==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/DNA 12-APR-07 2PI5 . COMPND 2 MOLECULE: 5'- . SOURCE 2 SYNTHETIC: YES; . AUTHOR W.P.KENNEDY,J.R.MOMAND,Y.W.YIN . 862 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 39536.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 589 68.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 53 6.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 57 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 104 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 343 39.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 1.0 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 3 6 2 3 0 4 1 2 3 0 1 2 1 0 3 1 1 1 0 1 0 0 0 0 0 0 1 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 . 5 2 4 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 6 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 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 6 A I > 0 0 91 0, 0.0 4,-0.6 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 140.9 97.8 57.2 37.7 2 7 A A H > + 0 0 14 174,-0.9 4,-1.6 171,-0.3 172,-0.1 0.953 360.0 70.5 -56.5 -51.2 95.4 54.6 36.2 3 8 A K H 4 S+ 0 0 118 173,-0.3 2,-2.9 1,-0.2 4,-0.1 -0.308 111.9 3.8 -68.3 150.1 98.0 53.7 33.6 4 9 A N H 4 S+ 0 0 136 2,-0.3 -1,-0.2 1,-0.2 -2,-0.1 -0.311 119.6 73.0 74.3 -60.8 101.2 51.9 34.6 5 10 A D H < S+ 0 0 97 -2,-2.9 2,-0.2 -4,-0.6 -1,-0.2 0.868 100.6 42.1 -53.3 -42.5 100.1 51.5 38.2 6 11 A F S < S- 0 0 45 -4,-1.6 2,-0.3 -5,-0.2 -2,-0.3 -0.627 83.7-115.6-106.9 168.6 97.5 48.9 37.3 7 12 A S >> - 0 0 48 -2,-0.2 4,-2.1 -4,-0.1 3,-1.2 -0.703 31.9-107.0-100.9 152.1 97.5 45.8 35.0 8 13 A D H 3> S+ 0 0 65 -2,-0.3 4,-1.9 1,-0.3 5,-0.2 0.873 118.9 53.1 -42.5 -50.0 95.3 45.4 31.9 9 14 A I H 34 S+ 0 0 126 2,-0.2 4,-0.4 1,-0.2 -1,-0.3 0.830 111.7 44.6 -58.0 -37.2 93.1 42.8 33.7 10 15 A E H X> S+ 0 0 89 -3,-1.2 3,-3.0 2,-0.2 4,-2.7 0.983 111.4 51.3 -70.9 -58.5 92.4 45.1 36.7 11 16 A L H 3< S+ 0 0 18 -4,-2.1 258,-0.2 1,-0.3 -2,-0.2 0.781 108.7 54.0 -47.0 -33.9 91.7 48.2 34.6 12 17 A A T 3< S+ 0 0 2 -4,-1.9 -1,-0.3 -5,-0.3 4,-0.3 0.661 115.6 39.0 -78.5 -15.1 89.3 46.1 32.6 13 18 A A T <> S+ 0 0 19 -3,-3.0 4,-1.7 -4,-0.4 -2,-0.2 0.801 99.0 