==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 31-MAY-08 3DBE . COMPND 2 MOLECULE: POLO-LIKE KINASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: DANIO RERIO; . AUTHOR R.A.ELLING,K.J.BARR,M.J.ROMANOWSKI . 283 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14850.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 188 66.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 46 16.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 . 17 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 12.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 80 28.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.4 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 1 0 2 0 0 0 0 1 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 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 1 2 1 0 1 2 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 1 0 1 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 24 A K 0 0 191 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 138.7 25.4 87.0 63.3 2 25 A E - 0 0 148 1,-0.1 3,-0.0 3,-0.0 0, 0.0 -0.230 360.0-136.4 -55.5 133.0 24.4 89.8 60.9 3 26 A I - 0 0 17 1,-0.1 -1,-0.1 84,-0.0 4,-0.0 -0.801 33.8-103.1 -91.6 132.1 25.3 89.3 57.2 4 27 A P - 0 0 41 0, 0.0 14,-0.2 0, 0.0 -1,-0.1 -0.252 12.3-140.2 -63.8 140.9 26.7 92.4 55.6 5 28 A D S S+ 0 0 103 1,-0.1 13,-2.6 12,-0.1 2,-0.4 0.809 96.4 41.0 -64.4 -33.0 24.6 94.6 53.3 6 29 A V E S-A 17 0A 62 11,-0.2 2,-0.6 27,-0.0 11,-0.3 -0.979 77.8-152.7-120.5 131.0 27.6 95.0 51.0 7 30 A L E +A 16 0A 6 9,-4.1 9,-2.4 -2,-0.4 2,-0.3 -0.898 19.2 173.9-112.9 110.3 29.9 92.1 50.2 8 31 A V E A 15 0A 83 -2,-0.6 7,-0.2 7,-0.2 -2,-0.0 -0.864 360.0 360.0-114.1 143.6 33.5 92.9 49.3 9 32 A D 0 0 26 5,-0.9 4,-0.9 -2,-0.3 76,-0.1 -0.955 360.0 360.0-110.6 360.0 36.4 90.6 48.7 10 ! 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 11 34 A R 0 0 98 0, 0.0 72,-0.1 0, 0.0 -2,-0.0 0.000 360.0 360.0 360.0-113.1 40.6 89.3 45.8 12 35 A T - 0 0 72 1,-0.1 3,-0.1 2,-0.0 69,-0.0 0.635 360.0-142.2 -51.6 -16.9 38.6 90.7 42.8 13 36 A M + 0 0 141 -4,-0.9 2,-0.3 1,-0.2 -1,-0.1 0.733 49.1 144.0 54.7 29.8 37.9 93.7 45.1 14 37 A K - 0 0 98 -5,-0.0 -5,-0.9 22,-0.0 2,-0.4 -0.694 48.1-126.3 -93.0 150.0 34.4 94.1 43.7 15 38 A R E -A 8 0A 26 -2,-0.3 21,-3.3 -7,-0.2 2,-0.5 -0.844 19.5-162.4 -99.9 130.8 31.5 95.1 45.9 16 39 A Y E -AB 7 35A 8 -9,-2.4 -9,-4.1 -2,-0.4 2,-0.6 -0.952 10.3-145.2-116.5 118.2 28.3 93.0 46.1 17 40 A M E -AB 6 34A 105 17,-2.7 17,-2.0 -2,-0.5 2,-0.4 -0.711 20.1-131.0 -82.6 117.2 25.0 94.4 47.4 18 41 A R E + B 0 33A 63 -13,-2.6 15,-0.2 -2,-0.6 3,-0.1 -0.562 39.4 168.7 -69.2 119.7 23.1 91.7 49.3 19 42 A G E - 0 0 24 13,-2.7 14,-0.1 -2,-0.4 -1,-0.1 0.012 39.0 -4.4-111.0-143.1 19.5 91.7 48.0 20 43 A R E - 0 0 152 11,-0.2 12,-2.7 1,-0.1 2,-0.3 -0.236 68.1-114.8 -65.8 134.1 16.4 89.5 48.3 21 44 A F E - B 0 31A 95 10,-0.2 10,-0.3 1,-0.2 -1,-0.1 -0.504 29.9-177.0 -63.3 122.7 16.7 86.2 50.1 22 45 A L E - 0 0 73 8,-2.9 2,-0.3 1,-0.3 9,-0.2 0.822 48.7 -83.9 -94.0 -39.5 16.1 83.4 47.6 23 46 A G E - B 0 30A 24 7,-1.7 7,-4.1 2,-0.0 -1,-0.3 -0.951 38.7 -82.4 158.2-171.3 16.2 80.5 50.0 24 47 A K E - B 0 29A 173 -2,-0.3 2,-0.3 5,-0.3 5,-0.2 -0.895 17.6-175.4-130.6 153.5 18.3 77.9 52.0 25 48 A G E > - B 0 28A 50 3,-2.8 3,-1.6 -2,-0.3 2,-0.7 -0.777 67.7 -48.7-150.7 101.1 20.0 74.6 51.6 26 49 A G T 3 S- 0 0 88 1,-0.3 -2,-0.0 -2,-0.3 0, 0.0 -0.674 125.1 -19.0 77.3-114.6 21.6 72.8 54.5 27 50 A F T 3 S+ 0 0 48 -2,-0.7 -1,-0.3 -3,-0.1 2,-0.2 0.614 121.5 97.3 -93.6 -18.9 23.8 75.4 56.3 28 51 A A E < -B 25 0A 14 -3,-1.6 -3,-2.8 19,-0.1 2,-0.4 -0.450 53.9-165.5 -78.2 140.4 23.8 77.6 53.2 29 52 A K E -BC 24 46A 95 17,-2.1 17,-2.4 -5,-0.2 2,-0.5 -0.996 13.7-146.0-122.4 134.1 21.5 80.6 52.7 30 53 A C E +BC 23 45A 33 -7,-4.1 -8,-2.9 -2,-0.4 -7,-1.7 -0.878 18.2 178.2-112.2 123.0 21.2 82.0 49.2 31 54 A Y E -BC 21 44A 30 13,-2.0 13,-1.9 -2,-0.5 2,-0.6 -0.869 36.2-110.0-117.0 151.0 20.7 85.7 48.5 32 55 A E E - C 0 43A 31 -12,-2.7 -13,-2.7 -2,-0.3 2,-0.4 -0.728 41.1-164.7 -76.4 121.0 20.4 87.6 45.2 33 56 A I E -BC 18 42A 5 9,-2.9 9,-3.3 -2,-0.6 2,-0.4 -0.940 7.3-156.9-115.7 135.0 23.6 89.7 45.0 34 57 A T E -BC 17 41A 38 -17,-2.0 -17,-2.7 -2,-0.4 2,-0.4 -0.912 24.4-116.6-112.7 133.5 24.2 92.6 42.6 35 58 A D E > -B 16 0A 5 5,-3.2 4,-2.6 -2,-0.4 -19,-0.2 -0.552 21.9-146.5 -68.7 121.1 27.6 93.9 41.4 36 59 A M T 4 S+ 0 0 82 -21,-3.3 -1,-0.2 -2,-0.4 -20,-0.1 0.720 93.7 32.7 -69.2 -22.5 27.8 97.4 42.8 37 60 A D T 4 S+ 0 0 138 -22,-0.4 -1,-0.2 3,-0.1 -21,-0.1 0.872 130.7 29.8 -94.2 -49.8 29.9 98.7 39.8 38 61 A T T 4 S- 0 0 64 2,-0.1 -2,-0.2 1,-0.0 3,-0.1 0.576 89.4-136.7 -91.0 -12.8 28.6 96.6 36.9 39 62 A K < + 0 0 143 -4,-2.6 2,-0.2 1,-0.2 -3,-0.1 0.546 52.5 148.7 65.4 7.4 25.0 96.0 38.1 40 63 A E - 0 0 112 -6,-0.1 -5,-3.2 -5,-0.1 2,-0.4 -0.518 41.8-132.3 -73.2 141.4 25.3 92.4 37.0 41 64 A V E +C 34 0A 36 -7,-0.2 54,-0.5 -2,-0.2 2,-0.3 -0.824 28.9 169.8-110.1 134.1 23.3 90.0 39.1 42 65 A F E -CD 33 94A 25 -9,-3.3 -9,-2.9 -2,-0.4 2,-0.7 -0.863 35.2-115.3-134.4 165.1 24.5 86.7 40.7 43 66 A A E -CD 32 93A 13 50,-2.8 50,-1.4 -2,-0.3 2,-0.6 -0.893 32.6-161.2-109.4 106.0 23.3 84.1 43.2 44 67 A G E -CD 31 92A 5 -13,-1.9 -13,-2.0 -2,-0.7 2,-0.3 -0.785 9.4-148.7 -97.0 115.9 25.5 84.0 46.2 45 68 A K E -CD 30 91A 58 46,-1.8 46,-2.0 -2,-0.6 2,-0.5 -0.626 16.4-156.0 -69.6 133.2 25.5 81.1 48.6 46 69 