==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/RNA 08-JUN-06 2DRB . COMPND 2 MOLECULE: TRNA (35-MER); . SOURCE 2 SYNTHETIC: YES; . AUTHOR K.TOMITA,R.ISHITANI,S.FUKAI,O.NUREKI . 437 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 23675.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 315 72.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 13 3.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 57 13.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 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 . 32 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 46 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 149 34.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 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 2 0 0 0 3 2 0 4 0 1 0 1 1 0 0 0 0 2 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 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 PARALLEL BRIDGES PER LADDER . 1 0 2 3 1 1 1 1 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 . 0 1 2 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 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 0 170 0, 0.0 2,-0.3 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 94.7 5.2 15.1 -6.2 2 2 A K > - 0 0 98 1,-0.2 3,-2.2 246,-0.1 4,-0.5 -0.866 360.0-107.9-142.3 105.4 2.7 12.2 -6.4 3 3 A V T >> S+ 0 0 26 -2,-0.3 4,-2.6 1,-0.3 3,-0.8 0.346 115.6 60.3 12.5 -80.4 3.1 9.6 -9.2 4 4 A E H 3> S+ 0 0 118 1,-0.3 4,-1.0 2,-0.2 -1,-0.3 0.769 111.9 35.2 -27.4 -60.5 0.1 10.9 -11.1 5 5 A E H <> S+ 0 0 100 -3,-2.2 4,-1.6 2,-0.2 -1,-0.3 0.820 113.2 59.6 -73.6 -31.4 1.4 14.5 -11.6 6 6 A I H <> S+ 0 0 5 -3,-0.8 4,-2.2 -4,-0.5 3,-0.2 0.923 105.6 49.3 -61.0 -44.2 5.0 13.3 -12.1 7 7 A L H X S+ 0 0 23 -4,-2.6 4,-1.5 1,-0.2 -1,-0.2 0.824 103.9 61.0 -65.0 -30.7 3.8 11.2 -15.0 8 8 A E H X S+ 0 0 121 -4,-1.0 4,-0.5 -5,-0.3 -1,-0.2 0.901 110.1 39.7 -63.8 -40.5 2.1 14.3 -16.4 9 9 A K H >X S+ 0 0 113 -4,-1.6 4,-0.8 -3,-0.2 3,-0.8 0.846 107.3 65.9 -74.7 -35.6 5.4 16.1 -16.6 10 10 A A H >X S+ 0 0 0 -4,-2.2 4,-1.6 1,-0.2 3,-0.6 0.831 88.8 65.9 -55.5 -37.1 7.1 12.9 -17.8 11 11 A L H 3X S+ 0 0 54 -4,-1.5 4,-3.7 1,-0.3 3,-0.3 0.899 93.9 60.6 -52.8 -44.2 5.1 12.9 -21.1 12 12 A E H << S+ 0 0 130 -3,-0.8 -1,-0.3 -4,-0.5 -2,-0.2 0.907 106.5 46.4 -50.4 -44.4 6.9 16.1 -22.1 13 13 A L H << S+ 0 0 71 -4,-0.8 -1,-0.2 -3,-0.6 -2,-0.2 0.830 124.6 30.1 -69.5 -32.9 10.2 14.3 -21.9 14 14 A V H < S+ 0 0 4 -4,-1.6 41,-2.1 -3,-0.3 -2,-0.2 0.616 95.1 90.9-106.5 -13.7 9.0 11.3 -23.9 15 15 A I S < S- 0 0 42 -4,-3.7 39,-0.1 -5,-0.2 131,-0.0 -0.733 81.3-116.8 -86.5 124.4 6.3 12.5 -26.3 16 16 A P - 0 0 10 0, 0.0 2,-0.3 0, 0.0 39,-0.1 -0.285 30.2-116.7 -57.8 140.1 7.7 13.5 -29.7 17 17 A D >> - 0 0 78 1,-0.1 3,-2.1 -5,-0.0 4,-1.7 -0.644 27.5-108.4 -81.4 135.8 7.2 17.2 -30.4 18 18 A E H 3> S+ 0 0 150 -2,-0.3 4,-1.5 1,-0.3 -1,-0.1 0.626 118.2 58.7 -35.9 -26.1 5.0 18.0 -33.4 19 19 A E H 3> S+ 0 0 118 2,-0.2 4,-2.6 1,-0.2 -1,-0.3 0.930 108.3 43.2 -73.3 -44.0 8.0 19.2 -35.4 20 20 A E H <> S+ 0 0 44 -3,-2.1 4,-1.5 1,-0.2 -2,-0.2 0.885 110.7 56.8 -66.6 -38.0 9.8 15.8 -35.0 21 21 A V H X S+ 0 0 28 -4,-1.7 4,-2.2 2,-0.2 -1,-0.2 0.900 110.3 45.4 -59.4 -39.6 6.5 14.1 -35.8 22 22 A R H X S+ 0 0 131 -4,-1.5 4,-3.4 -5,-0.3 5,-0.4 0.978 105.3 57.4 -65.9 -57.9 6.3 16.1 -39.1 23 23 A K H X S+ 0 0 101 -4,-2.6 4,-0.8 1,-0.3 -1,-0.2 0.806 113.4 45.2 -43.2 -32.2 10.0 15.5 -40.0 24 24 A G H X S+ 0 0 0 -4,-1.5 4,-2.7 2,-0.2 3,-0.3 0.912 110.2 48.6 -81.6 -45.4 8.9 11.8 -39.8 25 25 A R H X S+ 0 0 147 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.865 113.2 52.1 -62.1 -32.0 5.6 11.9 -41.6 26 26 A E H X S+ 0 0 67 -4,-3.4 4,-1.4 2,-0.2 -1,-0.2 0.782 110.5 45.7 -74.3 -30.1 7.5 13.8 -44.3 27 27 A A H X S+ 0 0 0 -4,-0.8 4,-2.8 -5,-0.4 -2,-0.2 0.868 110.0 53.8 -79.6 -40.5 10.3 11.2 -44.6 28 28 A E H X S+ 0 0 46 -4,-2.7 4,-2.2 1,-0.2 5,-0.2 0.955 105.6 55.1 -55.6 -50.6 7.8 8.4 -44.7 29 29 A E H X S+ 0 0 84 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.927 110.3 45.7 -44.5 -55.5 6.1 10.2 -47.5 30 30 A E H X S+ 0 0 44 -4,-1.4 4,-3.0 1,-0.2 5,-0.3 0.897 106.6 57.8 -58.7 -48.0 9.4 10.2 -49.4 31 31 A L H X S+ 0 0 1 -4,-2.8 4,-3.4 2,-0.2 -1,-0.2 0.941 108.8 45.7 -48.5 -56.5 10.2 6.5 -48.7 32 32 A R H X S+ 0 0 86 -4,-2.2 4,-3.8 1,-0.2 5,-0.3 0.967 112.5 49.6 -52.5 -61.0 7.0 5.3 -50.3 33 33 A R H X S+ 0 0 140 -4,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.902 114.8 44.7 -45.4 -50.4 7.3 7.5 -53.4 34 34 A R H X S+ 0 0 58 -4,-3.0 4,-1.0 1,-0.2 -1,-0.2 0.958 116.3 47.5 -60.0 -49.9 10.9 6.4 -53.9 35 35 A L H >X>S+ 0 0 1 -4,-3.4 5,-1.1 -5,-0.3 4,-1.0 0.903 109.8 50.9 -59.1 -47.4 9.9 2.8 -53.2 36 36 A D H ><5S+ 0 0 89 -4,-3.8 3,-1.1 1,-0.3 -1,-0.2 0.919 102.0 60.3 -58.8 -46.0 6.9 2.8 -55.5 37 37 A E H 3<5S+ 0 0 166 -4,-2.1 -1,-0.3 -5,-0.3 -2,-0.2 0.843 110.2 44.6 -50.5 -31.6 8.9 4.2 -58.4 38 38 A L H <<5S- 0 0 84 -4,-1.0 -1,-0.3 -3,-0.7 -2,-0.2 0.685 107.1-135.7 -86.5 -19.1 10.9 1.0 -58.0 39 39 A G T <<5 + 0 0 63 -3,-1.1 2,-0.3 -4,-1.0 -3,-0.2 0.890 47.6 150.6 67.9 41.1 7.8 -1.1 -57.7 40 40 A V < - 0 0 31 -5,-1.1 2,-0.4 42,-0.0 -1,-0.2 -0.732 49.3-111.8-104.5 155.7 8.9 -3.3 -54.8 41 41 A E + 0 0 102 24,-0.3 24,-0.9 -2,-0.3 2,-0.3 -0.708 50.7 155.8 -86.0 132.3 6.7 -4.8 -52.1 42 42 A Y E -A 64 0A 44 -2,-0.4 2,-0.4 22,-0.2 22,-0.2 -0.997 30.4-153.9-156.9 160.6 7.1 -3.3 -48.7 43 43 A V E -A 63 0A 43 20,-1.8 20,-2.8 -2,-0.3 2,-0.7 -0.999 20.0-130.9-140.7 136.4 5.5 -2.7 -45.3 44 44 A F E +A 62 0A 15 -2,-0.4 18,-0.2 18,-0.2 2,-0.1 -0.774 43.6 152.3 -88.1 116.8 6.1 -0.0 -42.7 45 45 A V E > +A 61 0A 2 16,-1.8 4,-1.1 -2,-0.7 16,-0.7 -0.373 20.6 72.9-122.5-157.0 6.6 -1.6 -39.2 46 46 A G H > S- 0 0 8 1,-0.2 4,-1.1 84,-0.2 3,-0.1 -0.094 100.2 -51.8 77.1-178.8 8.4 -0.7 -36.0 47 47 A S H 4>S+ 0 0 26 1,-0.2 5,-3.0 2,-0.2 