74.1-101.9 -35.0 87.5 45.1 35.8 14 19 A I H X S+ 0 0 22 -4,-2.7 4,-2.3 1,-0.2 5,-0.2 0.826 93.2 51.0 -48.0 -51.1 87.5 48.3 37.8 15 20 A P H > S+ 0 0 0 0, 0.0 4,-0.8 0, 0.0 -1,-0.2 0.970 109.7 50.5 -55.2 -54.2 84.9 50.3 35.9 16 21 A F H > S+ 0 0 0 -4,-0.3 4,-0.7 2,-0.2 3,-0.3 0.885 114.7 43.0 -48.3 -51.7 82.3 47.5 36.1 17 22 A N H >X S+ 0 0 64 -4,-1.7 4,-2.3 2,-0.3 3,-2.2 0.981 110.9 51.1 -61.9 -60.9 82.7 47.0 39.8 18 23 A T H 3< S+ 0 0 21 -4,-2.3 4,-0.3 1,-0.3 -1,-0.2 0.653 119.6 42.8 -54.1 -10.7 82.7 50.6 40.8 19 24 A L H 3< S+ 0 0 0 -4,-0.8 -1,-0.3 -3,-0.3 -2,-0.3 0.524 108.1 56.8-112.5 -11.5 79.6 50.8 38.7 20 25 A A H S+ 0 0 19 128,-1.5 4,-1.7 127,-0.2 5,-0.2 0.818 119.0 63.6 -83.8 -34.9 74.7 44.8 38.2 26 31 A R H > S+ 0 0 154 127,-1.1 4,-0.9 128,-0.4 -1,-0.1 0.893 113.6 32.3 -57.3 -45.4 72.1 44.8 35.5 27 32 A L H > S+ 0 0 17 -4,-0.4 4,-2.9 2,-0.2 5,-0.2 0.796 105.3 73.4 -81.7 -35.1 72.8 48.4 34.4 28 33 A A H X S+ 0 0 0 -4,-1.0 4,-1.8 1,-0.3 3,-0.3 0.940 106.1 37.9 -44.1 -54.2 76.5 48.2 35.2 29 34 A R H X S+ 0 0 58 -4,-1.7 4,-3.1 1,-0.2 5,-0.3 0.861 110.7 59.9 -67.5 -36.5 76.9 46.0 32.1 30 35 A E H X S+ 0 0 55 -4,-0.9 4,-2.1 -5,-0.2 -1,-0.2 0.864 106.0 50.0 -60.4 -34.7 74.3 48.0 30.1 31 36 A Q H X S+ 0 0 0 -4,-2.9 4,-2.3 -3,-0.3 -2,-0.2 0.970 117.4 36.2 -69.3 -54.3 76.5 51.1 30.5 32 37 A L H X S+ 0 0 0 -4,-1.8 4,-3.0 -5,-0.2 5,-0.2 0.986 116.8 53.6 -62.8 -54.7 79.8 49.5 29.4 33 38 A A H X S+ 0 0 21 -4,-3.1 4,-0.7 1,-0.3 -2,-0.2 0.912 110.8 47.5 -41.1 -57.2 78.1 47.4 26.8 34 39 A L H >< S+ 0 0 10 -4,-2.1 3,-1.1 -5,-0.3 -1,-0.3 0.888 112.0 48.7 -54.1 -46.3 76.5 50.5 25.3 35 40 A E H >< S+ 0 0 5 -4,-2.3 3,-2.3 1,-0.2 -1,-0.2 0.916 102.4 63.2 -63.2 -40.0 79.7 52.4 25.4 36 41 A H H >X S+ 0 0 20 -4,-3.0 4,-1.7 1,-0.3 3,-1.7 0.654 84.2 77.9 -58.6 -17.5 81.6 49.5 23.7 37 42 A E T << S+ 0 0 12 -3,-1.1 -1,-0.3 -4,-0.7 -2,-0.2 0.709 74.3 77.9 -64.9 -21.0 79.3 50.0 20.7 38 43 A S T <4 S+ 0 0 4 -3,-2.3 -1,-0.3 -4,-0.2 -2,-0.2 0.653 111.6 22.4 -63.5 -12.0 81.5 52.9 19.7 39 44 A Y T <4 S+ 0 0 5 -3,-1.7 58,-0.5 1,-0.3 2,-0.3 0.685 127.8 17.9-124.7 -35.3 84.0 50.4 18.5 40 45 A E < - 0 0 44 -4,-1.7 -1,-0.3 56,-0.1 2,-0.3 -1.000 64.7-121.4-147.6 145.6 