 1,-0.3 -1,-0.3 3,-0.0 -3,-0.0 0.686 86.4 72.9 -63.2 -17.8 15.2 19.0 -5.7 6 92 A D G < S+ 0 0 57 -3,-1.7 21,-2.7 20,-0.1 2,-0.4 0.450 94.5 67.5 -74.2 -0.8 16.9 19.0 -2.3 7 93 A F E < S-A 26 0A 8 -3,-1.7 2,-0.6 19,-0.2 19,-0.2 -0.970 72.6-138.6-129.7 134.6 17.1 15.2 -2.5 8 94 A D E -A 25 0A 45 17,-3.0 17,-2.5 -2,-0.4 2,-0.6 -0.831 29.8-139.8 -78.9 120.2 18.9 12.6 -4.5 9 95 A I E +A 24 0A 70 -2,-0.6 15,-0.2 15,-0.2 584,-0.1 -0.789 24.1 178.8 -87.5 119.7 16.3 9.9 -5.2 10 96 A G E - 0 0 5 13,-2.8 14,-0.2 -2,-0.6 -1,-0.2 0.953 52.2 -49.7 -84.9 -57.7 17.9 6.5 -4.8 11 97 A R E -A 23 0A 74 12,-1.2 12,-3.2 578,-0.1 -1,-0.3 -0.948 58.7 -81.0-175.2 155.8 15.1 4.0 -5.5 12 98 A P E -A 22 0A 82 0, 0.0 10,-0.3 0, 0.0 3,-0.1 -0.508 30.4-175.5 -69.9 138.6 11.6 3.0 -4.5 13 99 A L E - 0 0 67 8,-3.5 2,-0.3 1,-0.4 9,-0.2 0.745 65.3 -11.9 -99.4 -35.0 11.2 1.1 -1.2 14 100 A G E -A 21 0A 27 7,-1.6 7,-2.6 2,-0.0 -1,-0.4 -0.992 58.4-118.4-162.4 157.5 7.5 0.4 -1.3 15 101 A K - 0 0 180 -2,-0.3 2,-0.2 5,-0.2 5,-0.2 -0.750 32.3-176.2 -95.9 151.0 4.2 1.2 -3.0 16 102 A G - 0 0 20 3,-0.5 4,-0.0 -2,-0.3 -2,-0.0 -0.800 40.0 -99.6-133.6-178.7 1.3 2.7 -1.1 17 103 A K S S+ 0 0 124 -2,-0.2 3,-0.1 1,-0.2 -1,-0.1 0.908 120.9 26.7 -66.6 -44.4 -2.3 3.8 -1.6 18 104 A F S S- 0 0 36 1,-0.3 21,-2.7 19,-0.0 2,-0.3 0.404 133.9 -36.3-107.2 -0.4 -1.5 7.5 -2.1 19 105 A G - 0 0 7 19,-0.2 -3,-0.5 60,-0.1 -1,-0.3 -0.912 68.9 -77.2 162.6 178.6 2.0 7.3 -3.4 20 106 A N - 0 0 45 -2,-0.3 17,-2.8 -5,-0.2 2,-0.4 -0.550 29.6-127.1 -98.6 164.5 5.3 5.5 -3.1 21 107 A V E -AB 14 36A 35 -7,-2.6 -8,-3.5 15,-0.2 -7,-1.6 -0.942 29.8-164.2-109.7 137.1 8.1 5.6 -0.5 22 108 A Y E -AB 12 35A 62 13,-2.2 13,-2.7 -2,-0.4 2,-0.5 -0.926 27.0-119.7-124.9 141.7 11.7 6.1 -1.7 23 109 A L E +AB 11 34A 0 -12,-3.2 -13,-2.8 -2,-0.4 -12,-1.2 -0.722 51.0 174.3 -69.4 123.9 15.2 5.8 -0.4 24 110 A A E -AB 9 33A 0 9,-2.9 9,-3.1 -2,-0.5 2,-0.4 -0.935 30.1-144.7-137.4 157.4 16.5 9.3 -0.6 25 111 A R E -AB 8 32A 53 -17,-2.5 -17,-3.0 -2,-0.3 2,-0.3 -0.990 19.9-132.4-125.4 122.3 19.5 11.4 0.3 26 112 A E E >> -AB 7 31A 9 5,-2.8 5,-1.0 -2,-0.4 4,-1.0 -0.615 22.4-144.2 -69.3 127.8 19.3 15.0 1.5 27 113 A K T 45S+ 0 0 91 -21,-2.7 -1,-0.1 -2,-0.3 -20,-0.1 0.867 89.1 50.7 -70.6 -43.4 21.9 16.8 -0.6 28 114 A Q T 45S+ 0 0 160 -22,-0.4 -1,-0.2 1,-0.2 -21,-0.1 0.881 126.3 25.9 -64.1 -40.7 23.3 