A V E +CD 29 90A 5 -17,-2.4 -17,-2.1 -2,-0.3 44,-0.2 -0.974 15.2 176.7-116.9 119.4 26.3 82.3 52.1 47 70 A V E - D 0 89A 17 42,-2.1 42,-3.9 -2,-0.5 2,-0.2 -0.984 24.2-132.9-119.2 129.9 27.8 79.8 54.6 48 71 A P E >> - D 0 88A 33 0, 0.0 3,-1.4 0, 0.0 4,-0.8 -0.580 14.7-130.0 -77.5 146.7 28.9 80.8 58.1 49 72 A K T 34 S+ 0 0 65 38,-3.4 3,-0.2 1,-0.3 39,-0.1 0.775 107.9 70.5 -60.7 -27.8 32.3 79.7 59.4 50 73 A S T >4 S+ 0 0 83 37,-0.5 3,-0.6 1,-0.2 -1,-0.3 0.727 95.1 53.0 -61.4 -25.2 30.4 78.5 62.4 51 74 A M T <4 S+ 0 0 40 -3,-1.4 3,-0.3 1,-0.2 -1,-0.2 0.830 113.7 42.2 -77.0 -35.4 29.0 75.7 60.2 52 75 A L T 3< S+ 0 0 36 -4,-0.8 -1,-0.2 -3,-0.2 -2,-0.2 -0.247 70.7 127.2-104.8 42.7 32.5 74.7 59.1 53 76 A L < + 0 0 142 -3,-0.6 -1,-0.2 4,-0.1 -3,-0.1 0.800 62.5 76.8 -65.8 -28.2 34.2 74.9 62.5 54 77 A K S > S- 0 0 116 -3,-0.3 4,-1.6 1,-0.1 5,-0.1 -0.642 80.7-140.8 -79.5 137.2 35.3 71.4 61.8 55 78 A P H > S+ 0 0 110 0, 0.0 4,-0.8 0, 0.0 -1,-0.1 0.786 101.8 60.5 -63.2 -30.2 38.3 70.9 59.4 56 79 A H H >> S+ 0 0 100 2,-0.2 4,-1.2 1,-0.2 3,-0.5 0.928 108.6 39.0 -62.6 -50.7 36.5 67.8 58.0 57 80 A Q H 3> S+ 0 0 82 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.862 108.9 63.9 -67.6 -37.4 33.3 69.7 56.8 58 81 A K H 3X S+ 0 0 36 -4,-1.6 4,-1.0 1,-0.2 -1,-0.2 0.722 101.0 53.4 -58.9 -25.7 35.5 72.6 55.7 59 82 A E H XX S+ 0 0 105 -4,-0.8 4,-1.9 -3,-0.5 3,-0.7 0.957 98.8 59.3 -72.3 -54.8 37.1 70.3 53.2 60 83 A K H 3X S+ 0 0 84 -4,-1.2 4,-1.5 1,-0.3 -2,-0.2 0.788 109.5 46.1 -46.5 -35.0 33.8 69.1 51.6 61 84 A M H 3X S+ 0 0 30 -4,-1.2 4,-2.3 2,-0.2 -1,-0.3 0.841 113.1 47.2 -79.0 -35.8 33.1 72.7 50.6 62 85 A S H X S+ 0 0 15 -4,-2.1 3,-0.6 2,-0.2 4,-0.6 0.946 117.0 49.2 -66.0 -50.9 35.6 71.2 41.0 68 91 A H H >< S+ 0 0 10 -4,-2.8 3,-1.8 1,-0.2 11,-0.3 0.903 104.6 59.3 -58.0 -44.0 32.9 73.9 40.2 69 92 A K H 3< S+ 0 0 73 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.846 102.5 53.6 -54.3 -38.3 35.6 76.6 39.6 70 93 A S H << S+ 0 0 75 -4,-1.0 -1,-0.3 -3,-0.6 -2,-0.2 0.619 93.3 96.3 -72.4 -15.7 37.1 74.5 36.8 71 94 A L << + 0 0 9 -3,-1.8 8,-0.5 -4,-0.6 2,-0.2 -0.510 39.8 166.6 -85.2 147.0 33.8 74.1 35.0 72 95 A D + 0 0 138 -2,-0.2 6,-0.1 6,-0.1 5,-0.1 -0.718 24.4 128.6-159.1 99.1 32.5 76.3 32.1 73 96 A N > - 0 0 33 3,-0.3 3,-2.3 -2,-0.2 53,-0.0 -0.961 62.6-120.2-158.3 139.0 29.5 75.1 30.2 74 97 A P T 3 S+ 0 0 83 0, 0.0 52,-0.1 0, 0.0 4,-0.1 0.409 117.0 46.9 -54.3 -2.5 26.0 76.4 29.1 75 98 A H T 3 S+ 0 0 26 79,-0.1 80,-2.5 50,-0.1 2,-0.3 0.196 102.5 72.6-128.7 11.0 24.4 73.6 31.1 76 99 A V B < S-f 155 0B 2 -3,-2.3 2,-0.3 78,-0.3 -3,-0.3 -0.931 97.0 -94.3-120.2 148.4 26.4 74.0 34.3 77 100 A V - 0 0 10 78,-2.8 2,-0.1 -2,-0.3 -6,-0.1 -0.494 