82.3 47.1 17.6 41 46 A M - 0 0 14 51,-0.5 2,-0.3 -2,-0.3 55,-0.1 -0.620 39.9-109.6 -82.1 142.7 78.8 45.7 17.0 42 47 A G > - 0 0 25 -2,-0.3 4,-3.2 1,-0.1 5,-0.2 -0.550 13.8-140.2 -78.7 132.2 77.6 42.9 19.3 43 48 A E H > S+ 0 0 141 -2,-0.3 4,-2.4 2,-0.2 3,-0.5 0.972 104.4 36.5 -49.6 -70.2 77.3 39.4 17.9 44 49 A A H > S+ 0 0 76 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.946 117.5 53.0 -47.2 -58.6 74.1 38.6 19.7 45 50 A R H 4 S+ 0 0 118 1,-0.2 -1,-0.2 2,-0.2 -2,-0.2 0.835 114.0 43.8 -46.7 -41.7 72.8 42.1 19.3 46 51 A F H >< S+ 0 0 32 -4,-3.2 3,-3.3 -3,-0.5 -2,-0.2 0.991 113.2 46.9 -68.1 -64.7 73.5 41.9 15.5 47 52 A R H >< S+ 0 0 151 -4,-2.4 3,-1.2 1,-0.3 -2,-0.2 0.817 100.5 71.0 -46.9 -35.7 72.1 38.4 14.8 48 53 A K T 3< S+ 0 0 183 -4,-2.9 -1,-0.3 -5,-0.4 -2,-0.2 0.680 81.3 75.2 -59.2 -16.4 69.1 39.4 16.9 49 54 A M T < 0 0 54 -3,-3.3 -1,-0.3 -5,-0.2 -2,-0.1 0.145 360.0 360.0 -85.2 22.7 68.1 41.6 14.0 50 55 A F < 0 0 150 -3,-1.2 -2,-0.1 5,-0.0 -3,-0.1 0.224 360.0 360.0-121.1 360.0 66.9 38.7 11.9 51 ! 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 52 72 A P 0 0 66 0, 0.0 3,-0.4 0, 0.0 188,-0.2 0.000 360.0 360.0 360.0 161.9 67.8 47.2 8.7 53 73 A L >> + 0 0 9 187,-2.7 3,-2.9 1,-0.2 4,-1.4 0.955 360.0 63.9 -64.4 -51.1 70.7 48.4 6.7 54 74 A I H 3> S+ 0 0 0 186,-0.6 4,-1.3 1,-0.3 -1,-0.2 0.765 87.0 73.0 -42.8 -37.4 73.5 47.2 8.9 55 75 A T H 34 S+ 0 0 24 -3,-0.4 -1,-0.3 1,-0.2 -2,-0.1 0.614 110.3 29.5 -59.4 -11.0 72.5 43.6 8.4 56 76 A T H <> S+ 0 0 54 -3,-2.9 4,-1.5 -4,-0.1 5,-0.2 0.737 118.9 51.6-114.7 -42.2 73.9 43.8 4.9 57 77 A L H X S+ 0 0 1 -4,-1.4 4,-3.0 2,-0.2 3,-0.4 0.986 105.7 53.2 -58.4 -65.2 76.7 46.4 5.2 58 78 A L H X S+ 0 0 11 -4,-1.3 4,-3.2 1,-0.2 5,-0.3 0.880 109.5 45.7 -38.8 -63.9 78.5 44.9 8.1 59 79 A P H > S+ 0 0 54 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.881 116.7 44.5 -53.2 -42.9 79.0 41.3 6.8 60 80 A K H X S+ 0 0 101 -4,-1.5 4,-1.7 -3,-0.4 -2,-0.2 0.871 114.6 50.3 -69.8 -35.6 80.1 42.5 3.4 61 81 A M H X S+ 0 0 0 -4,-3.0 4,-1.3 -5,-0.2 -1,-0.2 0.960 110.0 49.4 -65.7 -49.1 82.4 45.0 4.9 62 82 A I H X S+ 0 0 28 -4,-3.2 4,-1.1 -5,-0.3 3,-0.3 0.878 108.7 51.6 -58.4 -42.2 84.0 42.6 7.2 63 83 A A H >X S+ 0 0 46 -4,-1.9 4,-2.2 -5,-0.3 3,-0.6 0.911 106.1 56.5 -62.4 -39.9 84.6 40.0 4.6 64 84 A R H 3X S+ 0 0 35 -4,-1.7 4,-1.8 1,-0.2 -1,-0.2 0.798 100.0 57.8 -64.0 -30.3 86.4 42.7 2.4 65 85 A I H 3X S+ 0 0 0 -4,-1.3 4,-1.6 -3,-0.3 -1,-0.2 0.841 109.2 45.4 -68.8 -32.4 88.8 43.6 5.1 66 86 A N H > - 0 0 43 0, 0.0 4,-1.0 0, 0.0 3,-0.8 -0.265 33.6-125.0 -55.5 136.5 100.5 49.8 1.9 81 101 A T H 3> S+ 0 0 43 1,-0.3 4,-1.0 2,-0.2 5,-0.2 0.841 108.5 61.5 -52.1 -39.3 101.0 52.1 4.9 82 102 A A H >> S+ 0 0 0 1,-0.2 4,-3.1 2,-0.2 3,-0.8 0.921 97.9 59.9 -54.7 -44.9 97.4 51.6 6.0 83 103 A F H <> S+ 0 0 6 -3,-0.8 4,-3.2 1,-0.2 5,-0.4 0.954 94.9 61.0 -44.0 -71.6 98.1 47.9 6.4 84 104 A Q H 3< S+ 0 0 94 -4,-1.0 4,-0.4 1,-0.3 -1,-0.2 0.714 117.3 31.1 -25.1 -47.6 100.8 48.4 9.0 85 105 A F H XX S+ 0 0 46 -4,-1.0 4,-0.7 -3,-0.8 3,-0.7 0.924 122.2 47.4 -85.2 -48.2 98.4 50.0 11.3 86 106 A L H 3< S+ 0 0 1 -4,-3.1 3,-0.3 1,-0.2 -2,-0.2 0.790 96.4 70.5 -64.4 -32.5 95.2 48.3 10.3 87 107 A Q T 3< S+ 0 0 82 -4,-3.2 -1,-0.2 -5,-0.3 -3,-0.1 0.849 96.6 54.8 -55.0 -37.4 96.6 44.7 10.4 88 108 A E T <4 S+ 0 0 157 -3,-0.7 -1,-0.2 -4,-0.4 -2,-0.2 0.899 95.4 80.6 -62.6 -45.7 96.8 44.8 14.2 89 109 A I S < S- 0 0 10 -4,-0.7 40,-0.1 -3,-0.3 37,-0.0 -0.269 91.1-100.7 -68.7 151.4 93.1 45.8 14.7 90 110 A K >> - 0 0 79 1,-0.1 4,-2.1 38,-0.1 3,-1.4 -0.519 23.6-136.2 -72.4 128.4 90.3 43.4 14.7 91 111 A P H 3> S+ 0 0 28 0, 0.0 4,-2.2 0, 0.0 5,-0.3 0.835 102.6 61.2 -56.3 -33.0 88.3 43.3 11.4 92 112 A E H 3> S+ 0 0 64 1,-0.2 4,-1.1 2,-0.2 -51,-0.5 0.828 111.0 41.1 -64.5 -26.7 85.0 43.3 13.2 93 113 A A H <> S+ 0 0 0 -3,-1.4 4,-2.8 2,-0.2 5,-0.3 0.865 111.2 54.1 -85.8 -40.9 85.9 46.6 14.8 94 114 A V H X S+ 0 0 0 -4,-2.1 4,-1.9 1,-0.2 -2,-0.2 0.912 110.8 47.5 -58.8 -45.0 87.5 48.2 11.7 95 115 A A H X S+ 0 0 0 -4,-2.2 4,-2.4 -5,-0.2 5,-0.2 0.952 114.9 43.8 -63.4 -51.3 84.4 47.6 9.6 96 116 A Y H X S+ 0 0 2 -4,-1.1 4,-2.4 -5,-0.3 5,-0.4 0.946 111.5 52.7 -60.2 -51.4 81.9 48.9 12.2 97 117 A I H X S+ 0 0 0 -4,-2.8 4,-2.6 -58,-0.5 5,-0.2 0.917 113.4 47.1 -51.8 -43.5 83.9 51.9 13.0 98 118 A T H X S+ 0 0 0 -4,-1.9 4,-3.1 -5,-0.3 5,-0.2 0.995 114.9 40.7 -62.6 -68.9 84.0 52.7 9.3 99 119 A I H X S+ 0 0 