==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 29-SEP-06 2IJF . COMPND 2 MOLECULE: RNA-DIRECTED RNA POLYMERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HUMAN POLIOVIRUS 1; . AUTHOR L.L.MARCOTTE,D.G.GOHARA,D.J.FILMAN,J.M.HOGLE . 461 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22091.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 306 66.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 7 1.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 51 11.1 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 . 5 1.1 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 . 30 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 62 13.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 140 30.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.5 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 2 2 1 1 0 3 1 1 1 0 1 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 2 3 2 2 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 ANTIPARALLEL BRIDGES PER LADDER . 3 1 0 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 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 G 0 0 0 0, 0.0 2,-0.3 0, 0.0 283,-0.2 0.000 360.0 360.0 360.0 117.0 54.6 -1.4 22.4 2 2 A E E -A 283 0A 60 281,-1.4 281,-3.1 282,-0.1 2,-0.3 -0.949 360.0-124.2-155.2 129.9 53.6 -0.2 25.9 3 3 A I E -A 282 0A 50 -2,-0.3 279,-0.2 59,-0.3 3,-0.1 -0.573 18.4-169.6 -73.5 129.3 54.4 2.9 28.1 4 4 A Q E - 0 0 82 277,-2.2 2,-0.3 1,-0.4 -1,-0.1 0.821 67.5 -23.7 -87.3 -36.9 55.9 1.9 31.4 5 5 A W E -A 281 0A 112 276,-0.8 276,-1.2 2,-0.0 -1,-0.4 -0.942 58.3-161.1-169.3 159.5 55.7 5.3 33.0 6 6 A M E +A 280 0A 66 -2,-0.3 274,-0.2 274,-0.2 272,-0.0 -0.985 20.5 142.0-151.7 148.1 55.6 8.9 32.0 7 7 A R E -A 279 0A 113 272,-1.8 272,-2.9 -2,-0.3 2,-0.1 -0.984 52.8 -47.9-174.9 170.7 56.3 12.2 33.7 8 8 A P E >> -A 278 0A 38 0, 0.0 3,-1.7 0, 0.0 4,-0.6 -0.316 44.8-135.6 -56.4 124.3 57.7 15.8 33.6 9 9 A S G >4>S+ 0 0 0 268,-3.2 5,-3.5 1,-0.3 3,-0.8 0.756 102.6 65.5 -51.5 -30.6 61.2 15.8 32.1 10 10 A K G >45S+ 0 0 177 267,-0.5 3,-1.6 3,-0.3 -1,-0.3 0.854 91.2 62.9 -63.3 -35.0 62.3 18.2 34.8 11 11 A E G <45S+ 0 0 111 -3,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.751 112.2 36.3 -61.7 -26.2 61.8 15.4 37.5 12 12 A V G <<5S- 0 0 50 -3,-0.8 -1,-0.3 -4,-0.6 -2,-0.2 0.101 127.3 -97.2-113.7 19.6 64.4 13.3 35.8 13 13 A G T < 5S+ 