47.6-113.2 -60.9 119.6 26.0 76.8 36.8 78 101 A G - 0 0 17 -2,-0.3 16,-1.1 17,-0.1 2,-0.6 -0.394 25.9-139.1 -56.2 123.2 28.5 79.5 35.8 79 102 A F E +E 93 0A 28 -8,-0.5 14,-0.2 -11,-0.3 3,-0.1 -0.823 23.4 179.6 -89.0 123.9 31.1 79.7 38.6 80 103 A H E - 0 0 90 12,-2.4 13,-0.1 -2,-0.6 -1,-0.1 -0.275 49.0 -70.6-125.9 47.6 32.0 83.4 39.2 81 104 A G E - 0 0 31 10,-0.1 11,-2.3 -12,-0.0 -1,-0.4 0.053 42.0-133.7 92.6 159.8 34.5 83.5 42.0 82 105 A F E +E 91 0A 89 9,-0.2 2,-0.3 -3,-0.1 9,-0.2 -0.981 25.7 155.2-146.1 157.2 34.5 82.8 45.8 83 106 A F E -E 90 0A 18 7,-1.2 7,-1.9 -2,-0.3 2,-0.3 -0.906 20.9-136.6-161.2-172.1 35.9 84.5 48.9 84 107 A E E -E 89 0A 105 -2,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.980 5.5-160.3-158.4 142.8 35.4 85.0 52.6 85 108 A D - 0 0 56 3,-1.8 -76,-0.0 -2,-0.3 -78,-0.0 -0.488 55.3 -80.7-102.5-170.9 35.4 87.4 55.5 86 109 A D S S+ 0 0 145 -2,-0.2 -37,-0.1 1,-0.2 3,-0.0 0.875 125.6 31.0 -60.1 -41.2 35.9 86.5 59.2 87 110 A D S S+ 0 0 67 1,-0.1 -38,-3.4 -39,-0.1 -37,-0.5 0.857 120.1 35.5 -89.3 -40.6 32.3 85.3 59.8 88 111 A F E -D 48 0A 10 -40,-0.3 -3,-1.8 -39,-0.1 2,-0.5 -0.864 56.7-145.6-124.1 151.5 31.1 83.9 56.5 89 112 A V E -DE 47 84A 8 -42,-3.9 -42,-2.1 -2,-0.3 2,-0.2 -0.977 29.5-162.3-112.0 118.7 32.4 82.0 53.4 90 113 A Y E -DE 46 83A 5 -7,-1.9 -7,-1.2 -2,-0.5 2,-0.4 -0.648 13.6-162.8-103.5 153.4 30.6 83.2 50.2 91 114 A V E -DE 45 82A 11 -46,-2.0 -46,-1.8 -2,-0.2 2,-0.6 -0.985 12.2-147.3-135.4 127.3 30.3 81.6 46.8 92 115 A V E +D 44 0A 1 -11,-2.3 -12,-2.4 -2,-0.4 2,-0.2 -0.851 30.0 167.3-102.3 117.2 29.2 83.7 43.7 93 116 A L E -DE 43 79A 19 -50,-1.4 -50,-2.8 -2,-0.6 2,-0.3 -0.679 40.4 -74.2-128.6 172.7 27.2 81.7 41.2 94 117 A E E -D 42 0A 45 -16,-1.1 2,-0.2 -52,-0.2 -52,-0.1 -0.527 49.5-120.2 -76.0 125.9 25.0 82.1 38.1 95 118 A I - 0 0 28 -54,-0.5 2,-0.5 -2,-0.3 -1,-0.1 -0.430 23.6-168.1 -68.5 132.7 21.5 83.4 38.8 96 119 A C > - 0 0 19 -2,-0.2 3,-0.7 52,-0.1 51,-0.3 -0.823 0.8-171.5-124.1 93.1 18.6 81.1 37.8 97 120 A R T 3 S+ 0 0 121 -2,-0.5 51,-0.2 1,-0.3 3,-0.1 0.380 74.9 62.6 -74.8 3.2 15.4 83.1 37.9 98 121 A R T 3 S- 0 0 88 49,-2.5 -1,-0.3 1,-0.4 50,-0.1 -0.171 97.0-129.3-119.8 42.3 13.0 80.2 37.4 99 122 A R < - 0 0 181 -3,-0.7 48,-2.6 47,-0.1 -1,-0.4 -0.104 48.8 -50.9 45.6-140.9 13.8 78.2 40.5 100 123 A S B > -G 146 0B 4 46,-0.2 4,-1.1 -3,-0.1 46,-0.2 -0.586 48.5 -97.1-119.3-178.6 14.5 74.5 39.8 101 124 A L H > S+ 0 0 0 44,-1.6 4,-2.1 41,-1.4 42,-0.2 0.618 118.0 64.4 -74.9 -13.7 13.0 71.6 37.9 102 125 A L H > S+ 0 0 54 40,-0.7 4,-3.0 2,-0.2 5,-0.3 0.978 98.6 48.7 -69.5 -59.4 11.5 70.4 41.2 103 126 A E H > S+ 0 0 57 1,-0.3 4,-1.4 2,-0.2 -2,-0.2 0.839 114.0 50.7 -50.6 -34.5 9.3 73.4 41.8 