==== 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 13-MAR-12 4AMQ . COMPND 2 MOLECULE: L544; . SOURCE 2 ORGANISM_SCIENTIFIC: ACANTHAMOEBA POLYPHAGA MIMIVIRUS; . AUTHOR A.LARTIGUE,J.M.CLAVERIE,S.PRIET,C.ABERGEL . 341 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18249.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 264 77.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 2.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 32 9.4 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 . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 28 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 47 13.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 137 40.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 2.1 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 4 0 2 1 1 0 1 0 3 1 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 1 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 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 PARALLEL BRIDGES PER LADDER . 0 0 2 1 0 1 0 0 1 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 0 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 0 A R 0 0 168 0, 0.0 178,-0.2 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 -62.8 5.8 53.6 36.2 2 1 A M - 0 0 42 1,-0.1 2,-1.2 177,-0.0 266,-0.0 -0.041 360.0 -99.1 -50.5 156.1 6.6 51.5 33.2 3 2 A L + 0 0 6 40,-0.1 40,-0.5 39,-0.0 2,-0.3 -0.703 58.5 164.6 -83.0 96.2 8.8 53.0 30.4 4 3 A I - 0 0 59 -2,-1.2 2,-0.2 38,-0.2 38,-0.2 -0.818 42.3 -95.6-112.7 152.4 6.2 54.1 27.9 5 4 A F + 0 0 28 36,-1.9 2,-0.3 -2,-0.3 3,-0.0 -0.472 51.8 154.9 -69.5 132.5 6.6 56.5 25.0 6 5 A T > - 0 0 71 -2,-0.2 4,-2.4 1,-0.0 5,-0.1 -0.955 52.2-118.4-144.9 162.2 5.6 60.1 25.5 7 6 A Y H > S+ 0 0 156 -2,-0.3 4,-2.4 2,-0.2 5,-0.2 0.776 116.4 59.5 -73.8 -24.8 6.7 63.3 23.9 8 7 A K H > S+ 0 0 180 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.905 109.3 44.3 -63.0 -41.8 8.0 64.5 27.2 9 8 A L H > S+ 0 0 10 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.923 112.1 50.9 -69.0 -46.2 10.3 61.4 27.2 10 9 A E H X S+ 0 0 11 -4,-2.4 4,-3.1 1,-0.2 5,-0.2 0.919 111.6 48.4 -56.9 -45.6 11.3 61.9 23.5 11 10 A R H X S+ 0 0 126 -4,-2.4 4,-3.1 2,-0.2 5,-0.4 0.907 110.5 51.3 -62.8 -42.4 12.2 65.5 24.2 12 