1 -4,-2.4 4,-2.2 1,-0.2 3,-0.3 0.938 120.1 46.5 -41.2 -62.6 80.4 52.2 8.4 100 120 A K H X S+ 0 0 4 -4,-2.4 4,-1.8 1,-0.2 -1,-0.2 0.904 117.1 42.5 -46.3 -56.3 79.2 53.9 11.6 101 121 A T H X S+ 0 0 8 -4,-2.6 4,-1.9 -5,-0.4 -1,-0.2 0.778 108.9 57.4 -65.9 -32.8 81.6 56.8 11.3 102 122 A T H X S+ 0 0 0 -4,-3.1 4,-1.6 -3,-0.3 -1,-0.2 0.973 108.8 46.4 -64.6 -50.9 81.1 57.4 7.6 103 123 A L H < S+ 0 0 3 -4,-2.2 3,-0.2 -5,-0.2 -2,-0.2 0.894 109.0 53.9 -56.2 -47.9 77.4 57.9 8.1 104 124 A A H >< S+ 0 0 28 -4,-1.8 3,-1.6 1,-0.3 4,-0.3 0.910 108.1 51.6 -56.2 -41.3 77.8 60.2 11.0 105 125 A C H >< S+ 0 0 26 -4,-1.9 3,-1.7 1,-0.3 -1,-0.3 0.848 98.4 65.4 -66.2 -30.8 80.1 62.3 8.8 106 126 A L T 3< S+ 0 0 11 -4,-1.6 -1,-0.3 1,-0.3 270,-0.2 0.408 83.2 78.2 -72.4 7.4 77.4 62.4 6.1 107 127 A T T < S+ 0 0 40 -3,-1.6 2,-0.6 269,-0.1 -1,-0.3 0.729 72.8 90.9 -85.4 -20.9 75.3 64.4 8.4 108 128 A S < - 0 0 42 -3,-1.7 266,-0.1 -4,-0.3 265,-0.0 -0.627 66.4-156.4 -77.3 118.0 77.3 67.5 7.7 109 129 A A S S+ 0 0 31 -2,-0.6 -1,-0.2 1,-0.1 3,-0.1 0.616 87.3 25.7 -68.6 -9.1 75.7 69.3 4.8 110 130 A D S S+ 0 0 133 1,-0.1 2,-1.8 260,-0.1 -1,-0.1 0.778 109.3 54.0-117.1 -68.9 79.0 70.9 4.0 111 131 A N + 0 0 93 1,-0.2 -3,-0.2 5,-0.0 -1,-0.1 -0.498 57.6 129.3 -79.1 75.6 82.3 69.3 5.0 112 132 A T + 0 0 3 -2,-1.8 112,-2.3 -3,-0.1 2,-0.3 -0.212 32.5 142.3-115.9 37.1 82.0 65.8 3.5 113 133 A T B >> -A 223 0A 30 110,-0.2 4,-1.9 1,-0.1 3,-1.4 -0.608 68.3-108.6 -80.6 145.7 85.4 66.0 1.8 114 134 A V H 3> S+ 0 0 3 108,-2.6 4,-2.3 1,-0.3 5,-0.2 0.712 118.8 56.0 -44.5 -27.9 87.4 62.9 1.7 115 135 A Q H 3> S+ 0 0 51 107,-0.3 4,-2.7 2,-0.2 -1,-0.3 0.897 105.1 48.4 -76.7 -39.8 89.8 64.4 4.3 116 136 A A H <> S+ 0 0 27 -3,-1.4 4,-1.5 2,-0.2 -2,-0.2 0.930 119.3 40.8 -64.1 -43.8 87.1 65.2 6.9 117 137 A V H X S+ 0 0 2 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.929 115.8 48.5 -69.1 -46.9 85.8 61.7 6.5 118 138 A A H X S+ 0 0 1 -4,-2.3 4,-2.1 -5,-0.3 75,-0.2 0.914 110.0 53.6 -60.6 -42.4 89.1 60.0 6.3 119 139 A S H X S+ 0 0 25 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.871 105.9 52.5 -61.7 -37.1 90.3 61.9 9.3 120 140 A A H X S+ 0 0 29 -4,-1.5 4,-1.2 2,-0.2 -1,-0.2 0.865 108.2 50.8 -66.2 -40.7 87.4 60.7 11.4 121 141 A I H >X S+ 0 0 0 -4,-1.8 4,-3.5 2,-0.2 3,-0.8 0.959 110.7 47.1 -65.3 -49.6 87.9 57.1 10.6 122 142 A G H 3X S+ 0 0 0 -4,-2.1 4,-1.7 1,-0.3 -2,-0.2 0.893 107.8 58.3 -58.7 -38.2 91.6 57.2 11.5 123 143 A R H 3< S+ 0 0 144 -4,-2.0 4,-0.3 -5,-0.2 -1,-0.3 0.800 117.2 32.1 -62.9 -28.8 90.8 59.0 14.7 124 144 A A H S+ 0 0 38 1,-0.2 4,-2.4 -2,-0.1 5,-0.2 0.202 92.4 107.9 52.9 -28.0 92.5 50.4 24.4 132 152 A G H X S+ 0 0 13 -2,-3.3 4,-1.8 -4,-1.1 -1,-0.2 0.873 76.8 50.6 -47.8 -44.6 91.2 47.4 22.2 133 153 A R H >> S+ 0 0 159 -4,-0.3 4,-1.9 1,-0.2 3,-1.6 0.994 113.7 41.9 -57.2 -67.5 92.9 44.9 24.5 134 154 A I H 3> S+ 0 0 23 1,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.785 111.9 59.3 -49.8 -29.8 91.5 46.2 27.7 135 155 A R H 3X S+ 0 0 14 -4,-2.4 4,-1.9 2,-0.2 -1,-0.3 0.866 105.3 47.8 -68.7 -36.5 88.2 46.6 25.8 136 156 A D H X S+ 0 0 122 -4,-2.2 3,-1.5 1,-0.2 4,-1.0 0.975 110.7 52.5 -50.7 -59.9 84.6 39.2 29.0 141 161 A H H 3< S+ 0 0 40 -4,-2.8 3,-0.3 1,-0.3 -1,-0.2 0.767 111.9 40.0 -50.6 -42.5 84.4 40.5 32.5 142 162 A F H 3< S+ 0 0 9 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.534 104.9 69.6 -88.9 -3.4 80.9 42.1 32.5 143 163 A K H << S+ 0 0 117 -3,-1.5 2,-0.2 -4,-1.0 -2,-0.2 0.790 89.8 73.9 -79.0 -28.3 79.6 39.2 30.5 144 164 A K S < S- 0 0 89 -4,-1.0 2,-0.2 -3,-0.3 0, 0.0 -0.608 93.7-107.8 -87.0 145.2 80.1 36.9 33.5 145 165 A N - 0 0 101 -2,-0.2 -2,-0.1 1,-0.1 -1,-0.1 -0.514 34.2-117.3 -73.1 138.3 77.6 37.2 36.5 146 166 A V - 0 0 35 -2,-0.2 2,-0.3 1,-0.1 -1,-0.1 -0.317 37.1 -92.6 -73.0 157.0 79.0 38.7 39.7 147 167 A E - 0 0 160 -2,-0.0 -1,-0.1 0, 0.0 0, 0.0 -0.559 67.8 -42.4 -80.9 133.1 79.2 36.7 42.9 148 168 A E S S+ 0 0 151 -2,-0.3 5,-0.1 4,-0.0 -2,-0.0 0.434 82.6 91.0 43.6-178.9 76.4 36.6 45.5 149 169 A Q > - 0 0 86 3,-0.1 4,-1.2 1,-0.1 5,-0.1 0.968 40.4-166.5 59.4 98.2 74.2 39.3 47.0 150 170 A L H > S+ 0 0 118 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.734 85.8 61.4 -80.8 -25.3 70.9 39.7 45.1 151 171 A N H > S+ 0 0 133 2,-0.2 4,-1.0 1,-0.2 -1,-0.2 0.822 110.6 40.8 -70.3 -31.1 70.0 43.0 46.9 152 172 A K H 4 S+ 0 0 124 2,-0.2 -2,-0.2 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