104 127 A L H X S+ 0 0 1 -4,-1.1 4,-1.4 2,-0.2 -1,-0.3 0.948 110.5 47.2 -66.6 -51.0 8.2 72.8 38.2 105 128 A H H X S+ 0 0 12 -4,-2.1 4,-3.0 1,-0.2 3,-0.3 0.896 111.4 50.3 -58.1 -45.4 7.5 69.1 38.8 106 129 A K H < S+ 0 0 140 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.882 115.4 43.2 -62.6 -37.9 5.5 69.7 42.0 107 130 A R H < S+ 0 0 163 -4,-1.4 -1,-0.2 -5,-0.3 -2,-0.2 0.672 126.5 32.2 -80.0 -19.0 3.4 72.3 40.3 108 131 A R H < S- 0 0 27 -4,-1.4 -2,-0.2 -3,-0.3 2,-0.2 0.645 80.0-165.5-110.6 -22.3 2.9 70.2 37.1 109 132 A K S < S+ 0 0 124 -4,-3.0 99,-0.3 -5,-0.2 2,-0.3 -0.482 73.2 19.5 54.5-129.3 2.9 66.6 38.2 110 133 A A S S- 0 0 47 97,-0.3 96,-0.2 -2,-0.2 2,-0.2 -0.502 81.5-153.4 -67.5 126.4 3.4 64.5 35.0 111 134 A V - 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0 0 18 -2,-1.2 -40,-0.1 -3,-0.3 15,-0.0 -0.456 23.3-119.0 -71.9 135.9 21.3 56.7 45.0 180 205 A A >> - 0 0 1 -2,-0.2 4,-1.3 1,-0.1 3,-1.3 -0.260 23.2-110.1 -68.4 153.8 22.3 53.7 42.8 181 206 A P H 3> S+ 0 0 16 0, 0.0 4,-2.6 0, 0.0 3,-0.3 0.873 118.6 55.6 -49.0 -44.0 22.2 50.0 44.2 182 207 A E H 34>S+ 0 0 12 1,-0.2 6,-1.0 67,-0.2 5,-0.6 0.653 101.8 57.0 -69.5 -17.6 26.1 49.9 44.1 183 208 A V H X45S+ 0 0 23 -3,-1.3 3,-0.6 3,-0.1 -1,-0.2 0.841 111.5 44.0 -75.4 -35.5 26.3 53.0 46.2 184 209 A L H 3<5S+ 0 0 28 -4,-1.3 -2,-0.2 -3,-0.3 -1,-0.1 0.946 110.8 50.5 -72.7 -50.7 24.3 51.2 48.9 185 210 A C T 3<5S- 0 0 57 -4,-2.6 -1,-0.2 1,-0.1 -3,-0.1 0.240 103.1-130.8 -72.7 14.4 26.0 47.8 48.7 186 211 A K T < 5 + 0 0 162 -3,-0.6 -3,-0.1 1,-0.2 -1,-0.1 0.651 65.8 137.1 41.2 23.4 29.4 49.7 49.1 187 212 A K S - 0 0 15 -2,-0.2 3,-1.6 -20,-0.2 4,-0.3 -0.608 61.1 -36.8-148.6-149.9 31.8 55.3 39.2 191 216 A F T > S+ 0 0 50 1,-0.3 3,-0.9 -2,-0.2 4,-0.5 0.717 118.8 71.4 -57.2 -25.4 30.4 57.3 36.2 192 217 A E T 3> S+ 0 0 33 1,-0.2 4,-1.2 2,-0.2 -1,-0.3 0.493 78.1 75.1 -79.8 -2.7 27.3 55.2 35.9 193 218 A V H <> S+ 0 0 8 -3,-1.6 4,-1.7 1,-0.2 -1,-0.2 0.842 93.7 54.6 -71.2 -33.3 25.7 56.5 39.2 194 219 A D H <> S+ 0 0 0 -3,-0.9 4,-1.9 -4,-0.3 -1,-0.2 0.798 102.5 55.8 -69.6 -30.8 24.8 59.7 37.3 195 220 A I H > S+ 0 0 4 -4,-0.5 4,-3.1 2,-0.2 -1,-0.2 0.903 105.4 53.4 -66.7 -40.9 23.0 57.8 34.6 196 221 A W H X S+ 0 0 1 -4,-1.2 4,-2.4 2,-0.2 -2,-0.2 0.902 106.5 50.9 -59.0 -46.9 20.8 56.2 37.3 197 222 A S H X S+ 0 0 5 -4,-1.7 4,-3.3 2,-0.2 -1,-0.2 0.932 111.7 48.7 -55.6 -45.3 19.9 59.6 38.6 198 223 A L H X S+ 0 0 0 -4,-1.9 4,-3.2 2,-0.2 -2,-0.2 0.941 108.2 52.9 -62.7 -47.6 19.0 60.6 35.1 199 224 A G H X S+ 0 0 0 -4,-3.1 4,-1.9 47,-0.4 -1,-0.2 0.900 113.1 45.9 -50.3 -44.1 16.9 57.5 34.6 200 225 A C H X S+ 0 0 0 -4,-2.4 4,-2.9 46,-0.2 5,-0.3 0.968 111.3 50.3 -63.3 -54.0 15.1 58.4 37.8 