19.4 1.8 29 115 A N T 45S- 0 0 48 2,-0.1 -1,-0.2 586,-0.0 -2,-0.2 0.393 94.9-131.6-104.8 -0.1 23.9 16.9 4.6 30 116 A K T <5 + 0 0 148 -4,-1.0 2,-0.5 1,-0.2 -3,-0.2 0.856 53.6 159.9 45.8 40.3 24.3 13.7 2.5 31 117 A F E < -B 26 0A 13 -5,-1.0 -5,-2.8 574,-0.0 2,-0.4 -0.825 36.6-135.4-102.6 123.0 21.9 12.2 5.0 32 118 A I E +B 25 0A 3 -2,-0.5 54,-0.5 -7,-0.2 2,-0.3 -0.609 38.7 144.8 -85.0 129.7 19.9 9.1 4.0 33 119 A M E -B 24 0A 0 -9,-3.1 -9,-2.9 -2,-0.4 2,-0.4 -0.843 47.2 -97.3-145.1 179.3 16.2 9.0 4.7 34 120 A A E -BC 23 84A 9 50,-3.0 50,-3.1 -2,-0.3 2,-0.5 -0.894 28.0-154.0-104.2 141.2 12.9 7.7 3.4 35 121 A L E -BC 22 83A 0 -13,-2.7 -13,-2.2 -2,-0.4 2,-0.6 -0.959 3.0-160.2-117.5 111.4 10.6 10.0 1.4 36 122 A K E -BC 21 82A 44 46,-2.5 46,-2.9 -2,-0.5 2,-0.5 -0.824 10.6-159.0 -88.6 122.8 6.9 9.2 1.4 37 123 A V E - C 0 81A 9 -17,-2.8 2,-0.4 -2,-0.6 44,-0.2 -0.891 9.5-175.1-104.3 128.4 5.2 10.8 -1.6 38 124 A L E - C 0 80A 8 42,-3.1 42,-3.0 -2,-0.5 2,-0.6 -0.986 23.0-129.3-123.7 137.9 1.4 11.4 -1.4 39 125 A F E > - C 0 79A 77 -21,-2.7 4,-2.0 -2,-0.4 40,-0.2 -0.751 10.5-150.2 -88.0 120.8 -0.8 12.8 -4.3 40 126 A K H > S+ 0 0 17 38,-2.0 4,-2.0 -2,-0.6 -1,-0.1 0.846 94.2 51.6 -57.2 -41.2 -3.0 15.6 -3.1 41 127 A S H > S+ 0 0 80 37,-0.4 4,-2.6 2,-0.2 -1,-0.2 0.894 109.9 47.6 -66.5 -43.1 -5.7 14.9 -5.6 42 128 A Q H > S+ 0 0 60 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.864 111.1 52.4 -67.4 -36.2 -6.1 11.2 -4.7 43 129 A L H X>S+ 0 0 2 -4,-2.0 5,-2.2 2,-0.2 4,-0.7 0.901 112.6 45.0 -62.8 -43.5 -6.1 12.1 -1.0 44 130 A E H <5S+ 0 0 115 -4,-2.0 3,-0.4 3,-0.2 -2,-0.2 0.910 112.3 51.5 -67.1 -43.3 -8.9 14.6 -1.6 45 131 A K H <5S+ 0 0 173 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.899 111.6 46.1 -60.4 -44.4 -10.9 12.1 -3.8 46 132 A E H <5S- 0 0 101 -4,-2.2 -1,-0.2 -5,-0.1 -2,-0.2 0.641 111.0-126.3 -73.1 -15.8 -10.7 9.4 -1.2 47 133 A G T <5S+ 0 0 49 -4,-0.7 -3,-0.2 -3,-0.4 3,-0.2 0.810 71.7 125.1 74.6 34.6 -11.7 11.9 1.4 48 134 A V >< + 0 0 18 -5,-2.2 4,-2.8 -6,-0.2 5,-0.2 0.118 25.8 114.3-110.8 20.2 -8.8 11.2 3.8 49 135 A E H > S+ 0 0 53 -6,-0.4 4,-2.2 1,-0.2 -1,-0.1 0.910 83.2 41.3 -60.2 -47.6 -7.3 14.8 4.2 50 136 A H H > S+ 0 0 137 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.825 112.8 56.0 -72.4 -32.5 -8.1 15.1 7.9 51 137 A Q H > S+ 0 0 101 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.951 