6,-0.7 0.679 134.7 60.6 -68.6 -19.4 7.5 1.9 -33.4 48 48 A Y H >45S+ 0 0 3 -3,-0.3 3,-1.0 11,-0.3 -1,-0.2 0.925 104.4 48.0 -73.4 -42.3 7.3 4.5 -36.1 49 49 A A H 3<5S+ 0 0 35 -4,-1.1 -2,-0.2 1,-0.3 -1,-0.2 0.769 119.4 40.1 -66.4 -25.3 4.5 2.6 -37.8 50 50 A R T 3<5S- 0 0 21 -4,-1.1 -1,-0.3 -5,-0.1 -2,-0.2 0.321 108.7-123.2-105.9 6.7 2.8 2.3 -34.5 51 51 A N T < 5S+ 0 0 62 -3,-1.0 -3,-0.2 -4,-0.2 -4,-0.1 0.937 77.9 116.8 50.1 55.1 3.5 5.7 -33.2 52 52 A T < + 0 0 0 -5,-3.0 2,-0.2 96,-0.1 -4,-0.2 0.037 34.0 134.0-135.8 23.7 5.3 4.6 -30.1 53 53 A W - 0 0 1 -6,-0.7 2,-0.2 1,-0.1 5,-0.1 -0.537 63.3-102.6 -81.7 146.9 8.8 5.8 -30.7 54 54 A L > - 0 0 12 3,-0.3 3,-2.5 -2,-0.2 -39,-0.1 -0.464 43.4-100.3 -68.5 127.5 10.7 7.6 -27.9 55 55 A K T 3 S+ 0 0 84 -41,-2.1 -1,-0.1 1,-0.3 -40,-0.1 -0.222 114.9 24.6 -47.2 131.6 10.7 11.4 -28.3 56 56 A G T 3 S+ 0 0 57 -39,-0.1 -1,-0.3 -3,-0.1 -2,-0.1 0.506 107.4 83.3 87.4 4.3 14.2 12.1 -29.7 57 57 A S < + 0 0 50 -3,-2.5 2,-0.3 2,-0.0 -3,-0.3 -0.216 55.4 163.2-132.5 43.1 14.5 8.6 -31.2 58 58 A L + 0 0 16 -5,-0.1 50,-0.7 -10,-0.0 2,-0.3 -0.486 10.6 153.0 -66.6 123.8 12.7 9.0 -34.5 59 59 A E E - b 0 108A 59 -2,-0.3 2,-0.4 48,-0.1 -11,-0.3 -0.970 34.4-134.7-154.8 139.1 13.6 6.2 -36.8 60 60 A I E - b 0 109A 0 48,-3.2 50,-3.7 -2,-0.3 2,-0.6 -0.836 9.4-159.7-104.9 133.0 11.7 4.4 -39.7 61 61 A D E +Ab 45 110A 27 -16,-0.7 -16,-1.8 -2,-0.4 2,-0.5 -0.939 12.5 177.2-109.7 116.0 11.5 0.7 -40.2 62 62 A V E -Ab 44 111A 1 48,-2.9 50,-2.1 -2,-0.6 2,-0.6 -0.982 13.0-157.1-120.5 121.6 10.6 -0.5 -43.8 63 63 A F E -Ab 43 112A 10 -20,-2.8 -20,-1.8 -2,-0.5 2,-0.7 -0.871 7.4-145.8-104.1 122.9 10.6 -4.2 -44.4 64 64 A L E -Ab 42 113A 0 48,-3.3 50,-2.6 -2,-0.6 2,-0.5 -0.757 19.1-143.3 -88.0 112.5 11.0 -5.5 -48.0 65 65 A L E + b 0 114A 22 -24,-0.9 -24,-0.3 -2,-0.7 50,-0.2 -0.638 21.7 179.7 -82.6 122.8 8.9 -8.7 -48.4 66 66 A F E - b 0 115A 15 48,-2.0 50,-3.3 -2,-0.5 9,-0.0 -0.852 36.2 -92.3-119.0 157.0 10.3 -11.5 -50.5 67 67 A P > - 0 0 45 0, 0.0 3,-1.6 0, 0.0 50,-0.1 -0.319 35.0-121.3 -62.8 143.5 8.8 -14.9 -51.5 68 68 A E T 3 S+ 0 0 76 48,-0.4 47,-0.1 1,-0.3 49,-0.0 0.447 107.4 68.7 -70.5 5.7 9.9 -17.7 -49.1 69 69 A E T 3 S+ 0 0 155 2,-0.1 -1,-0.3 0, 0.0 2,-0.0 0.666 77.0 104.0 -93.6 -18.8 11.5 -19.6 -52.0 70 70 A F S < S- 0 0 78 -3,-1.6 2,-0.1 1,-0.1 45,-0.1 -0.307 76.1-114.3 -64.7 144.3 14.2 -17.0 -52.4 71 71 A S > - 0 0 54 1,-0.1 4,-1.8 -2,-0.0 3,-0.2 -0.342 22.8-114.1 -75.0 158.8 17.7 -17.9 -51.2 72 72 A K H > S+ 0 0 85 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.872 119.3 58.0 -61.4 -34.4 19.2 -16.0 -48.3 73 73 A E H > S+ 0 0 107 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.888 102.7 53.2 -62.8 -39.7 21.8 -14.7 -50.8 74 74 A E H >>S+ 0 0 71 2,-0.2 4,-3.0 1,-0.2 5,-0.5 0.957 106.6 51.2 -61.8 -50.1 19.0 -13.2 -52.9 75 75 A L H X5S+ 0 0 3 -4,-1.8 4,-3.7 1,-0.2 5,-0.4 0.950 112.7 46.5 -50.0 -56.4 17.5 -11.3 -50.0 76 76 A R H X5S+ 0 0 84 -4,-2.1 4,-3.0 2,-0.2 5,-0.4 0.954 116.2 42.4 -50.9 -62.0 20.9 -9.7 -49.2 77 77 A E H X5S+ 0 0 103 -4,-2.5 4,-1.7 1,-0.2 -1,-0.2 0.916 124.0 36.0 -56.0 -49.0 21.9 -8.8 -52.7 78 78 A R H X5S+ 0 0 78 -4,-3.0 4,-2.9 -5,-0.2 -1,-0.2 0.915 117.6 51.8 -73.1 -42.3 18.4 -7.4 -53.7 79 79 A G H XX S+ 0 0 3 -4,-2.9 4,-1.2 2,-0.2 3,-0.7 0.965 113.8 50.5 -63.7 -56.1 17.0 -1.6 -53.0 83 83 A G H >X S+ 0 0 0 -4,-2.9 4,-1.3 1,-0.3 3,-0.7 0.879 106.5 54.0 -51.9 -44.9 18.1 0.2 -49.9 84 84 A K H 3< S+ 0 0 95 -4,-2.6 -1,-0.3 1,-0.2 -2,-0.2 0.848 111.7 46.5 -61.7 -32.2 21.1 1.8 -51.5 85 85 A A H << S+ 0 0 73 -4,-1.1 -1,-0.2 -3,-0.7 -2,-0.2 0.633 114.1 46.7 -85.6 -13.9 18.9 3.2 -54.2 86 86 A V H << S+ 0 0 2 -4,-1.2 2,-0.3 -3,-0.7 -2,-0.2 0.537 99.3 79.1-105.9 -6.6 16.2 4.5 -51.8 87 87 A L S < S- 0 0 14 -4,-1.3 17,-0.2 -5,-0.2 3,-0.1 -0.725 70.7-136.5-105.9 152.0 18.4 6.2 -49.2 88 88 A D S S- 0 0 88 15,-2.8 2,-0.3 1,-0.3 16,-0.1 0.849 94.9 -11.5 -69.4 -34.7 20.2 9.6 -49.2 89 89 A S E S-C 103 0A 68 14,-0.6 14,-1.5 -3,-0.0 -1,-0.3 -0.952 77.3-160.4-159.5 152.6 23.3 7.9 -47.7 90 90 A Y E -C 102 0A 113 -2,-0.3 2,-0.3 12,-0.2 12,-0.2 -0.868 18.5-155.5-139.9 173.6 23.8 4.5 -46.3 91 91 A E E -C 101 0A 109 10,-1.9 10,-0.9 -2,-0.3 2,-0.9 -0.821 12.4-155.8-152.6 100.8 25.9 2.3 -44.1 92 92 A I + 0 0 61 -2,-0.3 2,-0.2 8,-0.2 8,-0.1 -0.747 41.6 135.1 -82.2 109.7 25.8 -1.5 -44.6 93 93 A R + 0 0 114 -2,-0.9 2,-0.3 6,-0.5 -2,-0.0 -0.740 15.2 132.8-162.7 106.0 26.9 -2.9 -41.2 94 94 A Y - 0 0 68 -2,-0.2 195,-0.2 2,-0.1 -2,-0.0 -0.872 49.5-125.4-145.4 175.6 25.2 -5.9 -39.4 95 95 A A S S- 0 0 50 -2,-0.3 -1,-0.1 2,-0.2 194,-0.0 0.719 87.8 -28.8-102.2 -27.5 26.2 -9.1 -37.6 96 96 A E S S+ 0 0 111 1,-0.3 -2,-0.1 0, 0.0 0, 0.0 0.293 119.5 65.3-152.5 -62.3 24.2 -11.8 -39.4 97 97 A H S S- 0 0 17 1,-0.1 -1,-0.3 28,-0.0 -2,-0.2 -0.693 83.2-127.4 -81.4 115.5 20.9 -10.8 -41.0 98 98 A P + 0 0 10 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.162 44.2 138.2 -60.9 148.9 21.7 -8.3 -43.8 99 99 A Y - 0 0 65 13,-0.1 -6,-0.5 2,-0.0 2,-0.4 -0.929 42.7-112.5 178.7 161.7 20.1 -4.9 -44.1 100 100 A V E - D 0 111A 0 11,-2.0 11,-3.1 -2,-0.3 2,-0.4 -0.902 19.2-161.8-114.4 139.3 20.8 -1.3 -44.9 101 101 A H E +CD 91 110A 20 -10,-0.9 -10,-1.9 -2,-0.4 2,-0.3 -0.929 30.8 121.2-116.8 145.1 20.7 1.7 -42.6 102 102 A G E -CD 90 109A 4 7,-1.9 7,-3.1 -2,-0.4 2,-0.4 -0.931 49.4 -77.5-171.2-164.4 20.5 5.3 -43.7 103 103 A V E -CD 89 108A 37 -14,-1.5 -15,-2.8 -2,-0.3 -14,-0.6 -0.969 22.0-177.1-127.9 136.8 18.9 8.7 -44.0 104 104 A V E > S- D 0 107A 0 3,-1.9 3,-1.7 -2,-0.4 -73,-0.1 -0.960 81.8 -23.0-132.8 114.0 15.9 10.1 -45.9 105 105 A K T 3 S- 0 0 89 -2,-0.4 -1,-0.1 1,-0.3 -78,-0.1 0.929 131.8 -45.4 49.5 48.8 15.1 13.7 -45.6 106 106 A G T 3 S+ 0 0 43 1,-0.2 2,-0.3 -79,-0.1 -1,-0.3 0.250 112.5 112.1 84.1 -9.8 16.9 13.8 -42.3 107 107 A V E < - D 0 104A 2 -3,-1.7 -3,-1.9 -84,-0.1 2,-0.2 -0.776 68.5-111.8-107.9 148.4 15.6 10.7 -40.6 108 108 A E E -bD 59 103A 91 -50,-0.7 -48,-3.2 -2,-0.3 2,-0.4 -0.478 39.2-168.7 -68.8 130.6 17.2 7.4 -39.6 109 109 A V E -bD 60 102A 0 -7,-3.1 -7,-1.9 -2,-0.2 2,-0.6 -0.976 20.2-155.6-131.6 137.3 15.9 4.5 -41.7 110 110 A D E -bD 61 101A 20 -50,-3.7 -48,-2.9 -2,-0.4 2,-1.0 -0.926 8.2-167.6-108.3 114.4 16.1 0.7 -41.5 111 111 A V E +bD 62 100A 2 -11,-3.1 -11,-2.0 -2,-0.6 -48,-0.2 -0.805 19.0 179.7-102.9 93.2 15.6 -1.0 -44.8 112 112 A V E -b 63 0A 12 -50,-2.1 -48,-3.3 -2,-1.0 2,-0.3 -0.806 18.4-149.3-102.6 132.2 15.2 -4.7 -43.8 113 113 A P E +b 64 0A 0 0, 0.0 2,-0.3 0, 0.0 14,-0.2 -0.738 27.3 158.1 -95.7 142.7 14.6 -7.6 -46.2 114 114 A C E -b 65 0A 0 -50,-2.6 -48,-2.0 -2,-0.3 2,-0.2 -0.955 44.4 -96.1-165.9 147.0 12.6 -10.6 -45.1 115 115 A Y E -b 66 0A 2 -2,-0.3 2,-1.0 -50,-0.2 10,-0.1 -0.413 36.9-130.8 -64.7 128.1 10.6 -13.6 -46.4 116 116 A K + 0 0 89 -50,-3.3 -48,-0.4 -2,-0.2 2,-0.2 -0.723 39.5 174.9 -85.6 105.8 6.9 -12.8 -46.4 117 117 A L - 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0 0 146 47,-0.2 -1,-0.3 -3,-0.2 2,-0.3 -0.966 68.0-167.2-154.7 134.3 50.9 -9.2 -3.6 338 338 A I - 0 0 33 45,-2.4 -25,-0.0 -2,-0.3 -26,-0.0 -0.762 34.8 -88.5-117.3 164.1 50.9 -12.8 -2.4 339 339 A S - 0 0 66 -2,-0.3 -1,-0.1 2,-0.1 41,-0.1 -0.188 25.6-127.5 -68.5 163.1 53.6 -15.0 -1.0 340 340 A R S S+ 0 0 117 39,-0.1 40,-2.9 41,-0.1 -1,-0.1 0.930 90.3 62.6 -75.4 -47.6 55.9 -17.1 -3.2 341 341 A V E +K 379 0D 51 38,-0.3 2,-0.3 36,-0.1 38,-0.2 -0.343 61.2 164.7 -79.9 159.8 55.2 -20.3 -1.2 342 342 A F E -K 378 0D 52 36,-1.8 36,-2.9 -2,-0.1 2,-0.6 -0.969 36.9 -93.3-163.4 169.6 51.9 -22.1 -0.7 343 343 A R E -K 377 0D 98 -2,-0.3 2,-0.5 34,-0.2 34,-0.2 -0.834 27.2-168.6 -99.8 120.1 50.3 -25.4 0.4 344 344 A R E -K 376 0D 133 32,-3.3 32,-2.7 -2,-0.6 2,-0.6 -0.885 27.6-122.0-104.1 134.5 49.5 -28.2 -2.1 345 345 A M E -K 375 0D 108 -2,-0.5 30,-0.2 30,-0.2 29,-0.1 -0.661 32.0-174.5 -82.3 117.7 47.3 -31.0 -0.6 346 346 A G E - 0 0 6 28,-2.1 9,-0.1 -2,-0.6 30,-0.0 -0.224 31.0 -70.1 -94.8-171.4 48.8 -34.4 -0.8 347 347 A P E - 0 0 24 0, 0.0 27,-2.8 0, 0.0 2,-0.4 0.015 52.6 -84.7 -73.3 179.5 47.3 -37.9 0.1 348 348 A Q E > -K 373 0D 97 25,-0.3 3,-1.0 1,-0.1 25,-0.3 -0.766 35.3-121.9 -91.2 131.5 46.4 -39.5 3.4 349 349 A F T 3 S+ 0 0 106 23,-1.6 24,-0.1 -2,-0.4 -1,-0.1 0.725 102.7 80.1 -42.0 -29.2 49.3 -41.3 5.2 350 350 A E T 3 S+ 0 0 133 22,-0.5 2,-1.0 1,-0.2 -1,-0.2 0.937 87.4 50.6 -46.1 -65.9 47.2 -44.4 5.0 351 351 A D <> - 0 0 63 -3,-1.0 4,-1.6 1,-0.2 3,-0.4 -0.668 64.8-172.0 -85.8 103.8 47.9 -45.4 1.4 352 352 A E H > S+ 0 0 125 -2,-1.0 4,-2.8 1,-0.2 5,-0.3 0.718 73.5 79.4 -65.1 -21.2 51.7 -45.4 0.9 353 353 A R H > S+ 0 0 177 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.967 106.5 26.2 -51.3 -61.7 51.3 -45.8 -2.8 354 354 A N H > S+ 0 0 75 -3,-0.4 4,-3.6 2,-0.2 5,-0.3 0.868 114.7 64.2 -74.1 -34.2 50.5 -42.2 -3.5 355 355 A V H X S+ 0 0 15 -4,-1.6 4,-3.8 1,-0.2 5,-0.3 0.947 106.1 47.0 -53.7 -44.5 52.4 -40.8 -0.5 356 356 A K H X S+ 0 0 135 -4,-2.8 4,-2.8 1,-0.2 -1,-0.2 0.925 113.1 47.5 -61.7 -45.6 55.5 -42.2 -2.1 357 357 A K H < S+ 0 0 151 -4,-1.5 -1,-0.2 -5,-0.3 -2,-0.2 0.866 116.3 46.0 -62.9 -35.1 54.6 -40.7 -5.4 358 358 A F H < S+ 0 0 28 -4,-3.6 -2,-0.2 1,-0.2 -1,-0.2 0.954 115.4 44.1 -72.0 -50.8 53.8 -37.4 -3.7 359 359 A L H < S+ 0 0 66 -4,-3.8 2,-2.0 -5,-0.3 4,-0.2 0.857 98.2 76.3 -63.0 -38.4 56.9 -37.3 -1.5 360 360 A S S < S+ 0 0 84 -4,-2.8 2,-0.3 -5,-0.3 -1,-0.2 -0.551 74.1 112.3 -76.8 84.3 59.2 -38.3 -4.4 361 361 A R S S- 0 0 157 -2,-2.0 2,-1.5 2,-0.1 5,-0.1 -0.855 81.6-103.5-163.4 124.2 59.2 -35.0 -6.1 362 362 A N + 0 0 157 -2,-0.3 2,-0.4 4,-0.0 -2,-0.1 -0.176 61.1 166.7 -44.3 78.8 61.9 -32.3 -6.6 363 363 A R - 0 0 42 -2,-1.5 15,-0.1 -4,-0.2 -2,-0.1 -0.843 38.9-146.3-109.8 141.5 60.5 -30.1 -3.9 364 364 A A S S+ 0 0 82 -2,-0.4 -1,-0.1 13,-0.3 14,-0.1 0.848 96.6 21.6 -72.7 -36.5 62.3 -27.1 -2.3 365 365 A F S S- 0 0 107 12,-0.5 -1,-0.2 0, 0.0 13,-0.1 0.523 100.1-124.3-111.9 -8.6 60.9 -27.4 1.3 366 366 A R - 0 0 207 11,-0.2 -7,-0.1 -5,-0.1 -4,-0.0 0.749 32.1 -89.5 64.9 120.7 59.8 -31.0 1.6 367 367 A P - 0 0 20 0, 0.0 9,-0.2 0, 0.0 2,-0.2 0.040 38.6-159.9 -55.6 159.8 56.2 -31.9 2.6 368 368 A F E -L 375 0D 55 7,-2.0 7,-2.0 5,-0.1 2,-0.4 -0.609 20.7 -99.5-130.4-172.3 54.9 -32.4 6.2 369 369 A I E +L 374 0D 93 5,-0.2 2,-0.3 -2,-0.2 5,-0.2 -0.975 34.7 166.1-123.2 130.8 51.9 -34.1 7.9 370 370 A E E > S-L 373 0D 74 3,-2.0 3,-0.6 -2,-0.4 -2,-0.0 -0.903 70.9 -15.0-145.6 111.2 48.8 -32.3 9.1 371 371 A N T 3 S- 0 0 142 -2,-0.3 -1,-0.1 1,-0.2 3,-0.0 0.972 124.1 -49.0 60.0 63.1 45.7 -34.3 10.1 372 372 A G T 3 S+ 0 0 26 -24,-0.1 -23,-1.6 1,-0.1 -22,-0.5 0.463 122.7 85.4 62.7 2.2 46.4 -37.7 8.6 373 373 A R E < S-KL 348 370D 61 -3,-0.6 -3,-2.0 -25,-0.3 -25,-0.3 -0.998 75.3-116.3-139.7 142.6 47.3 -36.3 5.2 374 374 A W E - L 0 369D 47 -27,-2.8 -28,-2.1 -2,-0.4 2,-0.3 -0.322 25.7-168.6 -72.6 154.3 50.5 -35.0 3.7 375 375 A W E -KL 345 368D 44 -7,-2.0 -7,-2.0 -30,-0.2 2,-0.3 -0.967 5.5-151.8-139.3 151.2 50.9 -31.4 2.5 376 376 A A E -K 344 0D 0 -32,-2.7 -32,-3.3 -2,-0.3 2,-0.6 -0.951 15.3-128.4-128.9 148.8 53.6 -29.8 0.4 377 377 A F E -K 343 0D 78 -2,-0.3 -12,-0.5 -34,-0.2 -13,-0.3 -0.852 33.8-176.3 -94.1 124.2 55.0 -26.3 0.1 378 378 A E E -K 342 0D 30 -36,-2.9 -36,-1.8 -2,-0.6 2,-0.4 -0.755 19.3-125.6-117.1 164.4 55.1 -25.1 -3.5 379 379 A M E -K 341 0D 73 -2,-0.3 -38,-0.3 -38,-0.2 2,-0.2 -0.920 19.8-125.2-115.5 140.5 56.4 -21.9 -5.0 380 380 A R - 0 0 22 -40,-2.9 3,-0.1 -2,-0.4 -39,-0.0 -0.577 2.2-146.0 -85.1 144.2 54.4 -19.5 -7.2 381 381 A K S S+ 0 0 174 -2,-0.2 2,-0.3 1,-0.1 -1,-0.1 0.722 89.6 22.4 -76.9 -21.1 55.6 -18.4 -10.7 382 382 A F - 0 0 24 -42,-0.1 -1,-0.1 1,-0.1 -2,-0.0 -0.971 57.5-166.6-143.7 155.3 54.1 -15.0 -10.1 