201 226 A I H X S+ 0 0 0 -4,-3.3 4,-2.6 1,-0.2 -2,-0.2 0.901 109.4 51.8 -52.3 -46.6 14.6 62.0 36.8 202 227 A L H X S+ 0 0 0 -4,-3.2 4,-3.0 2,-0.2 -1,-0.2 0.926 112.8 46.0 -55.5 -50.1 13.2 60.9 33.4 203 228 A Y H X>S+ 0 0 15 -4,-1.9 4,-3.3 -5,-0.2 5,-0.5 0.985 111.3 50.2 -51.4 -66.7 10.7 58.7 35.3 204 229 A T H X5S+ 0 0 0 -4,-2.9 4,-1.5 1,-0.2 -2,-0.2 0.812 115.6 45.5 -45.1 -40.1 9.7 61.3 37.8 205 230 A L H <5S+ 0 0 0 -4,-2.6 -94,-1.8 -5,-0.3 -1,-0.2 0.985 118.2 39.0 -68.5 -58.2 9.1 63.7 35.0 206 231 A L H <5S+ 0 0 17 -4,-3.0 -2,-0.2 -96,-0.2 -3,-0.2 0.787 127.2 34.1 -64.2 -30.7 7.2 61.4 32.7 207 232 A V H <5S- 0 0 34 -4,-3.3 -97,-0.3 -5,-0.2 -3,-0.2 0.770 97.3-125.9-103.8 -33.5 5.2 59.7 35.4 208 233 A G S < - 0 0 28 0, 0.0 3,-1.1 0, 0.0 -9,-0.1 -0.247 33.0-128.5 -53.6 145.2 9.5 59.4 42.2 211 236 A P T 3 S+ 0 0 14 0, 0.0 19,-0.2 0, 0.0 -10,-0.0 0.744 108.8 32.7 -72.4 -25.6 10.1 55.7 41.2 212 237 A F T 3 S+ 0 0 12 17,-0.1 2,-0.8 2,-0.1 12,-0.1 -0.167 87.6 150.0-120.9 37.1 11.2 54.7 44.7 213 238 A E < + 0 0 127 -3,-1.1 2,-0.3 10,-0.1 3,-0.0 -0.626 10.9 149.3 -81.6 105.6 8.9 57.1 46.5 214 239 A T - 0 0 43 -2,-0.8 6,-0.1 2,-0.1 -2,-0.1 -0.861 52.2-121.1-128.1 166.9 7.8 55.9 49.9 215 240 A S S S+ 0 0 134 -2,-0.3 2,-0.4 4,-0.0 -1,-0.1 0.896 95.6 67.1 -72.8 -41.8 6.8 57.6 53.2 216 241 A C S > S- 0 0 74 1,-0.1 4,-1.1 -3,-0.0 -2,-0.1 -0.664 73.1-146.5 -86.1 133.8 9.5 55.9 55.3 217 242 A L H >> S+ 0 0 122 -2,-0.4 4,-1.1 1,-0.2 3,-0.5 0.931 98.6 49.7 -62.1 -50.3 13.2 56.7 54.5 218 243 A K H 3> S+ 0 0 161 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.844 104.2 60.6 -61.0 -35.7 14.5 53.2 55.4 219 244 A E H 3> S+ 0 0 52 1,-0.2 4,-2.3 2,-0.2 3,-0.4 0.877 99.3 57.3 -58.7 -39.9 11.9 51.6 53.1 220 245 A T H S+ 0 0 69 -4,-2.3 5,-3.6 1,-0.2 4,-1.1 0.866 111.5 44.6 -49.6 -47.0 13.3 49.3 47.3 224 249 A I H ><5S+ 0 0 5 -4,-2.1 3,-0.7 3,-0.2 -1,-0.2 0.959 111.4 50.1 -66.8 -55.8 16.5 50.4 45.4 225 250 A K H 3<5S+ 0 0 96 -4,-1.5 -2,-0.2 1,-0.3 -1,-0.2 0.887 115.1 44.7 -49.3 -46.1 18.7 47.5 46.5 226 251 A K H 3<5S- 0 0 137 -4,-2.4 -1,-0.3 -5,-0.1 -2,-0.2 0.768 113.3-120.3 -69.9 -25.6 16.0 45.0 45.5 227 252 A N T <<5 + 0 0 52 -4,-1.1 2,-1.0 -3,-0.7 -3,-0.2 0.859 48.4 173.3 77.3 48.0 15.4 46.8 42.2 228 253 A E < + 0 0 104 -5,-3.6 2,-0.3 -6,-0.2 -1,-0.2 -0.731 23.5 105.7 -96.5 91.3 11.7 47.4 43.2 229 254 A Y - 0 0 52 -2,-1.0 2,-0.3 -17,-0.1 -17,-0.1 -0.965 41.5-159.6-151.1 164.1 10.0 49.7 40.7 230 255 A S - 0 0 87 -2,-0.3 -2,-0.0 -19,-0.2 3,-0.0 -0.968 17.6-135.3-148.5 139.6 7.5 49.5 37.8 231 256 A V - 0 0 28 -2,-0.3 4,-0.1 2,-0.0 9,-0.0 -0.840 38.8-114.1 -91.2 116.1 6.7 51.8 34.9 232 257 A P > - 0 0 50 0, 0.0 3,-2.2 0, 0.0 8,-0.1 -0.193 