110.3 45.6 -55.0 -53.6 -7.1 11.5 8.5 52 138 A L H X S+ 0 0 15 -4,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.908 111.3 50.4 -60.8 -45.8 -3.7 12.3 7.0 53 139 A R H X S+ 0 0 81 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.789 110.2 51.9 -67.3 -26.6 -3.2 15.5 8.8 54 140 A R H X S+ 0 0 109 -4,-1.5 4,-2.7 2,-0.2 -1,-0.2 0.927 110.3 47.5 -69.0 -49.0 -4.0 13.7 12.1 55 141 A E H X S+ 0 0 46 -4,-2.3 4,-2.5 1,-0.2 5,-0.2 0.888 114.9 46.8 -56.7 -43.7 -1.4 11.0 11.4 56 142 A I H X S+ 0 0 2 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.918 110.8 51.3 -67.4 -46.4 1.1 13.7 10.5 57 143 A E H X S+ 0 0 77 -4,-2.2 4,-0.6 -5,-0.2 -2,-0.2 0.960 115.3 42.7 -54.8 -51.9 0.3 15.8 13.6 58 144 A I H >< S+ 0 0 16 -4,-2.7 3,-1.3 1,-0.2 -2,-0.2 0.969 119.0 40.8 -60.5 -59.2 0.7 12.7 15.9 59 145 A Q H >< S+ 0 0 11 -4,-2.5 3,-1.3 1,-0.2 11,-0.5 0.825 108.6 59.5 -63.0 -34.2 3.9 11.2 14.3 60 146 A S H 3< S+ 0 0 26 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.611 105.0 51.7 -71.7 -11.6 5.7 14.6 13.7 61 147 A H T << S+ 0 0 112 -3,-1.3 2,-0.5 -4,-0.6 -1,-0.3 0.265 90.7 94.0-107.9 9.1 5.6 15.3 17.5 62 148 A L < - 0 0 6 -3,-1.3 2,-0.4 -4,-0.1 8,-0.4 -0.900 45.8-178.9-108.4 130.8 7.1 12.0 18.7 63 149 A R + 0 0 122 -2,-0.5 5,-0.1 6,-0.1 6,-0.0 -0.846 28.2 130.4-129.4 94.9 10.8 11.5 19.4 64 150 A H > - 0 0 23 3,-0.4 3,-2.1 -2,-0.4 -2,-0.0 -0.999 61.1-124.0-147.4 141.3 11.7 8.0 20.5 65 151 A P T 3 S+ 0 0 42 0, 0.0 4,-0.1 0, 0.0 -1,-0.1 0.721 114.7 45.6 -57.5 -21.5 14.4 5.5 19.4 66 152 A N T 3 S+ 0 0 1 47,-0.1 80,-2.8 79,-0.1 2,-0.4 0.163 99.1 78.0-111.6 19.2 11.6 2.9 18.7 67 153 A I B < S-e 146 0B 2 -3,-2.1 -3,-0.4 78,-0.3 2,-0.2 -0.997 91.3-111.3-123.2 128.1 9.2 5.2 16.9 68 154 A L - 0 0 8 78,-2.7 2,-0.2 -2,-0.4 -6,-0.1 -0.423 40.3-125.5 -60.6 125.1 10.0 6.0 13.2 69 155 A R - 0 0 37 -2,-0.2 16,-2.8 -4,-0.1 2,-0.6 -0.493 13.7-153.5 -78.5 139.6 11.0 9.6 13.1 70 156 A M E -D 84 0A 9 -11,-0.5 14,-0.2 -8,-0.4 3,-0.1 -0.966 11.8-172.8-106.1 109.6 9.3 12.2 10.9 71 157 A Y E - 0 0 23 12,-2.1 2,-0.3 -2,-0.6 13,-0.1 0.877 58.1 -52.7 -68.3 -41.9 12.0 14.8 10.4 72 158 A N E -D 83 0A 6 11,-1.0 11,-2.3 -3,-0.1 2,-0.3 -0.938 51.2-132.7-178.1-176.3 9.8 17.3 8.5 73 159 A Y E +D 82 0A 23 -2,-0.3 2,-0.3 9,-0.2 -71,-0.2 -0.973 16.4 179.0-155.3 161.2 7.5 17.5 5.5 74 160 A F E -D 81 0A 6 7,-2.1 