11 A Y H X>S+ 0 0 82 -4,-1.9 4,-2.9 2,-0.2 5,-1.0 0.921 112.5 46.9 -58.9 -44.5 14.2 64.5 27.3 13 12 A I H X>S+ 0 0 0 -4,-2.7 5,-2.8 3,-0.2 4,-1.0 0.950 117.5 41.4 -61.9 -51.1 16.1 61.9 25.2 14 13 A K H <5S+ 0 0 30 -4,-3.1 -2,-0.2 3,-0.2 -1,-0.2 0.846 125.4 35.5 -66.9 -35.6 16.8 64.4 22.4 15 14 A N H <5S+ 0 0 73 -4,-3.1 -3,-0.2 -5,-0.2 -2,-0.2 0.865 131.1 22.5 -88.0 -39.4 17.6 67.3 24.7 16 15 A K H <5S+ 0 0 125 -4,-2.9 -3,-0.2 -5,-0.4 -2,-0.1 0.761 129.8 31.1-104.0 -30.6 19.4 65.7 27.6 17 16 A I T >X - 0 0 78 1,-0.1 3,-2.3 3,-0.1 4,-0.2 -0.164 64.9-134.6 -49.4 126.5 23.7 68.5 15.4 27 26 A R G > S+ 0 0 109 1,-0.3 3,-1.1 2,-0.2 -1,-0.1 0.809 104.1 56.8 -54.4 -35.2 20.1 67.4 14.6 28 27 A D G 3 S+ 0 0 128 1,-0.2 -1,-0.3 3,-0.0 -2,-0.1 0.590 102.2 58.3 -74.9 -9.0 20.7 67.4 10.9 29 28 A K G < S+ 0 0 69 -3,-2.3 22,-2.4 -5,-0.1 2,-0.3 0.318 102.8 55.5-104.5 6.2 23.6 65.0 11.3 30 29 A Y E < -A 50 0A 14 -3,-1.1 2,-0.4 20,-0.2 20,-0.2 -0.996 59.1-160.6-139.9 148.0 21.7 62.1 13.0 31 30 A Q E -A 49 0A 106 18,-2.3 18,-2.5 -2,-0.3 2,-0.4 -0.992 17.9-133.1-128.9 131.6 18.7 60.0 12.1 32 31 A I E -A 48 0A 15 -2,-0.4 16,-0.2 16,-0.2 2,-0.2 -0.682 33.2-177.6 -80.4 129.2 16.5 57.9 14.5 33 32 A K E >> +A 47 0A 69 14,-2.9 4,-0.9 -2,-0.4 14,-0.7 -0.610 33.9 13.2-117.0 176.8 15.8 54.4 13.2 34 33 A G H 3> S- 0 0 22 1,-0.2 4,-1.2 -2,-0.2 3,-0.3 -0.117 114.4 -11.7 66.0-147.0 13.9 51.3 14.1 35 34 A S H 34>S+ 0 0 12 1,-0.2 5,-1.8 2,-0.2 -1,-0.2 0.789 131.3 55.6 -66.7 -32.4 11.3 51.0 16.8 36 35 A F H X45S+ 0 0 5 -3,-0.6 3,-1.0 9,-0.2 -1,-0.2 0.870 103.2 55.4 -70.0 -36.6 11.9 54.4 18.5 37 36 A R H 3<5S+ 0 0 127 -4,-0.9 -1,-0.2 -3,-0.3 -2,-0.2 0.858 109.4 48.1 -60.2 -34.7 11.4 56.2 15.1 38 37 A R T 3<5S- 0 0 103 -4,-1.2 -1,-0.3 -5,-0.1 -2,-0.2 0.488 109.0-134.2 -82.5 -5.0 8.0 54.4 15.1 39 38 A R T < 5 - 0 0 100 -3,-1.0 -3,-0.2 -4,-0.2 -2,-0.1 0.886 26.9-162.9 53.4 46.0 7.5 55.6 18.7 40 39 A I < - 0 0 4 -5,-1.8 3,-0.2 1,-0.1 -35,-0.2 -0.307 22.5-123.3 -59.0 143.1 6.2 52.2 19.8 41 40 A P S S+ 0 0 40 0, 0.0 -36,-1.9 0, 0.0 2,-1.2 0.869 103.5 54.1 -60.6 -41.2 4.4 52.4 23.2 42 41 A Y S S- 0 0 46 190,-0.5 -38,-0.2 -38,-0.2 -2,-0.1 -0.659 90.8-144.2 -98.1 80.8 6.7 49.9 25.0 43 42 A I + 0 0 3 -2,-1.2 -40,-0.1 -40,-0.5 3,-0.1 -0.084 28.1 169.5 -48.4 131.6 10.1 51.4 24.4 44 43 A T - 0 0 12 1,-0.5 139,-0.6 -4,-0.1 2,-0.3 0.779 57.6 -34.0-108.5 -58.7 12.8 48.8 23.9 45 44 A D E - b 0 183A 35 137,-0.1 2,-0.5 2,-0.0 -1,-0.5 -0.938 53.1-109.7-155.4 175.7 15.9 50.6 22.7 46 45 A I E - b 0 184A 0 137,-2.6 139,-2.9 -2,-0.3 2,-0.5 -0.977 23.2-167.9-120.8 125.5 17.1 53.5 20.6 47 46 A D E +Ab 33 185A 50 -14,-0.7 -14,-2.9 -2,-0.5 2,-0.4 -0.946 13.8 175.5-110.8 128.7 18.9 53.0 17.2 48 47 A I E -Ab 32 186A 4 137,-3.0 139,-3.1 -2,-0.5 2,-0.5 -0.995 25.4-148.3-137.9 139.5 20.6 56.0 15.6 49 48 A V E -Ab 31 187A 31 -18,-2.5 -18,-2.3 -2,-0.4 2,-0.6 -0.928 15.8-163.7-101.2 124.0 22.7 56.7 12.6 50 49 A N E -Ab 30 188A 0 137,-3.3 139,-2.5 -2,-0.5 2,-0.9 -0.935 3.4-162.1-109.5 111.4 25.3 59.5 13.1 51 50 A N E + b 0 189A 61 -22,-2.4 139,-0.1 -2,-0.6 4,-0.1 -0.822 21.1 164.0 -94.6 103.7 26.7 60.9 9.8 52 51 A V > + 0 0 1 137,-1.9 4,-3.3 -2,-0.9 138,-0.2 0.519 20.4 140.0-107.4 -8.1 29.8 62.7 11.0 53 52 A H T 4 + 0 0 73 136,-0.9 4,-0.1 1,-0.3 138,-0.1 -0.646 69.3 13.2 -80.0 141.7 31.9 63.2 7.8 54 53 A P T 4 S+ 0 0 96 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 -0.999 124.9 59.6 -88.7 -6.4 33.5 65.5 7.0 55 54 A E T 4 S+ 0 0 88 1,-0.1 2,-0.4 -4,-0.1 -2,-0.3 0.877 123.9 20.6 -44.0 -44.7 33.2 67.0 10.5 56 55 A Y S < S+ 0 0 49 -4,-3.3 2,-0.2 -32,-0.0 -1,-0.1 -0.980 78.1 152.9-128.1 143.5 35.0 63.8 11.6 57 56 A D >> - 0 0 47 -2,-0.4 4,-1.8 -4,-0.1 3,-1.5 -0.757 58.8 -56.6-146.8-165.8 37.1 61.3 9.7 58 57 A D T 34 S+ 0 0 19 132,-0.3 4,-0.4 1,-0.3 106,-0.1 0.814 124.8 53.2 -46.8 -40.5 39.9 58.8 9.8 59 58 A T T 34 S+ 0 0 113 1,-0.2 -1,-0.3 2,-0.1 4,-0.1 0.592 124.2 17.5 -83.7 -12.4 42.4 61.2 11.3 60 59 A N T <> S+ 0 0 60 -3,-1.5 4,-1.2 2,-0.1 -1,-0.2 0.374 93.6 93.5-140.3 1.7 40.4 62.5 14.3 61 60 A I H X S+ 0 0 0 -4,-1.8 4,-1.4 1,-0.2 5,-0.1 0.847 85.5 56.8 -70.3 -33.0 37.5 60.1 15.0 62 61 A Y H > S+ 0 0 54 -4,-0.4 4,-2.2 1,-0.2 3,-0.5 0.949 105.6 48.6 -62.0 -50.2 39.6 58.1 17.6 63 62 A Q H > S+ 0 0 104 1,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.813 109.0 54.3 -63.3 -31.1 40.3 61.1 19.8 64 63 A R H X S+ 0 0 49 -4,-1.2 4,-2.0 2,-0.2 -1,-0.3 0.817 107.9 49.7 -70.9 -31.4 36.6 62.1 19.7 65 64 A I H X S+ 0 0 0 -4,-1.4 4,-2.7 -3,-0.5 -2,-0.2 0.872 109.2 52.1 -72.8 -37.8 35.7 58.6 21.0 66 65 A V H X S+ 0 0 15 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.913 108.8 50.9 -61.1 -43.3 38.3 59.0 23.7 67 66 A D H X S+ 0 0 72 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.922 110.4 49.1 -60.7 -45.5 36.7 62.3 24.6 68 67 A L H X S+ 0 0 2 -4,-2.0 4,-0.5 2,-0.2 -2,-0.2 0.947 111.3 49.5 -57.7 -50.2 33.3 60.7 24.8 69 68 A I H >X S+ 0 0 9 -4,-2.7 3,-1.4 1,-0.2 4,-0.6 0.932 111.4 48.0 -56.6 -48.9 34.6 57.9 27.0 70 69 A N H >< S+ 0 0 86 -4,-2.6 3,-0.7 1,-0.3 4,-0.4 0.821 104.7 59.6 -63.2 -32.5 36.3 60.2 29.4 71 70 A S H 3< S+ 0 0 67 -4,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.601 106.9 49.2 -71.9 -10.3 33.2 62.4 29.7 72 71 A F H X< S+ 0 0 13 -3,-1.4 3,-2.3 -4,-0.5 -1,-0.2 0.546 80.1 94.4-104.3 -11.1 31.3 59.4 31.0 73 72 A T T << S+ 0 0 97 -3,-0.7 -2,-0.1 -4,-0.6 -1,-0.1 0.829 98.8 31.5 -55.4 -35.9 33.7 58.1 33.7 74 73 A N T 3 S+ 0 0 164 -4,-0.4 2,-0.6 -3,-0.1 -1,-0.3 0.013 97.6 100.7-110.1 26.4 31.9 60.0 36.4 75 74 A D X - 0 0 37 -3,-2.3 3,-0.7 3,-0.2 -1,-0.0 -0.897 47.8-173.7-114.4 102.7 28.4 59.8 34.9 76 75 A N T 3 S+ 0 0 121 -2,-0.6 -1,-0.1 1,-0.2 100,-0.1 0.666 81.4 60.0 -69.9 -16.0 26.4 57.0 36.5 77 76 A Q T 3 S+ 0 0 47 1,-0.1 99,-2.9 98,-0.1 2,-0.5 0.782 103.9 50.1 -82.0 -28.4 23.6 57.3 34.0 78 77 A I E < +C 175 0A 3 -3,-0.7 2,-0.4 97,-0.2 -3,-0.2 -0.944 57.1 175.3-123.2 126.7 25.6 56.6 30.9 79 78 A K E -C 174 0A 93 95,-2.2 95,-2.2 -2,-0.5 2,-1.0 -0.990 22.3-148.5-129.1 127.0 27.9 53.7 30.1 80 79 A L E +C 173 0A 7 -2,-0.4 61,-0.3 93,-0.2 93,-0.2 -0.824 23.2 175.6 -88.7 102.8 29.6 53.0 26.8 81 80 A I E + 0 0 6 91,-1.9 60,-0.4 -2,-1.0 2,-0.4 0.946 58.5 9.2 -75.9 -52.4 29.8 49.2 26.9 82 81 A Y E -C 172 0A 18 90,-1.3 90,-3.2 58,-0.1 2,-0.6 -0.987 47.3-158.1-134.7 142.7 31.2 48.4 23.5 83 82 A V E -CD 171 139A 1 56,-2.8 56,-3.2 -2,-0.4 2,-0.7 -0.980 25.4-156.2-109.6 113.6 32.8 50.2 20.5 84 83 A I E +CD 170 138A 26 86,-3.1 86,-2.5 -2,-0.6 2,-0.3 -0.824 33.9 135.1 -98.9 112.9 32.3 47.9 17.6 85 84 A C E + 0 0 3 52,-1.8 84,-0.1 -2,-0.7 78,-0.1 -0.892 46.5 18.0-158.4 121.8 34.8 48.4 14.7 86 85 A G E - 0 0 5 -2,-0.3 51,-2.2 76,-0.1 2,-0.3 -0.271 62.6-111.8 107.8 166.8 36.8 45.9 12.7 87 86 A T E - D 0 136A 43 49,-0.2 2,-0.8 -2,-0.1 49,-0.2 -0.976 