21.2-117.2 -56.4 138.3 2.9 52.1 34.6 233 258 A R T 3 S+ 0 0 219 1,-0.3 7,-0.1 7,-0.0 -2,-0.0 0.666 107.8 77.1 -48.4 -21.9 1.5 50.6 31.4 234 259 A H T 3 S+ 0 0 147 2,-0.1 2,-0.3 -27,-0.0 -1,-0.3 0.497 76.9 96.9 -70.9 -6.6 0.3 54.1 30.4 235 260 A I S < S- 0 0 30 -3,-2.2 -28,-0.0 1,-0.1 -4,-0.0 -0.667 89.3 -96.2 -91.1 140.1 3.9 55.1 29.4 236 261 A N >> - 0 0 56 -2,-0.3 4,-2.8 1,-0.1 3,-0.6 -0.294 31.6-132.1 -48.1 125.0 5.2 54.9 25.8 237 262 A P H 3> S+ 0 0 96 0, 0.0 4,-2.9 0, 0.0 5,-0.1 0.882 106.1 53.0 -51.4 -47.0 7.1 51.6 25.3 238 263 A V H 3> S+ 0 0 38 1,-0.2 4,-1.8 2,-0.2 27,-0.3 0.833 113.1 46.0 -59.4 -33.1 10.1 53.3 23.7 239 264 A A H <> S+ 0 0 0 -3,-0.6 4,-2.5 2,-0.2 -1,-0.2 0.924 111.6 48.3 -78.0 -46.0 10.3 55.6 26.7 240 265 A S H X S+ 0 0 14 -4,-2.8 4,-3.0 2,-0.2 -2,-0.2 0.918 109.6 56.5 -58.2 -42.6 9.8 52.9 29.4 241 266 A A H X S+ 0 0 34 -4,-2.9 4,-2.1 2,-0.2 5,-0.2 0.961 109.2 43.2 -51.0 -61.7 12.5 50.9 27.5 242 267 A L H X S+ 0 0 0 -4,-1.8 4,-2.3 1,-0.2 -1,-0.2 0.888 113.5 54.2 -50.9 -43.0 15.1 53.7 27.8 243 268 A I H X S+ 0 0 0 -4,-2.5 4,-0.5 1,-0.2 -1,-0.2 0.918 107.5 49.9 -58.9 -44.1 14.0 54.1 31.4 244 269 A R H >< S+ 0 0 120 -4,-3.0 3,-0.5 1,-0.2 -2,-0.2 0.873 111.4 46.9 -66.3 -40.9 14.6 50.5 32.2 245 270 A R H >< S+ 0 0 95 -4,-2.1 3,-1.5 1,-0.2 -1,-0.2 0.917 110.0 54.1 -62.8 -44.4 18.1 50.5 30.7 246 271 A M H 3< S+ 0 0 1 -4,-2.3 -47,-0.4 1,-0.3 -1,-0.2 0.598 114.6 42.1 -67.7 -11.4 19.0 53.7 32.6 247 272 A L T << S+ 0 0 0 -3,-0.5 -1,-0.3 -4,-0.5 -2,-0.2 0.290 83.3 148.4-117.3 7.7 17.9 52.0 35.8 248 273 A H < - 0 0 76 -3,-1.5 6,-0.1 -4,-0.2 5,-0.1 -0.042 51.8-129.9 -49.4 141.7 19.5 48.6 35.2 249 274 A A S S+ 0 0 51 -22,-0.1 -67,-0.2 4,-0.1 -1,-0.1 0.964 95.3 66.6 -56.2 -57.8 20.7 46.7 38.3 250 275 A D S > S- 0 0 59 1,-0.2 3,-1.4 -69,-0.1 4,-0.4 -0.559 76.1-150.0 -69.6 117.3 24.1 46.0 36.8 251 276 A P G > S+ 0 0 27 0, 0.0 3,-1.2 0, 0.0 -1,-0.2 0.833 92.1 67.6 -53.7 -35.8 26.0 49.3 36.4 252 277 A T G 3 S+ 0 0 95 1,-0.3 -2,-0.1 -3,-0.0 -3,-0.1 0.309 101.0 48.2 -76.6 11.5 27.9 47.9 33.4 253 278 A L G < S+ 0 0 105 -3,-1.4 -1,-0.3 -5,-0.1 -5,-0.1 0.436 80.0 107.8-129.2 -7.8 24.7 47.8 31.3 254 279 A R S < S- 0 0 15 -3,-1.2 -8,-0.2 -4,-0.4 -9,-0.1 -0.534 83.2 -98.6 -65.3 139.2 23.3 51.3 32.0 255 280 A P - 0 0 5 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.266 36.1-113.5 -64.7 146.9 23.7 53.4 28.8 256 281 A S >> - 0 0 52 1,-0.1 3,-1.1 -3,-0.1 4,-1.0 -0.489 30.2-106.0 -77.3 153.5 26.7 55.8 28.6 257 282 A V H >> S+ 0 0 11 1,-0.3 4,-0.8 2,-0.2 3,-0.8 0.850 124.0 51.6 -44.5 -42.7 26.0 59.5 28.5 258 283 A A H 3> S+ 0 0 53 1,-0.2 4,-0.7 2,-0.2 -1,-0.3 0.831 105.7 54.2 -65.6 -35.4 26.9 59.5 24.8 259 284 A E H <4 S+ 