7,-3.2 -2,-0.3 2,-0.3 -0.929 11.0-146.2-153.7 174.6 6.9 19.7 2.5 75 161 A H E -D 80 0A 27 -2,-0.3 5,-0.2 -73,-0.3 2,-0.2 -0.985 7.3-170.6-146.6 157.9 4.6 20.0 -0.5 76 162 A D - 0 0 45 3,-2.3 -73,-0.0 -2,-0.3 5,-0.0 -0.531 57.0 -63.1-126.4-159.2 4.6 21.2 -4.1 77 163 A R S S+ 0 0 187 1,-0.2 3,-0.0 -2,-0.2 -2,-0.0 0.852 129.8 11.3 -57.1 -39.6 1.8 21.6 -6.7 78 164 A K S S+ 0 0 115 -38,-0.1 -38,-2.0 1,-0.1 -37,-0.4 0.550 119.0 58.0-117.7 -17.3 0.7 18.0 -6.8 79 165 A R E -C 39 0A 92 -40,-0.2 -3,-2.3 -39,-0.1 2,-0.4 -0.894 53.0-148.9-132.0 149.8 2.5 16.1 -3.9 80 166 A I E -CD 38 75A 0 -42,-3.0 -42,-3.1 -2,-0.3 2,-0.5 -0.972 25.3-157.5-109.8 130.7 2.9 16.0 -0.2 81 167 A Y E -CD 37 74A 8 -7,-3.2 -7,-2.1 -2,-0.4 2,-0.5 -0.954 5.9-160.5-115.5 129.9 6.3 14.7 0.9 82 168 A L E -CD 36 73A 14 -46,-2.9 -46,-2.5 -2,-0.5 2,-0.8 -0.943 10.7-147.4-111.8 121.3 7.1 13.2 4.3 83 169 A M E +CD 35 72A 0 -11,-2.3 -12,-2.1 -2,-0.5 -11,-1.0 -0.787 31.8 177.8 -89.2 108.2 10.7 13.0 5.4 84 170 A L E -CD 34 70A 20 -50,-3.1 -50,-3.0 -2,-0.8 -14,-0.2 -0.803 36.1 -95.3-118.8 150.3 11.0 9.9 7.4 85 171 A E - 0 0 34 -16,-2.8 2,-0.4 -2,-0.3 -52,-0.1 -0.394 43.8-123.1 -55.3 131.8 13.7 7.9 9.2 86 172 A F - 0 0 26 -54,-0.5 -1,-0.1 -2,-0.1 -17,-0.1 -0.703 16.7-153.3 -81.5 132.1 15.1 5.2 7.0 87 173 A A > - 0 0 8 -2,-0.4 3,-2.1 1,-0.1 51,-0.3 -0.868 5.3-162.8-110.3 95.8 14.8 1.7 8.6 88 174 A P T 3 S+ 0 0 45 0, 0.0 51,-0.2 0, 0.0 -1,-0.1 0.752 85.1 50.8 -54.4 -34.8 17.7 -0.3 7.0 89 175 A R T 3 S- 0 0 139 49,-1.8 50,-0.2 1,-0.2 6,-0.1 0.492 97.0-156.4 -88.6 -0.8 16.3 -3.7 7.9 90 176 A G E < +F 138 0B 25 -3,-2.1 48,-1.5 48,-0.7 2,-0.2 -0.239 46.2 15.7 73.8-150.7 12.9 -3.1 6.5 91 177 A E E > -F 137 0B 80 46,-0.2 4,-1.3 1,-0.1 46,-0.2 -0.428 50.5-154.4 -72.5 126.3 9.5 -4.7 7.3 92 178 A L H > S+ 0 0 0 44,-2.3 4,-2.4 41,-0.4 3,-0.2 0.883 96.5 59.5 -63.0 -38.0 9.3 -6.7 10.5 93 179 A Y H > S+ 0 0 66 40,-0.7 4,-2.7 43,-0.5 -1,-0.2 0.868 102.1 52.8 -62.3 -36.1 6.4 -8.7 9.0 94 180 A K H > S+ 0 0 114 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.875 110.2 48.4 -64.3 -37.6 8.7 -9.9 6.2 95 181 A E H X S+ 0 0 50 -4,-1.3 4,-1.9 2,-0.2 -2,-0.2 0.874 111.8 48.6 -68.9 -41.4 11.3 -11.0 8.7 96 182 A L H X S+ 0 0 9 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.936 113.0 47.9 -63.2 -46.4 8.7 -12.9 10.7 97 183 A Q H < S+ 0 0 144 