383 383 A T + 0 0 13 -2,-0.3 -45,-2.4 -3,-0.1 -1,-0.1 0.585 67.0 57.5-121.3 -16.7 53.2 -12.9 -7.1 384 384 A T S > S- 0 0 25 -47,-0.2 4,-1.6 1,-0.1 -47,-0.2 -0.677 82.4-114.2-111.9 170.5 51.0 -10.0 -8.2 385 385 A P H > S+ 0 0 0 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.867 117.2 48.9 -69.5 -34.5 47.7 -9.9 -10.1 386 386 A E H > S+ 0 0 45 2,-0.2 4,-3.4 -50,-0.2 5,-0.4 0.969 107.8 51.8 -68.6 -53.8 49.4 -8.2 -13.0 387 387 A E H > S+ 0 0 53 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.891 112.7 50.3 -47.9 -41.5 52.3 -10.6 -13.2 388 388 A G H X S+ 0 0 0 -4,-1.6 4,-2.1 2,-0.2 -1,-0.2 0.902 112.6 42.5 -65.8 -44.1 49.6 -13.3 -13.2 389 389 A V H X S+ 0 0 0 -4,-2.2 4,-3.3 2,-0.2 5,-0.5 0.903 108.3 58.2 -72.0 -39.9 47.5 -11.8 -16.0 390 390 A R H X S+ 0 0 146 -4,-3.4 4,-0.7 1,-0.2 -1,-0.2 0.903 112.1 45.1 -54.6 -36.7 50.5 -10.9 -18.2 391 391 A S H X S+ 0 0 57 -4,-1.3 4,-1.4 -5,-0.4 -1,-0.2 0.910 117.5 42.3 -71.8 -44.5 51.2 -14.6 -17.9 392 392 A Y H X S+ 0 0 9 -4,-2.1 4,-4.5 2,-0.2 3,-0.3 0.963 114.4 47.3 -68.0 -57.1 47.7 -15.7 -18.6 393 393 A A H < S+ 0 0 1 -4,-3.3 4,-0.3 1,-0.2 -1,-0.2 0.694 114.4 49.8 -61.8 -18.9 46.7 -13.3 -21.4 394 394 A S H < S+ 0 0 72 -4,-0.7 -1,-0.2 -5,-0.5 -2,-0.2 0.820 122.5 31.6 -86.6 -33.1 50.0 -14.2 -23.1 395 395 A T H < S+ 0 0 83 -4,-1.4 3,-0.3 -3,-0.3 -2,-0.2 0.839 126.7 37.2 -92.3 -37.1 49.5 -17.9 -22.8 396 396 A H S >< S+ 0 0 82 -4,-4.5 3,-2.8 1,-0.2 4,-0.4 0.173 70.3 123.8-104.7 17.9 45.7 -18.2 -23.1 397 397 A W G > + 0 0 72 -4,-0.3 3,-2.7 1,-0.3 -1,-0.2 0.875 65.9 69.1 -43.7 -45.3 44.7 -15.5 -25.6 398 398 A H G 3 S+ 0 0 142 1,-0.3 -1,-0.3 -3,-0.3 3,-0.2 0.650 98.2 51.6 -54.5 -12.2 43.0 -18.1 -27.8 399 399 A T G < S+ 0 0 41 -3,-2.8 2,-0.4 1,-0.2 -1,-0.3 0.537 85.2 85.6-103.0 -2.6 40.3 -18.5 -25.2 400 400 A L S < S- 0 0 0 -3,-2.7 -100,-0.3 -4,-0.4 5,-0.2 -0.089 112.3 -63.2 -89.8 38.4 39.4 -14.8 -24.8 401 401 A G > - 0 0 9 -2,-0.4 4,-1.9 -3,-0.2 5,-0.3 0.202 55.3 -91.1 93.0 142.0 37.0 -14.7 -27.7 402 402 A K H > S+ 0 0 136 3,-0.2 4,-1.2 2,-0.2 -2,-0.1 0.956 121.4 21.1 -49.1 -65.5 37.6 -15.3 -31.4 403 403 A N H > S+ 0 0 48 2,-0.2 4,-1.7 1,-0.1 3,-0.3 0.947 128.1 46.4 -73.9 -52.0 38.4 -11.7 -32.3 404 404 A V H > S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 3,-0.4 0.934 111.4 55.6 -57.0 -44.9 39.3 -10.1 -29.0 405 405 A G H X S+ 0 0 0 -4,-1.9 4,-1.6 1,-0.2 -1,-0.2 0.866 107.4 49.0 -55.6 -39.0 41.5 -13.1 -28.4 406 406 A E H X S+ 0 0 61 -4,-1.2 4,-1.4 -5,-0.3 -1,-0.2 0.791 107.3 52.9 -74.4 -28.9 43.4 -12.5 -31.6 407 407 A S H X S+ 0 0 10 -4,-1.7 4,-1.2 -3,-0.4 3,-0.3 0.948 110.3 48.5 -69.4 -46.4 44.0 -8.8 -31.0 408 408 A I H < S+ 0 0 3 -4,-2.2 3,-0.3 1,-0.2 -2,-0.2 0.865 105.2 59.7 -59.9 -37.6 45.5 -9.6 -27.6 409 409 A R H < S+ 0 0 108 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.917 112.0 39.4 -57.9 -41.5 47.6 -12.3 -29.2 410 410 A E H < S- 0 0 136 -4,-1.4 -1,-0.2 -3,-0.3 -2,-0.2 0.622 136.2 -10.0 -86.3 -10.3 49.2 -9.6 -31.4 411 411 A Y < + 0 0 78 -4,-1.2 -127,-0.3 -3,-0.3 -1,-0.3 -0.763 63.6 149.0 175.7 137.1 49.4 -6.9 -28.7 412 412 A F - 0 0 34 -2,-0.2 2,-0.3 -129,-0.1 -129,-0.2 -0.886 14.9-169.9-172.6 142.9 48.2 -6.3 -25.2 413 413 A E E -I 282 0C 73 -131,-2.0 -131,-3.1 -2,-0.3 2,-0.5 -0.932 19.8-127.1-138.4 161.7 49.5 -4.3 -22.1 414 414 A I E -I 281 0C 42 -2,-0.3 2,-0.5 -133,-0.2 -133,-0.2 -0.951 22.2-162.4-114.5 126.5 48.8 -3.9 -18.4 415 415 A I E +I 280 0C 12 -135,-1.9 -135,-1.6 -2,-0.5 2,-0.2 -0.937 13.2 172.4-116.9 125.2 48.3 -0.4 -17.0 416 416 A S E > -I 279 0C 51 -2,-0.5 4,-0.6 -137,-0.2 3,-0.4 -0.608 42.0 -10.6-119.4 177.5 48.5 0.4 -13.3 417 417 A G H >> S- 0 0 38 -139,-0.5 3,-1.9 1,-0.2 4,-0.9 0.129 121.1 -2.0 35.8-135.6 48.5 3.4 -11.0 418 418 A E H >4 S+ 0 0 118 1,-0.3 3,-0.9 2,-0.2 4,-0.5 0.889 131.4 55.8 -52.4 -49.2 48.9 6.9 -12.4 419 419 A K H 34 S+ 0 0 161 -3,-0.4 4,-0.4 1,-0.2 -1,-0.3 0.599 104.4 58.8 -64.7 -5.6 49.3 5.8 -16.0 420 420 A L H << S+ 0 0 0 -3,-1.9 3,-0.3 -4,-0.6 -1,-0.2 0.783 96.5 56.8 -91.2 -31.0 45.9 4.0 -15.6 421 421 A F S << S+ 0 0 17 -4,-0.9 -2,-0.2 -3,-0.9 5,-0.2 0.496 98.0 65.5 -78.9 -3.4 43.8 7.1 -14.6 422 422 A K S S+ 0 0 169 -4,-0.5 -1,-0.2 2,-0.1 -2,-0.2 0.832 86.3 80.7 -85.6 -36.7 44.9 8.8 -17.9 423 423 A E S > S- 0 0 42 -4,-0.4 2,-1.5 -3,-0.3 3,-0.6 -0.118 102.4 -91.7 -62.5 168.2 43.1 6.3 -20.2 424 424 A P T 3 S+ 0 0 61 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 -0.412 99.8 91.5 -82.9 61.5 39.3 6.7 -20.7 425 425 A V T 3> + 0 0 0 -2,-1.5 4,-3.2 -5,-0.2 5,-0.3 0.444 42.5 105.1-132.0 -6.3 38.0 4.4 -18.0 426 426 A T H <> S+ 0 0 35 -3,-0.6 4,-2.3 1,-0.2 5,-0.3 0.848 84.3 53.8 -45.7 -39.7 37.5 6.7 -15.0 427 427 A A H > S+ 0 0 40 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.957 114.3 39.7 -61.3 -51.3 33.8 6.5 -15.6 428 428 A E H > S+ 0 0 48 -3,-0.3 4,-3.0 2,-0.2 -2,-0.2 0.934 115.5 50.5 -64.4 -50.1 33.8 2.7 -15.6 429 429 A L H X S+ 0 0 0 -4,-3.2 4,-2.4 2,-0.2 5,-0.2 0.940 112.2 46.3 -54.9 -51.7 36.3 2.3 -12.7 430 430 A C H X>S+ 0 0 5 -4,-2.3 5,-2.2 -5,-0.3 4,-0.6 0.944 114.4 49.6 -56.3 -46.5 34.3 4.7 -10.4 431 431 A E H ><5S+ 0 0 137 -4,-2.0 3,-0.8 -5,-0.3 -1,-0.2 0.895 110.3 50.9 -57.0 -43.6 31.2 2.9 -11.4 432 432 A M H 3<5S+ 0 0 7 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.830 111.0 46.8 -64.6 -37.4 32.9 -0.4 -10.6 433 433 A M H 3<5S- 0 0 9 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.438 110.4-120.6 -86.9 -0.9 34.0 0.6 -7.2 434 434 A G T <<5 + 0 0 54 -3,-0.8 2,-0.9 -4,-0.6 -3,-0.2 0.839 41.8 179.7 66.0 32.0 30.6 2.1 -6.4 435 435 A V < - 0 0 32 -5,-2.2 -1,-0.2 -6,-0.2 -2,-0.1 -0.547 17.9-151.8 -67.6 104.8 32.1 5.5 -5.8 436 436 A K 0 0 182 -2,-0.9 -1,-0.0 -3,-0.2 -3,-0.0 -0.264 360.0 360.0 -77.2 169.4 28.9 7.4 -4.9 437 437 A D 0 0 169 -2,-0.0 -1,-0.2 0, 0.0 -2,-0.0 -0.346 360.0 360.0 150.8 360.0 28.2 11.1 -5.5