7.2-136.5-138.7 153.7 36.7 42.2 12.0 88 87 A D > - 0 0 14 47,-2.7 3,-2.6 -2,-0.3 4,-0.1 -0.846 20.0-165.5-108.1 92.2 38.8 39.1 12.8 89 88 A D G > S+ 0 0 97 -2,-0.8 3,-1.7 1,-0.3 -1,-0.1 0.567 77.7 79.6 -62.5 -10.0 38.9 37.4 9.4 90 89 A R G 3 S+ 0 0 86 1,-0.3 -1,-0.3 45,-0.1 45,-0.1 0.715 97.1 47.8 -66.5 -19.7 40.1 34.1 10.9 91 90 A F G < S+ 0 0 2 -3,-2.6 2,-1.6 43,-0.1 -1,-0.3 0.239 82.1 110.7-102.3 9.3 36.5 33.6 11.9 92 91 A L < - 0 0 92 -3,-1.7 -1,-0.1 -4,-0.1 -3,-0.1 -0.658 58.0-168.8 -82.9 85.0 35.4 34.5 8.3 93 92 A L - 0 0 23 -2,-1.6 -2,-0.1 1,-0.1 -3,-0.0 -0.210 32.8-150.5 -73.1 162.0 34.2 31.0 7.4 94 93 A T - 0 0 60 2,-0.2 -1,-0.1 0, 0.0 3,-0.1 0.113 45.2-120.2-111.8 13.3 33.3 29.8 3.9 95 94 A E + 0 0 79 1,-0.2 2,-0.3 2,-0.1 -2,-0.0 0.689 64.3 146.2 58.4 21.9 30.8 27.4 5.6 96 95 A Y >> - 0 0 133 1,-0.1 4,-1.4 0, 0.0 3,-1.2 -0.660 65.0-115.2 -89.8 146.1 32.7 24.4 4.1 97 96 A S H 3> S+ 0 0 118 -2,-0.3 4,-0.5 1,-0.3 -1,-0.1 0.747 121.5 43.2 -48.4 -25.4 33.0 21.2 6.0 98 97 A D H 3> S+ 0 0 96 2,-0.1 4,-0.9 3,-0.1 -1,-0.3 0.646 102.4 66.4 -97.2 -20.8 36.7 21.9 6.0 99 98 A E H X4 S+ 0 0 47 -3,-1.2 3,-1.4 2,-0.2 4,-0.2 0.990 96.8 54.8 -59.8 -62.4 36.5 25.6 6.9 100 99 A E H >X S+ 0 0 16 -4,-1.4 3,-2.4 1,-0.3 4,-0.9 0.855 100.8 59.1 -35.2 -57.4 35.1 24.9 10.4 101 100 A I H >X S+ 0 0 93 -4,-0.5 3,-0.8 1,-0.3 4,-0.5 0.844 96.1 62.1 -47.0 -43.0 38.0 22.6 11.4 102 101 A E H << S+ 0 0 138 -3,-1.4 -1,-0.3 -4,-0.9 -2,-0.2 0.405 107.0 45.4 -71.3 5.2 40.6 25.3 10.8 103 102 A K H X> S+ 0 0 1 -3,-2.4 3,-2.4 -4,-0.2 4,-0.5 0.567 84.0 87.1-119.9 -19.5 39.0 27.5 13.5 104 103 A I H X< S+ 0 0 85 -4,-0.9 3,-1.4 -3,-0.8 -2,-0.1 0.824 80.0 68.9 -50.8 -33.6 38.4 25.0 16.3 105 104 A K T 3< S+ 0 0 157 -4,-0.5 -1,-0.3 1,-0.3 -2,-0.1 0.756 103.7 42.8 -59.8 -24.5 41.9 25.7 17.5 106 105 A I T <4 S+ 0 0 16 -3,-2.4 -1,-0.3 46,-0.1 2,-0.3 0.409 101.8 84.2-104.9 0.4 40.8 29.2 18.5 107 106 A L << - 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0 0 14 -6,-0.5 2,-0.2 -5,-0.2 43,-0.1 -0.783 46.2-168.3 -88.0 111.6 26.6 45.0 36.0 258 274 A D > - 0 0 73 -2,-0.8 4,-2.5 1,-0.1 3,-0.3 -0.531 35.7-104.6 -90.7 167.2 26.8 46.1 39.6 259 275 A L H > S+ 0 0 58 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.913 118.3 55.3 -58.3 -46.5 24.4 