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.882 110.6 52.7 -59.3 -41.3 7.3 -14.5 7.5 98 184 A K H < S+ 0 0 164 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.877 120.1 32.5 -61.8 -41.9 10.9 -15.5 6.5 99 185 A H H < S- 0 0 99 -4,-1.9 2,-1.5 1,-0.1 -2,-0.2 0.618 93.5-139.2 -93.4 -16.8 11.6 -17.2 9.9 100 186 A G S < S+ 0 0 41 -4,-2.3 2,-0.3 -5,-0.2 -1,-0.1 -0.423 80.4 7.7 86.2 -61.2 8.1 -18.5 10.7 101 187 A R S S- 0 0 124 -2,-1.5 2,-0.3 98,-0.1 96,-0.2 -0.977 78.4-117.1-145.1 158.6 8.5 -17.5 14.3 102 188 A F - 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0 0 97 -5,-2.1 -1,-0.2 -6,-0.2 2,-0.1 -0.420 60.9 -84.5 -82.9 159.9 12.2 71.6 51.5 456 265 B T - 0 0 65 -2,-0.1 2,-0.3 -20,-0.1 -18,-0.2 -0.435 55.6-160.5 -59.0 135.4 11.1 69.5 54.4 457 266 B H B -R 437 0H 4 -20,-3.0 -20,-2.6 -2,-0.1 2,-0.2 -0.809 14.0-169.9-123.2 162.2 12.5 66.0 53.8 458 267 B D > - 0 0 37 -2,-0.3 3,-1.8 -22,-0.2 4,-0.2 -0.585 53.3 -62.2-132.1-163.1 11.8 62.4 55.0 459 268 B E T > S+ 0 0 36 -24,-0.3 3,-1.6 1,-0.3 4,-0.4 0.654 116.3 79.5 -61.5 -16.6 13.3 58.9 55.0 460 269 B K T 3> S+ 0 0 46 1,-0.3 4,-1.7 2,-0.2 -1,-0.3 0.584 71.0 79.7 -75.0 -9.5 13.0 58.9 51.1 461 270 B V H <> S+ 0 0 2 -3,-1.8 4,-2.2 1,-0.2 -1,-0.3 0.873 90.6 55.7 -56.4 -35.7 16.2 61.0 50.9 462 271 B D H <> S+ 0 0 0 -3,-1.6 4,-2.1 -4,-0.2 -1,-0.2 0.808 101.5 55.5 -70.2 -29.6 17.9 57.7 51.5 463 272 B L H > S+ 0 0 12 -4,-0.4 4,-1.6 -3,-0.2 -1,-0.2 0.912 108.9 47.6 -68.3 -42.9 16.2 56.1 48.4 464 273 B W H >X S+ 0 0 0 -4,-1.7 4,-2.1 2,-0.2 3,-0.6 0.967 112.2 48.2 -58.1 -55.2 17.5 58.9 46.2 465 274 B C H 3X S+ 0 0 4 -4,-2.2 4,-2.7 1,-0.3 -2,-0.2 0.863 107.3 57.2 -58.6 -36.6 21.1 58.6 47.6 466 275 B A H 3X S+ 0 0 2 -4,-2.1 4,-2.1 1,-0.2 -1,-0.3 0.882 107.1 49.2 -57.3 -39.9 20.8 54.8 47.1 467 276 B G H - 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0 0 34 -3,-1.4 2,-2.1 -4,-0.2 -3,-0.2 0.914 35.0-173.7 42.5 55.9 17.0 64.8 37.2 496 305 B D < + 0 0 32 -5,-2.9 2,-0.2 -6,-0.1 -1,-0.2 -0.486 7.0 180.0 -84.9 73.7 19.2 65.3 34.1 497 306 B L - 0 0 37 -2,-2.1 2,-0.3 -3,-0.2 -17,-0.1 -0.553 18.7-176.6 -78.5 139.0 20.5 61.7 33.8 498 307 B K - 0 0 132 -19,-0.3 -2,-0.1 -2,-0.2 -1,-0.0 -0.736 17.2-157.9-132.3 81.2 22.8 60.8 31.0 499 308 B F - 0 0 50 -2,-0.3 -2,-0.0 1,-0.1 9,-0.0 -0.412 20.6-118.2 -62.8 127.1 23.3 57.0 31.4 500 309 B P > - 0 0 23 