0 0 60 -3,-1.6 -3,-0.3 1,-0.2 -2,-0.1 0.816 78.6 131.3 71.7 36.9 66.6 16.2 34.9 14 14 A Y < - 0 0 60 -5,-3.5 -1,-0.2 -6,-0.1 -2,-0.1 -0.929 48.0-129.3-119.9 145.6 65.6 16.9 31.2 15 15 A P - 0 0 56 0, 0.0 2,-0.2 0, 0.0 -6,-0.1 -0.224 32.7 -89.3 -83.4 177.5 64.7 20.2 29.6 16 16 A I - 0 0 106 106,-0.1 2,-0.4 261,-0.1 261,-0.2 -0.553 33.6-133.6 -87.5 151.4 61.7 21.0 27.4 17 17 A I - 0 0 8 259,-1.7 2,-0.9 -2,-0.2 105,-0.1 -0.887 3.9-143.9-108.7 135.7 61.5 20.6 23.6 18 18 A N - 0 0 149 -2,-0.4 3,-0.1 103,-0.3 -2,-0.0 -0.474 21.5-177.6 -96.9 63.5 60.2 23.2 21.2 19 19 A A - 0 0 18 -2,-0.9 -2,-0.0 1,-0.1 138,-0.0 -0.413 44.1 -94.3 -59.8 130.3 58.4 21.2 18.5 20 20 A P - 0 0 87 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 -0.146 29.0-148.8 -49.2 132.6 57.1 23.7 15.9 21 21 A S S S+ 0 0 93 -3,-0.1 2,-0.4 2,-0.1 23,-0.3 0.659 74.0 60.4 -82.1 -15.7 53.5 24.7 16.5 22 22 A K S S- 0 0 166 21,-0.1 138,-0.0 138,-0.0 -1,-0.0 -0.933 80.7-118.7-120.8 142.3 52.5 25.2 12.9 23 23 A T - 0 0 35 -2,-0.4 -2,-0.1 18,-0.1 19,-0.0 -0.299 8.5-145.4 -66.9 150.0 52.4 22.9 9.8 24 24 A K S S+ 0 0 144 -2,-0.0 2,-0.4 2,-0.0 -1,-0.1 0.534 71.7 102.9 -93.8 -9.3 54.6 23.7 6.8 25 25 A L + 0 0 21 378,-0.1 380,-0.2 136,-0.1 -2,-0.1 -0.636 44.3 158.0 -79.3 124.1 51.9 22.3 4.5 26 26 A E E -F 404 0B 102 378,-1.4 378,-1.5 -2,-0.4 -2,-0.0 -0.973 50.4 -70.8-144.8 153.3 49.8 24.9 2.7 27 27 A P E -F 403 0B 69 0, 0.0 376,-0.3 0, 0.0 2,-0.1 -0.156 53.0-145.6 -47.8 129.2 47.7 24.9 -0.5 28 28 A S > - 0 0 16 374,-2.6 3,-2.3 1,-0.1 4,-0.3 -0.322 33.6 -87.7 -92.6 176.8 49.9 24.7 -3.7 29 29 A A T 3 S+ 0 0 46 1,-0.3 3,-0.2 2,-0.1 412,-0.1 0.660 131.5 46.5 -55.9 -19.1 49.4 26.2 -7.2 30 30 A F T >> S+ 0 0 2 371,-0.4 4,-1.4 1,-0.1 3,-1.0 0.248 76.7 111.6-108.9 7.3 47.4 23.1 -8.0 31 31 A H T <4 S+ 0 0 18 -3,-2.3 3,-0.1 1,-0.3 -2,-0.1 0.875 88.9 31.5 -50.7 -46.7 45.2 23.0 -4.9 32 32 A Y T 34 S+ 0 0 200 -4,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.408 111.4 64.5 -96.4 3.0 42.0 23.9 -6.7 33 33 A V T <4 S+ 0 0 46 -3,-1.0 2,-0.3 2,-0.0 -2,-0.2 0.657 104.5 45.8 -96.5 -19.6 42.8 22.2 -10.0 34 34 A F S < S- 0 0 11 -4,-1.4 2,-0.5 -3,-0.1 -1,-0.0 -0.851 84.7-113.9-121.5 159.6 42.9 18.7 -8.6 35 35 A E + 0 0 175 -2,-0.3 2,-0.3 -3,-0.0 367,-0.1 -0.813 44.1 148.2 -98.0 130.1 40.6 16.8 -6.2 36 36 A G - 0 0 20 -2,-0.5 360,-0.0 -5,-0.1 -2,-0.0 -0.955 34.7-162.3-160.9 