0 0 114 -3,-1.1 4,-0.4 1,-0.2 -1,-0.2 0.576 97.1 69.4 -77.2 -12.1 24.4 56.6 24.1 260 285 A L H X< S+ 0 0 0 -4,-1.0 3,-1.4 -3,-0.8 6,-0.3 0.965 95.3 48.3 -70.0 -54.9 21.5 58.5 25.7 261 286 A L H 3< S+ 0 0 24 -4,-0.8 -1,-0.2 1,-0.3 -2,-0.1 0.807 110.9 51.4 -58.5 -35.9 21.1 61.3 23.1 262 287 A T T 3< S+ 0 0 105 -4,-0.7 -1,-0.3 4,-0.1 -2,-0.2 0.629 85.6 117.4 -77.8 -13.9 21.1 58.8 20.2 263 288 A D S X> S- 0 0 23 -3,-1.4 4,-1.3 -4,-0.4 3,-1.0 -0.206 79.9-111.9 -61.0 146.0 18.4 56.6 21.8 264 289 A E H 3> S+ 0 0 113 1,-0.2 4,-1.3 2,-0.2 5,-0.3 0.821 110.5 69.5 -45.7 -44.2 15.1 56.2 20.0 265 290 A F H >> S+ 0 0 1 -27,-0.3 4,-1.0 1,-0.3 3,-0.6 0.887 106.9 36.3 -42.3 -56.2 13.2 58.1 22.7 266 291 A F H <4 S+ 0 0 13 -3,-1.0 -1,-0.3 -6,-0.3 -2,-0.2 0.833 123.5 43.9 -66.5 -34.0 14.9 61.5 21.8 267 292 A T H 3< S+ 0 0 99 -4,-1.3 -1,-0.2 -3,-0.2 -2,-0.2 0.329 107.6 58.6 -99.8 5.0 14.9 60.8 18.0 268 293 A S H << S+ 0 0 62 -4,-1.3 -3,-0.1 -3,-0.6 -2,-0.1 0.875 102.6 32.9-100.8 -51.8 11.4 59.3 17.6 269 294 A G S < S- 0 0 31 -4,-1.0 2,-0.2 -5,-0.3 0, 0.0 -0.203 102.1 -54.9 -99.0-170.9 8.8 61.9 18.8 270 295 A Y - 0 0 168 -2,-0.1 -153,-0.2 1,-0.0 -1,-0.2 -0.458 46.5-173.6 -68.3 132.5 8.6 65.7 18.8 271 296 A A - 0 0 43 -2,-0.2 -156,-0.1 -154,-0.1 -1,-0.0 -0.844 10.5-154.9-131.2 95.4 11.5 67.5 20.5 272 297 A P - 0 0 15 0, 0.0 3,-0.1 0, 0.0 0, 0.0 -0.305 9.0-146.6 -63.4 151.7 11.1 71.3 20.8 273 298 A M S S+ 0 0 154 1,-0.2 2,-0.3 -2,-0.0 0, 0.0 0.690 81.0 27.0 -97.0 -22.1 14.2 73.4 21.0 274 299 A R - 0 0 191 -122,-0.0 -1,-0.2 0, 0.0 -123,-0.1 -0.998 68.4-150.9-137.8 144.7 12.8 76.1 23.3 275 300 A L - 0 0 17 -125,-0.5 2,-0.1 -2,-0.3 -160,-0.0 -0.918 19.3-121.5-114.6 141.9 10.1 76.0 25.9 276 301 A P > - 0 0 62 0, 0.0 3,-1.2 0, 0.0 4,-0.1 -0.389 25.1-117.5 -70.9 156.3 7.8 78.9 27.1 277 302 A T G > S+ 0 0 59 1,-0.2 3,-2.4 2,-0.2 4,-0.2 0.738 106.4 82.4 -64.6 -23.5 7.8 80.0 30.7 278 303 A S G >> S+ 0 0 49 1,-0.3 4,-2.7 2,-0.2 3,-2.6 0.826 73.8 74.3 -47.7 -37.1 4.1 78.9 30.7 279 304 A C G <4 S+ 0 0 0 -3,-1.2 -1,-0.3 1,-0.3 -2,-0.2 0.703 77.2 76.2 -54.1 -22.7 5.3 75.3 31.3 280 305 A L G <4 S+ 0 0 35 -3,-2.4 -1,-0.3 1,-0.1 -2,-0.2 0.704 120.5 7.1 -61.5 -21.2 6.2 76.3 34.9 281 306 A T T <4 S+ 0 0 56 -3,-2.6 -2,-0.2 1,-0.3 -1,-0.1 0.618 131.4 31.6-130.2 -39.1 2.4 76.1 35.6 282 307 A V S < S- 0 0 76 -4,-2.7 -1,-0.3 1,-0.0 -174,-0.1 -0.946 81.5 -97.5-132.1 149.3 0.5 74.7 32.6 283 308 A P - 0 0 76 0, 0.0 2,-0.1 0, 0.0 -3,-0.0 -0.316 47.7-105.7 -61.8 145.0 1.1 72.3 29.7 284 309 A P 0 0 44 0, 0.0 -169,-0.1 0, 0.0 -9,-0.0 -0.457 360.0 360.0 -75.5 143.8 2.2 73.8 26.4 285 310 A R 0 0 297 -2,-0.1 0, 0.0 0, 0.0 0, 0.0 0.668 360.0 360.0-108.9 360.0 -0.3 74.1 23.5