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 -0.336 22.1-117.7 -58.0 145.9 26.6 55.8 29.7 501 310 B P T 3 S+ 0 0 134 0, 0.0 -2,-0.1 0, 0.0 0, 0.0 0.628 108.1 69.5 -61.6 -15.1 26.0 53.3 26.9 502 311 B F T 3 S+ 0 0 100 2,-0.1 2,-0.2 -27,-0.0 -3,-0.0 0.551 76.8 101.0 -83.9 -7.1 27.9 50.6 28.8 503 312 B L S < S- 0 0 12 -3,-1.5 2,-0.0 1,-0.1 -28,-0.0 -0.571 74.5-119.7 -79.7 140.3 25.2 50.2 31.5 504 313 B S > - 0 0 35 -2,-0.2 4,-2.0 1,-0.1 5,-0.2 -0.320 21.7-113.4 -72.1 160.3 22.8 47.3 31.2 505 314 B D H > S+ 0 0 131 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.881 115.7 56.8 -59.1 -41.0 19.0 47.8 30.9 506 315 B G H > S+ 0 0 24 2,-0.2 4,-2.0 1,-0.2 27,-0.2 0.908 108.1 44.3 -58.8 -48.7 18.5 46.2 34.3 507 316 B S H > S+ 0 0 0 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.901 113.5 50.5 -64.6 -42.9 20.8 48.7 36.2 508 317 B K H X S+ 0 0 64 -4,-2.0 4,-2.6 1,-0.2 -1,-0.2 0.867 108.4 54.1 -63.7 -38.1 19.3 51.7 34.3 509 318 B D H X S+ 0 0 62 -4,-2.2 4,-1.5 2,-0.2 -2,-0.2 0.962 111.2 44.3 -58.9 -51.4 15.8 50.5 35.2 510 319 B L H X S+ 0 0 0 -4,-2.0 4,-1.2 1,-0.2 3,-0.3 0.934 116.1 45.9 -58.8 -50.8 16.7 50.4 38.9 511 320 B I H >X S+ 0 0 0 -4,-2.6 4,-3.1 1,-0.2 3,-0.5 0.907 110.9 52.6 -60.0 -45.3 18.5 53.7 39.0 512 321 B S H 3< S+ 0 0 50 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.785 110.0 50.0 -63.0 -27.9 15.7 55.4 37.0 513 322 B K H 3< S+ 0 0 85 -4,-1.5 10,-2.2 -3,-0.3 -1,-0.2 0.688 115.6 41.9 -84.2 -20.7 13.1 54.1 39.5 514 323 B L H << S+ 0 0 0 -4,-1.2 2,-2.1 -3,-0.5 -2,-0.2 0.845 102.4 67.7 -88.3 -42.5 15.1 55.4 42.5 515 324 B L < + 0 0 4 -4,-3.1 2,-0.4 -5,-0.2 -1,-0.2 -0.425 69.3 146.2 -83.4 66.6 16.2 58.8 41.1 516 325 B R - 0 0 91 -2,-2.1 6,-0.1 -3,-0.2 -21,-0.1 -0.876 48.6-143.0-100.8 137.3 12.7 60.4 41.1 517 326 B Y S S+ 0 0 84 -2,-0.4 -67,-0.2 1,-0.1 -1,-0.1 0.952 91.9 65.3 -59.6 -48.9 12.2 64.0 41.7 518 327 B H S > S- 0 0 98 1,-0.2 3,-2.0 -3,-0.1 4,-0.5 -0.657 83.3-144.5 -82.0 113.3 8.9 63.4 43.6 519 328 B P G > S+ 0 0 26 0, 0.0 3,-1.8 0, 0.0 -1,-0.2 0.830 92.9 57.5 -52.7 -45.3 9.9 61.5 46.8 520 329 B P G 3 S+ 0 0 83 0, 0.0 -2,-0.0 0, 0.0 -3,-0.0 0.684 100.1 61.5 -60.3 -17.7 6.8 59.2 47.0 521 330 B Q G < S+ 0 0 97 -3,-2.0 -4,-0.1 2,-0.1 -3,-0.0 0.650 78.9 112.6 -78.7 -16.8 7.5 57.9 43.5 522 331 B R S < S- 0 0 6 -3,-1.8 -8,-0.2 -4,-0.5 -9,-0.1 -0.297 82.2-100.5 -64.3 