140.1 41.8 15.7 -2.8 37 37 A V + 0 0 103 -2,-0.3 128,-0.3 2,-0.0 2,-0.3 0.226 59.2 108.7-106.9 10.4 40.2 15.2 0.6 38 38 A K - 0 0 66 126,-0.1 126,-0.2 127,-0.1 124,-0.1 -0.670 42.7-172.7 -95.9 148.3 43.4 15.3 2.7 39 39 A E E -G 163 0C 46 124,-2.1 124,-2.5 -2,-0.3 3,-0.1 -0.910 39.6 -79.5-131.4 155.9 44.5 18.1 5.1 40 40 A P E -G 162 0C 13 0, 0.0 122,-0.2 0, 0.0 3,-0.1 -0.265 60.5-100.1 -55.2 142.9 47.8 18.7 7.1 41 41 A A - 0 0 3 120,-2.6 2,-0.4 118,-0.1 -18,-0.1 -0.029 39.2 -92.2 -60.7 165.6 47.9 16.6 10.3 42 42 A V + 0 0 0 125,-0.2 -1,-0.1 1,-0.2 3,-0.1 -0.683 44.6 174.3 -81.0 133.3 47.1 17.9 13.8 43 43 A L + 0 0 18 -2,-0.4 2,-0.3 1,-0.2 -1,-0.2 0.799 56.3 27.9-107.9 -45.3 50.2 19.1 15.5 44 44 A T S > S- 0 0 25 -23,-0.3 3,-1.2 1,-0.1 -1,-0.2 -0.759 79.4-106.6-120.1 168.7 49.2 20.8 18.8 45 45 A K T 3 S+ 0 0 75 -2,-0.3 9,-0.1 1,-0.2 5,-0.1 0.695 110.4 67.4 -58.7 -25.6 46.4 20.5 21.3 46 46 A N T 3 + 0 0 140 3,-0.0 -1,-0.2 8,-0.0 4,-0.1 0.648 62.0 128.1 -74.2 -22.4 44.9 23.8 20.0 47 47 A D X - 0 0 29 -3,-1.2 3,-1.8 1,-0.2 -5,-0.0 -0.131 53.9-145.0 -44.6 115.1 43.7 22.7 16.5 48 48 A P T 3 S+ 0 0 128 0, 0.0 -1,-0.2 0, 0.0 -3,-0.0 0.669 93.0 69.3 -57.4 -20.6 40.0 23.8 16.2 49 49 A R T 3 S+ 0 0 69 119,-0.0 2,-0.3 2,-0.0 122,-0.1 0.416 73.8 115.2 -81.8 2.4 39.3 20.7 14.0 50 50 A L < + 0 0 37 -3,-1.8 119,-0.2 1,-0.1 120,-0.2 -0.557 34.3 173.6 -77.8 135.2 39.8 18.3 17.0 51 51 A K + 0 0 168 118,-2.5 2,-0.2 -2,-0.3 119,-0.2 0.772 69.3 33.5-104.3 -42.3 36.7 16.2 18.1 52 52 A T S S- 0 0 66 117,-1.2 -1,-0.1 1,-0.1 119,-0.0 -0.638 107.5 -66.8-108.3 169.4 38.3 13.9 20.8 53 53 A D > - 0 0 87 -2,-0.2 4,-1.0 1,-0.1 -1,-0.1 -0.238 39.3-148.2 -57.2 142.3 41.2 14.6 23.1 54 54 A F H > S+ 0 0 3 2,-0.2 4,-1.8 -9,-0.1 5,-0.3 0.971 88.9 50.6 -77.1 -60.5 44.6 15.1 21.5 55 55 A E H > S+ 0 0 66 1,-0.2 4,-1.5 2,-0.2 5,-0.2 0.881 113.6 47.5 -45.5 -49.9 47.2 13.8 24.0 56 56 A E H > S+ 0 0 123 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.924 108.4 55.1 -59.0 -50.1 45.3 10.5 24.4 57 57 A A H < S+ 0 0 11 -4,-1.0 -2,-0.2 1,-0.2 -1,-0.2 0.892 108.6 44.3 -50.9 -55.5 44.8 10.0 20.6 58 58 A I H >< S+ 0 0 4 -4,-1.8 3,-0.7 1,-0.2 -1,-0.2 0.852 118.3 43.6 -63.4 -38.8 48.5 10.1 19.6 59 59 A F H >< S+ 0 0 27 -4,-1.5 3,-2.3 -5,-0.3 -1,-0.2 0.697 90.0 85.3 -81.4 -19.9 49.7 8.0 22.5 60 60 A S T 3< + 0 0 58 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.1 