45.0 42.3 260 276 A D H > S+ 0 0 92 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.857 112.2 42.8 -56.8 -38.6 22.4 48.2 42.4 261 277 A T H > S+ 0 0 28 -3,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.905 113.3 51.5 -75.8 -41.1 21.7 48.1 38.6 262 278 A A H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.904 111.5 49.0 -59.1 -42.4 20.9 44.3 38.7 263 279 A K H X S+ 0 0 94 -4,-3.0 4,-2.8 2,-0.2 -1,-0.2 0.897 108.2 52.1 -65.6 -42.7 18.5 45.0 41.6 264 280 A S H X S+ 0 0 25 -4,-1.7 4,-2.0 -5,-0.2 -1,-0.2 0.912 112.5 46.6 -62.0 -41.0 16.8 47.9 39.8 265 281 A I H X S+ 0 0 3 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.941 113.3 47.7 -64.5 -48.6 16.3 45.7 36.7 266 282 A I H X S+ 0 0 6 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.890 111.3 51.3 -60.8 -42.2 15.0 42.7 38.8 267 283 A I H X S+ 0 0 108 -4,-2.8 4,-1.8 1,-0.2 -1,-0.2 0.915 109.9 48.7 -61.6 -44.1 12.6 45.0 40.7 268 284 A S H X S+ 0 0 15 -4,-2.0 4,-1.8 -5,-0.2 -1,-0.2 0.850 112.2 49.8 -64.8 -34.0 11.1 46.5 37.5 269 285 A I H X S+ 0 0 1 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.891 106.5 53.8 -73.6 -40.9 10.7 43.0 36.0 270 286 A I H X S+ 0 0 23 -4,-2.3 4,-0.5 1,-0.2 -2,-0.2 0.906 112.0 46.0 -58.7 -44.4 8.9 41.6 39.1 271 287 A K H >< S+ 0 0 77 -4,-1.8 3,-0.6 1,-0.2 -2,-0.2 0.929 118.1 40.4 -63.4 -47.6 6.4 44.4 39.0 272 288 A D H >< S+ 0 0 4 -4,-1.8 3,-1.9 1,-0.2 4,-0.4 0.764 99.6 71.4 -78.8 -27.1 5.7 44.2 35.2 273 289 A I H >< S+ 0 0 1 -4,-2.4 3,-1.1 1,-0.3 -1,-0.2 0.763 88.7 65.7 -61.1 -24.6 5.6 40.4 34.9 274 290 A R T << S+ 0 0 164 -3,-0.6 -1,-0.3 -4,-0.5 -2,-0.2 0.649 91.2 63.2 -74.3 -15.4 2.3 40.4 36.7 275 291 A K T < S+ 0 0 91 -3,-1.9 -1,-0.3 -4,-0.1 -2,-0.2 0.655 92.6 83.7 -80.7 -17.0 0.7 42.3 33.8 276 292 A L S < S- 0 0 11 -3,-1.1 2,-0.4 -4,-0.4 3,-0.1 -0.258 74.0-130.4 -81.1 170.8 1.4 39.3 31.5 277 293 A N S S+ 0 0 105 1,-0.1 -2,-0.1 -2,-0.0 -3,-0.0 -0.970 78.8 22.8-125.9 142.0 -0.7 36.2 31.1 278 294 A G S S+ 0 0 65 -2,-0.4 2,-0.4 1,-0.3 -1,-0.1 0.621 80.4 147.5 85.8 15.4 0.4 32.5 31.1 279 295 A I - 0 0 21 -6,-0.1 2,-1.5 -3,-0.1 -1,-0.3 -0.685 55.8-122.6 -90.7 133.6 3.5 33.1 33.2 280 296 A D >> - 0 0 68 -2,-0.4 3,-2.0 1,-0.2 4,-0.5 -0.588 26.0-166.9 -70.2 93.0 4.8 30.5 35.6 281 297 A M H 3> S+ 0 0 62 -2,-1.5 4,-1.8 1,-0.3 -1,-0.2 0.547 76.7 79.7 -65.9 -6.2 4.8 32.7 38.7 282 298 A N H 3> S+ 0 0 101 2,-0.2 4,-2.2 1,-0.2 -1,-0.3 0.831 86.7 58.9 -65.3 -33.1 6.9 30.1 40.5 283 299 A I H <> S+ 0 0 10 -3,-2.0 4,-1.5 2,-0.2 -1,-0.2 0.900 104.7 50.6 -59.3 -41.6 9.9 31.6 38.7 284 300 A I H X S+ 0 0 3 -4,-0.5 4,-1.9 2,-0.2 -2,-0.2 0.909 108.2 50.6 -63.6 -45.0 9.0 34.9 40.3 285 301 A D H X S+ 0 0 91 -4,-1.8 4,-2.1 1,-0.2 -1,-0.2 0.891 108.2 53.5 -60.7 -40.4 8.9 33.4 43.8 286 302 A K H X S+ 0 0 93 -4,-2.2 4,-1.2 1,-0.2 -1,-0.2 0.842 107.0 52.5 -61.7 -34.1 12.3 31.7 43.2 287 303 A I H X S+ 0 0 1 -4,-1.5 4,-2.0 2,-0.2 -2,-0.2 0.879 107.9 50.7 -70.7 -37.3 13.7 35.2 42.3 288 304 A Q H < S+ 0 0 89 -4,-1.9 4,-0.3 1,-0.2 -2,-0.2 0.905 106.9 53.7 -66.1 -41.7 12.3 36.7 45.5 289 305 A E H X S+ 0 0 119 -4,-2.1 4,-1.9 1,-0.2 3,-0.5 0.793 107.1 52.5 -65.5 -28.2 13.9 33.9 47.6 290 306 A V H X S+ 0 0 19 -4,-1.2 4,-1.8 1,-0.2 -1,-0.2 0.953 103.7 56.0 -65.4 -50.4 17.2 34.7 46.0 291 307 A S H < S+ 0 0 31 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.548 114.5 43.5 -58.3 -6.5 16.8 38.4 46.9 292 308 A N H 4 S+ 0 0 91 -3,-0.5 -1,-0.2 -4,-0.3 -2,-0.2 0.786 122.1 27.3-109.3 -40.4 16.5 37.1 50.5 293 309 A N H < S+ 0 0 146 -4,-1.9 2,-0.3 -3,-0.1 -2,-0.2 0.264 109.3 67.9-116.1 11.1 19.1 34.4 51.1 294 310 A S < - 0 0 44 -4,-1.8 2,-0.3 -5,-0.1 3,-0.0 -0.819 62.6-158.7-118.2 167.5 21.9 35.4 48.7 295 311 A A >> - 0 0 69 -2,-0.3 3,-1.1 0, 0.0 4,-0.7 -0.994 44.1 -24.2-146.4 152.0 24.2 38.4 48.7 296 312 A G H >> S- 0 0 33 -2,-0.3 4,-1.5 1,-0.2 3,-0.6 -0.159 123.4 -1.7 54.9-133.3 26.4 40.4 46.4 297 313 A Q H 3> S+ 0 0 102 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.820 129.8 60.5 -63.3 -36.2 27.7 38.7 43.3 298 314 A D H <> S+ 0 0 112 -3,-1.1 4,-2.5 1,-0.2 -1,-0.2 0.880 105.3 51.0 -58.5 -38.1 26.1 35.4 44.1 299 315 A K H X S+ 0 0 80 -4,-2.4 4,-1.0 1,-0.2 3,-0.6 0.915 113.6 45.8 -59.2 -46.5 20.2 32.0 35.9 306 322 A L H 3X S+ 0 0 15 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.814 104.9 60.7 -70.3 -30.8 16.5 32.5 36.9 307 323 A L H 3X S+ 0 0 0 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.760 98.9 60.4 -66.7 -22.9 16.0 35.3 34.2 308 324 A T H < S+ 0 0 164 -4,-1.8 3,-0.6 -5,-0.3 4,-0.4 0.926 112.2 45.8 -64.2 -47.2 1.1 30.6 22.2 321 337 A Q H 3< S+ 0 0 51 -4,-2.2 -1,-0.2 1,-0.2 4,-0.2 0.576 114.3 52.2 -72.3 -9.2 -1.2 33.7 22.4 322 338 A S H >X S+ 0 0 0 -4,-0.6 4,-2.0 -3,-0.4 3,-0.6 0.645 81.0 88.9-100.7 -18.9 0.1 34.7 19.0 323 339 A K H S+ 0 0 110 -4,-0.4 4,-2.2 2,-0.2 -1,-0.3 0.854 108.7 50.8 -71.9 -37.1 -4.1 32.5 16.0 325 341 A Y H <> S+ 0 0 32 -3,-0.6 4,-1.7 -4,-0.2 -1,-0.2 0.828 112.5 49.5 -69.3 -30.9 -3.1 36.0 14.8 326 342 A F H X S+ 0 0 22 -4,-2.0 4,-3.1 2,-0.2 5,-0.3 0.983 111.7 45.5 -66.0 -59.3 -0.4 34.3 12.7 327 343 A T H X S+ 0 0 51 -4,-2.7 4,-1.3 1,-0.2 -2,-0.2 0.849 112.4 54.6 -53.6 -37.5 -2.7 31.7 11.2 328 344 A R H < S+ 0 0 120 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.934 115.7 34.9 -62.0 -49.7 -5.3 34.4 10.5 329 345 A Y H >X S+ 0 0 6 -4,-1.7 3,-0.8 -3,-0.2 4,-0.6 0.790 113.1 58.0 -81.3 -28.1 -2.9 36.7 8.5 330 346 A I H >< S+ 0 0 14 -4,-3.1 3,-0.6 1,-0.2 -1,-0.2 0.819 102.6 56.9 -68.6 -28.9 -1.0 33.9 6.9 331 347 A N T 3< S+ 0 0 109 -4,-1.3 -1,-0.2 -5,-0.3 -2,-0.2 0.568 96.1 64.2 -77.2 -9.9 -4.3 32.7 5.4 332 348 A I T <4 S+ 0 0 85 -3,-0.8 -1,-0.2 -4,-0.1 -2,-0.2 0.717 93.1 76.4 -81.4 -23.5 -4.7 36.1 3.9 333 349 A I S << S- 0 0 2 -4,-0.6 2,-0.2 -3,-0.6 5,-0.1 -0.654 98.5-102.3 -85.8 142.0 -1.6 35.4 1.8 334 350 A P >> - 0 0 58 0, 0.0 4,-2.4 0, 0.0 3,-1.8 -0.497 27.2-123.4 -66.6 131.0 -2.0 33.0 -1.2 335 351 A K H 3> S+ 0 0 146 1,-0.3 4,-0.6 2,-0.2 -2,-0.0 0.764 111.5 56.9 -44.2 -36.4 -0.7 29.5 -0.5 336 352 A E H 34 S+ 0 0 158 1,-0.2 4,-0.3 2,-0.2 -1,-0.3 0.874 116.6 34.1 -65.2 -38.3 1.7 29.7 -3.4 337 353 A D H X4 S+ 0 0 71 -3,-1.8 3,-0.6 1,-0.2 -2,-0.2 0.724 103.9 72.9 -87.5 -25.4 3.3 32.9 -2.0 338 354 A R H >< S+ 0 0 54 -4,-2.4 3,-0.6 1,-0.2 -1,-0.2 0.638 84.6 72.4 -70.1 -10.9 3.0 31.9 1.6 339 355 A K T 3< S+ 0 0 147 -4,-0.6 -1,-0.2 -3,-0.3 -2,-0.1 0.942 108.6 25.7 -65.0 -51.6 5.8 29.4 1.1 340 356 A L T X S- 0 0 120 -3,-0.6 3,-1.5 -4,-0.3 2,-0.2 -0.231 93.7-161.4-115.0 43.9 8.6 31.9 0.8 341 357 A C T < + 0 0 3 -3,-0.6 -142,-2.9 1,-0.3 -141,-0.5 -0.537 55.7 6.2 -68.1 134.2 7.4 34.9 2.7 342 358 A C T 3 0 0 12 -144,-0.3 -1,-0.3 -2,-0.2 -144,-0.1 -0.397 360.0 360.0-141.4 77.4 8.5 37.4 2.4 343 359 A L < 0 0 140 -3,-1.5 -3,-0.1 -127,-0.0 -1,-0.0 -0.255 360.0 360.0-154.8 360.0 11.1 38.3 -0.2