136.2 10.9 56.5 44.5 523 332 B L - 0 0 35 -10,-2.2 -1,-0.1 -13,-0.2 5,-0.1 -0.350 44.0-117.0 -54.2 125.3 11.1 52.7 44.4 524 333 B P > - 0 0 80 0, 0.0 4,-1.6 0, 0.0 3,-0.5 -0.298 21.5-110.1 -64.5 156.8 10.8 51.4 48.0 525 334 B L H > S+ 0 0 9 1,-0.3 4,-2.3 2,-0.2 5,-0.2 0.861 121.7 56.5 -53.3 -39.1 13.7 49.6 49.6 526 335 B K H > S+ 0 0 121 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.903 106.5 50.9 -60.1 -39.5 11.7 46.4 49.5 527 336 B G H > S+ 0 0 14 -3,-0.5 4,-0.7 2,-0.2 -1,-0.2 0.796 106.8 53.7 -68.8 -30.6 11.4 46.9 45.7 528 337 B V H >< S+ 0 0 0 -4,-1.6 3,-0.9 2,-0.2 6,-0.2 0.949 109.9 46.8 -64.2 -49.3 15.1 47.4 45.4 529 338 B M H 3< S+ 0 0 34 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.828 118.4 42.9 -64.8 -30.3 15.8 44.1 47.1 530 339 B E H 3< S+ 0 0 116 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.493 84.1 126.3 -89.1 -10.5 13.1 42.4 44.9 531 340 B H S+ 0 0 94 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.837 109.4 51.0 -51.8 -36.7 15.0 41.7 38.9 533 342 B W H > S+ 0 0 12 -27,-0.2 4,-1.6 2,-0.2 5,-0.2 0.898 112.1 46.2 -69.2 -41.4 18.5 43.1 38.3 534 343 B V H > S+ 0 0 0 -3,-0.3 4,-2.5 -6,-0.2 -1,-0.2 0.946 114.6 48.2 -62.2 -47.5 19.4 42.9 42.0 535 344 B K H < S+ 0 0 135 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.920 114.2 45.3 -59.8 -45.5 18.0 39.3 42.2 536 345 B A H < S+ 0 0 63 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.797 124.9 30.5 -68.4 -30.3 19.8 38.1 39.1 537 346 B N H < S+ 0 0 25 -4,-1.6 -151,-0.3 -5,-0.2 -2,-0.2 0.634 86.8 107.4-111.0 -18.5 23.2 39.7 40.0 538 347 B S < - 0 0 16 -4,-2.5 -155,-0.1 -153,-0.2 -156,-0.1 -0.408 35.9-178.4 -66.3 136.6 23.5 39.8 43.8 539 348 B R + 0 0 153 -157,-0.5 -1,-0.1 -2,-0.1 -4,-0.1 -0.274 25.3 169.0-122.9 41.3 26.0 37.3 45.3 540 349 B R - 0 0 47 -155,-0.0 2,-0.4 1,-0.0 -153,-0.0 -0.269 16.5-166.7 -66.6 138.9 25.3 38.4 48.9 541 350 B V - 0 0 72 -123,-0.1 -123,-0.1 -155,-0.0 -2,-0.1 -0.983 15.0-135.2-124.2 139.2 26.6 36.4 51.8 542 351 B L - 0 0 116 -2,-0.4 3,-0.1 1,-0.1 0, 0.0 -0.753 36.1 -98.7 -89.9 138.1 25.5 36.7 55.4 543 352 B P - 0 0 41 0, 0.0 -1,-0.1 0, 0.0 23,-0.1 -0.308 56.4 -87.6 -52.5 136.8 28.2 36.8 58.1 544 353 B P - 0 0 38 0, 0.0 2,-0.3 0, 0.0 23,-0.0 -0.007 40.0-109.8 -47.0 147.3 28.6 33.3 59.6 545 354 B V 0 0 131 -3,-0.1 -3,-0.0 21,-0.1 0, 0.0 -0.655 360.0 360.0 -78.0 136.2 26.4 32.3 62.6 546 355 B Y 0 0 141 -2,-0.3 23,-0.1 21,-0.1 21,-0.1 -0.520 360.0 360.0 -86.0 360.0 28.5 32.0 65.8 547 !