0.556 68.8 84.6 -59.2 -5.2 46.9 5.4 22.1 61 61 A K T < + 0 0 67 -3,-0.7 2,-1.3 1,-0.2 -1,-0.3 0.713 70.0 85.2 -70.4 -17.9 49.1 3.7 19.5 62 62 A Y < + 0 0 25 -3,-2.3 -59,-0.3 1,-0.2 -1,-0.2 -0.692 58.0 167.8 -87.9 90.7 50.9 1.9 22.3 63 63 A V - 0 0 100 -2,-1.3 2,-0.3 1,-0.2 -1,-0.2 0.964 40.7 -87.9 -63.6 -93.8 48.7 -1.1 22.9 64 64 A S - 0 0 60 287,-0.1 2,-0.6 175,-0.1 -1,-0.2 -0.928 36.2 -86.4-169.9-179.4 50.3 -3.7 25.1 65 65 A N - 0 0 32 -2,-0.3 286,-0.1 1,-0.1 3,-0.1 -0.942 29.9-178.1-111.2 119.2 52.6 -6.7 24.9 66 66 A K S S+ 0 0 146 -2,-0.6 2,-0.3 1,-0.2 -1,-0.1 0.794 73.3 35.7 -83.8 -31.6 50.8 -9.9 24.2 67 67 A I - 0 0 31 283,-0.2 177,-0.6 1,-0.1 -1,-0.2 -0.957 50.2-179.5-127.9 145.9 54.0 -12.0 24.3 68 68 A T + 0 0 103 -2,-0.3 2,-0.2 175,-0.1 -1,-0.1 0.810 66.6 46.2-103.9 -47.7 57.2 -11.8 26.4 69 69 A E S S- 0 0 159 174,-0.1 2,-0.6 175,-0.0 175,-0.1 -0.548 79.7-106.1-105.8 165.6 59.3 -14.7 25.2 70 70 A V - 0 0 20 -2,-0.2 2,-0.1 174,-0.1 -1,-0.0 -0.791 40.5-156.1 -89.7 115.4 60.5 -16.4 22.0 71 71 A D > - 0 0 49 -2,-0.6 4,-2.3 1,-0.1 3,-0.2 -0.281 33.3 -90.0 -88.6 176.3 58.7 -19.6 21.3 72 72 A E H > S+ 0 0 132 1,-0.2 4,-1.8 2,-0.2 5,-0.2 0.830 124.3 52.4 -50.9 -42.8 59.6 -22.7 19.3 73 73 A Y H > S+ 0 0 64 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.920 110.1 47.7 -63.2 -45.8 58.0 -21.4 16.1 74 74 A M H > S+ 0 0 0 1,-0.2 4,-3.0 2,-0.2 -2,-0.2 0.908 108.1 56.2 -61.8 -43.7 59.9 -18.1 16.3 75 75 A K H X S+ 0 0 111 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.872 110.0 44.3 -57.0 -41.5 63.2 -20.0 16.9 76 76 A E H X S+ 0 0 106 -4,-1.8 4,-2.8 2,-0.2 -1,-0.2 0.860 110.3 55.5 -72.1 -36.1 62.8 -22.0 13.7 77 77 A A H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 5,-0.3 0.951 108.8 49.2 -59.2 -48.5 61.8 -18.8 11.9 78 78 A V H X S+ 0 0 2 -4,-3.0 4,-3.0 2,-0.2 5,-0.3 0.949 111.3 48.9 -53.7 -54.6 65.1 -17.3 13.1 79 79 A D H X S+ 0 0 84 -4,-2.3 4,-2.8 2,-0.2 -2,-0.2 0.946 112.8 46.3 -52.4 -56.3 67.1 -20.3 11.9 80 80 A H H X S+ 0 0 34 -4,-2.8 4,-1.3 1,-0.2 -1,-0.2 0.931 118.1 40.5 -52.8 -55.2 65.6 -20.5 8.5 81 81 A Y H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.850 113.7 52.4 -64.3 -40.2 65.9 -16.7 7.7 82 82 A A H X S+ 0 0 3 -4,-3.0 4,-1.6 -5,-0.3 -1,-0.2 0.932 106.7 57.4 -60.4 -44.7 69.3 -16.4 9.3 83 83 A G H X S+ 0 0 47 -4,-2.8 4,-0.7 -5,-0.3 -2,-0.2 0.848 107.5 46.5 -52.6 -40.9 70.2 -19.3 7.0 84 84 A Q H >< S+ 0 0 29 -4,-1.3 3,-1.6 1,-0.2 4,-0.5 0.956 107.9 54.4 -69.4 -49.1 69.2 -17.3 4.0 85 85 A L H >< S+ 0 0 1 -4,-2.4 3,-0.9 1,-0.3 5,-0.4 0.765 100.6 63.0 -57.6 -24.4 71.0 -14.2 5.0 86 86 A M H >< S+ 0 0 102 -4,-1.6 3,-1.4 1,-0.2 -1,-0.3 0.834 90.0 65.4 -71.9 -27.6 74.2 -16.2 5.3 87 87 A S T << S+ 0 0 87 -3,-1.6 -1,-0.2 -4,-0.7 -2,-0.2 0.682 93.6 61.8 -65.6 -18.2 74.1 -17.1 1.6 88 88 A L T < S- 0 0 44 -3,-0.9 -1,-0.3 -4,-0.5 -2,-0.2 0.688 99.2-140.6 -79.5 -17.3 74.7 -13.4 0.9 89 89 A D < - 0 0 145 -3,-1.4 2,-0.2 -4,-0.4 -3,-0.1 0.982 24.1-157.1 52.2 66.7 78.0 -13.5 2.7 90 90 A I - 0 0 16 -5,-0.4 2,-0.8 1,-0.1 -1,-0.1 -0.495 22.0-107.6 -75.8 140.2 77.5 -10.1 4.3 91 91 A N - 0 0 81 102,-0.2 106,-0.1 -2,-0.2 102,-0.1 -0.588 31.2-168.3 -70.9 106.7 80.6 -8.2 5.5 92 92 A T + 0 0 59 -2,-0.8 -1,-0.2 101,-0.1 102,-0.1 0.435 48.7 113.7 -79.1 0.2 80.3 -8.5 9.4 93 93 A E S S- 0 0 132 1,-0.1 100,-0.4 98,-0.0 2,-0.1 -0.197 75.2-103.2 -67.5 165.1 83.0 -5.9 10.0 94 94 A Q - 0 0 111 98,-0.1 2,-0.4 99,-0.1 96,-0.2 -0.493 35.5-118.1 -83.7 160.5 82.2 -2.6 11.6 95 95 A M - 0 0 11 94,-3.1 97,-0.1 -2,-0.1 96,-0.1 -0.876 28.5-111.2-104.9 133.7 82.0 0.5 9.2 96 96 A C > - 0 0 69 -2,-0.4 4,-2.5 1,-0.1 5,-0.2 -0.177 29.1-110.3 -59.6 154.1 84.5 3.4 9.7 97 97 A L H > S+ 0 0 18 1,-0.2 4,-1.2 2,-0.2 5,-0.2 0.812 114.1 59.5 -55.3 -35.5 83.0 6.7 11.0 98 98 A E H >> S+ 0 0 80 2,-0.2 4,-3.5 1,-0.2 3,-0.7 0.969 111.2 37.7 -60.0 -56.7 83.6 8.4 7.6 99 99 A D H 3> S+ 0 0 44 1,-0.3 4,-1.7 2,-0.2 -2,-0.2 0.918 112.4 59.1 -59.7 -46.9 81.4 6.0 5.6 100 100 A A H 3< S+ 0 0 0 -4,-2.5 -1,-0.3 1,-0.2 -2,-0.2 0.746 119.7 30.6 -53.7 -26.6 78.9 5.8 8.5 101 101 A M H << S+ 0 0 0 -4,-1.2 9,-2.7 -3,-0.7 -2,-0.2 0.878 130.0 27.5 -99.4 -52.8 78.6 9.6 8.1 102 102 A Y H < S- 0 0 25 -4,-3.5 7,-0.4 1,-0.3 -3,-0.2 0.128 106.1-109.3-104.1 20.4 79.1 10.6 4.5 103 103 A G < - 0 0 7 -4,-1.7 -1,-0.3 5,-0.4 2,-0.3 -0.035 30.6-162.0 83.5 174.2 78.1 7.5 2.6 104 104 A T B > -H 107 0D 62 3,-2.2 3,-2.6 -4,-0.1 2,-0.2 -0.924 53.4 -39.0 179.8 174.5 79.7 4.8 0.5 105 105 A D T 3 S+ 0 0 115 1,-0.3 95,-0.1 -2,-0.3 91,-0.1 -0.349 132.9 11.2 -55.6 118.1 78.7 2.1 -2.0 106 106 A G T 3 S+ 0 0 21 -2,-0.2 2,-0.4 93,-0.1 -1,-0.3 0.196 118.8 74.6 98.6 -15.0 75.3 0.9 -0.8 107 107 A L B < -H 104 0D 11 -3,-2.6 -3,-2.2 92,-0.1 89,-0.0 -0.962 69.9-138.8-138.4 