* 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 0.0 548 798 C I 0 0 187 0, 0.0 5,-0.1 0, 0.0 -258,-0.1 0.000 360.0 360.0 360.0 -58.6 54.5 46.8 66.2 549 799 C P >> - 0 0 39 0, 0.0 3,-1.1 0, 0.0 4,-0.5 -0.226 360.0-129.4 -60.5 138.3 52.6 44.2 68.3 550 800 C A G >4 S+ 0 0 68 1,-0.3 3,-1.4 2,-0.2 6,-0.3 0.858 106.2 56.7 -52.5 -44.8 52.9 40.7 66.9 551 801 C W G 34 S+ 0 0 39 1,-0.3 -1,-0.3 5,-0.1 9,-0.2 0.812 110.2 47.0 -58.5 -30.1 49.1 40.1 67.0 552 802 C A G <4 S+ 0 0 16 -3,-1.1 -1,-0.3 4,-0.1 -2,-0.2 0.456 85.7 114.0 -91.3 -7.3 48.6 43.2 64.8 553 803 C S S XX S- 0 0 51 -3,-1.4 4,-2.8 -4,-0.5 3,-0.6 -0.465 81.9-103.7 -70.6 141.0 51.3 42.4 62.3 554 804 C G H 3> S+ 0 0 49 1,-0.2 4,-2.0 2,-0.2 -1,-0.1 0.758 114.0 39.3 -26.7 -67.5 50.1 41.7 58.7 555 805 C N H 3> S+ 0 0 137 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.853 118.7 45.4 -64.8 -41.2 50.3 37.9 58.6 556 806 C L H <> S+ 0 0 101 -3,-0.6 4,-2.1 -6,-0.3 -1,-0.2 0.913 112.1 54.1 -66.5 -43.1 49.2 37.1 62.1 557 807 C L H X S+ 0 0 29 -4,-2.8 4,-2.9 -7,-0.2 5,-0.2 0.903 102.5 55.7 -58.5 -46.2 46.3 39.6 61.8 558 808 C T H X S+ 0 0 76 -4,-2.0 4,-1.7 -5,-0.2 -1,-0.2 0.858 111.4 43.5 -60.1 -39.5 44.9 38.0 58.6 559 809 C Q H X S+ 0 0 115 -4,-1.1 4,-2.0 -3,-0.2 -1,-0.2 0.871 114.1 50.1 -73.8 -38.0 44.5 34.6 60.2 560 810 C A H X S+ 0 0 36 -4,-2.1 4,-1.8 2,-0.2 -2,-0.2 0.877 111.3 49.2 -65.3 -39.1 43.1 36.0 63.4 561 811 C I H X S+ 0 0 11 -4,-2.9 4,-2.0 2,-0.2 -2,-0.2 0.913 110.0 52.4 -65.2 -42.1 40.5 38.0 61.5 562 812 C R H X S+ 0 0 119 -4,-1.7 4,-2.0 -5,-0.2 -2,-0.2 0.912 110.4 45.8 -59.3 -48.3 39.6 34.9 59.5 563 813 C Q H X S+ 0 0 136 -4,-2.0 4,-2.7 1,-0.2 -1,-0.2 0.863 111.7 53.0 -64.5 -38.7 39.0 32.8 62.6 564 814 C Q H < S+ 0 0 39 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.837 109.4 49.7 -66.3 -35.3 37.0 35.6 64.2 565 815 C Y H < S+ 0 0 30 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.891 119.3 35.7 -68.9 -42.5 34.8 35.8 61.1 566 816 C Y H < S+ 0 0 88 -4,-2.0 -2,-0.2 1,-0.2 -3,-0.2 0.714 128.8 35.0 -87.1 -24.2 34.1 32.1 61.0 567 817 C K S < S+ 0 0 147 -4,-2.7 -1,-0.2 -5,-0.2 -21,-0.1 -0.595 83.7 177.3-125.8 69.7 33.9 31.6 64.8 568 818 C P - 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