121.4 74.7 3.5 1.9 108 108 A E - 0 0 167 -2,-0.4 -5,-0.4 -5,-0.2 3,-0.1 -0.260 33.9 -98.2 -68.6 160.3 73.6 7.2 1.4 109 109 A A - 0 0 50 -7,-0.4 -7,-0.2 1,-0.2 -1,-0.1 -0.361 58.0 -70.6 -75.0 159.4 75.2 10.0 3.5 110 110 A L - 0 0 16 -9,-2.7 2,-0.8 1,-0.1 -1,-0.2 -0.210 52.7-105.7 -54.7 136.6 73.3 11.3 6.5 111 111 A D - 0 0 85 1,-0.2 3,-0.3 -3,-0.1 -1,-0.1 -0.511 27.5-159.6 -69.1 105.3 70.2 13.4 5.8 112 112 A L S S+ 0 0 70 -2,-0.8 16,-0.3 1,-0.2 15,-0.2 0.599 84.2 52.6 -61.1 -15.7 71.2 17.0 6.5 113 113 A S S S+ 0 0 85 14,-0.1 -1,-0.2 2,-0.1 3,-0.1 0.851 86.8 88.3 -92.5 -40.2 67.6 18.2 7.0 114 114 A T S S- 0 0 74 -3,-0.3 13,-0.2 1,-0.1 0, 0.0 -0.198 92.7 -69.2 -63.7 154.1 66.1 15.7 9.6 115 115 A S - 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0 0 32 1,-0.1 3,-1.6 -381,-0.0 4,-0.3 -0.939 61.5-153.6-134.8 113.7 58.6 24.7 -0.1 407 407 A P T 3 S+ 0 0 87 0, 0.0 3,-0.5 0, 0.0 4,-0.3 0.674 99.5 58.5 -52.9 -20.9 57.6 26.8 -3.2 408 408 A R T 3 S+ 0 0 204 1,-0.2 3,-0.4 2,-0.1 4,-0.2 0.764 101.1 54.4 -80.3 -28.6 61.2 26.3 -4.5 409 409 A N S <> S+ 0 0 86 -3,-1.6 4,-2.8 1,-0.2 5,-0.2 0.373 79.3 98.8 -85.3 2.6 60.9 22.5 -4.4 410 410 A T H > S+ 0 0 20 -3,-0.5 4,-2.8 -4,-0.3 5,-0.4 0.940 77.1 57.1 -55.1 -52.1 57.7 22.7 -6.6 411 411 A Q H > S+ 0 0 59 -3,-0.4 4,-2.0 -4,-0.3 -1,-0.2 0.891 114.9 37.6 -44.9 -48.3 59.7 21.8 -9.7 412 412 A D H > S+ 0 0 103 -4,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.869 112.7 54.6 -76.1 -38.4 61.0 18.6 -8.1 413 413 A H H X S+ 0 0 56 -4,-2.8 4,-1.7 2,-0.2 -2,-0.2 0.897 115.6 40.1 -63.9 -39.4 57.9 17.6 -6.2 414 414 A V H X S+ 0 0 1 -4,-2.8 4,-1.9 -5,-0.2 -2,-0.2 0.936 113.6 53.6 -72.0 -47.9 55.9 17.8 -9.5 415 415 A R H X S+ 0 0 70 -4,-2.0 4,-1.6 -5,-0.4 3,-0.2 0.901 109.7 50.0 -50.2 -47.3 58.7 16.2 -11.5 416 416 A S H X S+ 0 0 66 -4,-2.9 4,-1.0 1,-0.2 -1,-0.2 0.925 106.3 54.6 -58.9 -48.6 58.7 13.3 -8.9 417 417 A L H X S+ 0 0 12 -4,-1.7 4,-3.4 1,-0.2 3,-0.3 0.823 104.7 55.2 -57.2 -33.6 55.0 12.8 -9.2 418 418 A C H X S+ 0 0 0 -4,-1.9 4,-1.9 2,-0.2 5,-0.3 0.928 98.8 58.8 -66.0 -44.9 55.3 12.5 -13.0 419 419 A L H < S+ 0 0 52 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.778 116.0 38.7 -55.4 -24.2 57.8 9.6 -12.7 420 420 A L H >< S+ 0 0 49 -4,-1.0 3,-1.1 -3,-0.3 -28,-0.4 0.920 114.2 53.7 -87.7 -53.3 55.0 8.0 -10.8 421 421 A A H >< S+ 0 0 0 -4,-3.4 3,-2.9 1,-0.2 -2,-0.2 0.847 90.8 67.8 -48.1 -56.0 52.0 9.1 -12.9 422 422 A W G >< S+ 0 0 4 -4,-1.9 3,-1.8 1,-0.3 -1,-0.2 0.681 84.9 73.6 -46.2 -25.8 52.9 8.1 -16.5 423 423 A H G < S+ 0 0 13 -3,-1.1 -1,-0.3 1,-0.3 -2,-0.1 0.649 83.3 71.3 -66.0 -12.0 52.6 4.4 -15.6 424 424 A N G < S- 0 0 43 -3,-2.9 4,-0.3 1,-0.3 -1,-0.3 0.449 118.0 -87.9 -80.3 -2.2 48.8 5.0 -15.6 425 425 A G <> - 0 0 24 -3,-1.8 4,-3.0 -4,-0.2 -1,-0.3 -0.163 33.8 -85.0 111.5 154.5 48.9 5.3 -19.3 426 426 A E H > S+ 0 0 108 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.913 124.7 50.2 -60.5 -48.7 49.4 7.9 -22.0 427 427 A E H > S+ 0 0 136 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.940 115.5 45.1 -56.4 -48.0 45.8 9.1 -22.0 428 428 A E H > S+ 0 0 82 -4,-0.3 4,-1.9 2,-0.2 -2,-0.2 0.930 113.1 49.0 -59.1 -52.0 45.9 9.4 -18.2 429 429 A Y H X S+ 0 0 0 -4,-3.0 4,-2.8 1,-0.2 5,-0.2 0.916 109.2 52.1 -57.2 -48.1 49.3 11.1 -18.1 430 430 A N H X S+ 0 0 65 -4,-2.9 4,-2.6 1,-0.2 -1,-0.2 0.875 107.7 52.3 -58.1 -38.8 48.4 13.7 -20.7 431 431 A K H X S+ 0 0 109 -4,-1.7 4,-2.4 -5,-0.2 -1,-0.2 0.897 110.2 49.8 -61.9 -40.9 45.2 14.6 -18.7 432 432 A F H X S+ 0 0 3 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.936 112.3 45.3 -62.9 -50.8 47.5 15.1 -15.7 433 433 A L H X S+ 0 0 3 -4,-2.8 4,-3.0 2,-0.2 -2,-0.2 0.878 109.9 56.5 -60.7 -38.9 49.9 17.4 -17.6 434 434 A A H < S+ 0 0 61 -4,-2.6 -2,-0.2 -5,-0.2 4,-0.2 0.954 108.7 46.2 -55.6 -54.3 47.0 19.2 -19.1 435 435 A K H >< S+ 0 0 97 -4,-2.4 3,-1.2 1,-0.2 -1,-0.2 0.881 112.1 50.7 -57.6 -43.5 45.7 20.1 -15.7 436 436 A I H >< S+ 0 0 0 -4,-2.3 3,-1.4 1,-0.3 6,-0.4 0.939 109.1 51.0 -60.3 -48.8 49.1 21.1 -14.5 437 437 A R T 3< S+ 0 0 82 -4,-3.0 -1,-0.3 1,-0.3 -2,-0.2 0.391 88.5 82.9 -72.2 5.5 49.6 23.4 -17.4 438 438 A S T < S+ 0 0 64 -3,-1.2 -1,-0.3 -4,-0.2 -2,-0.2 0.592 89.0 60.2 -84.0 -9.0 46.3 25.1 -16.8 439 439 A V S <> S- 0 0 26 -3,-1.4 4,-1.6 -4,-0.2 3,-0.2 -0.969 91.2-116.6-123.6 138.0 48.0 27.3 -14.2 440 440 A P H > S+ 0 0 87 0, 0.0 4,-1.3 0, 0.0 3,-0.1 0.742 113.0 49.8 -32.2 -50.7 50.9 29.8 -14.6 441 441 A I H >> S+ 0 0 87 1,-0.2 3,-1.1 2,-0.2 4,-0.7 0.974 110.0 48.2 -57.9 -61.0 53.2 27.8 -12.3 442 442 A G H 34 S+ 0 0 1 -6,-0.4 3,-0.3 1,-0.3 -1,-0.2 0.722 109.2 56.2 -52.3 -26.6 52.7 24.5 -13.9 443 443 A R H 3< S+ 0 0 142 -4,-1.6 -1,-0.3 -7,-0.2 -2,-0.2 0.839 104.8 50.9 -75.7 -34.5 53.3 26.1 -17.3 444 444 A A H << S+ 0 0 87 -4,-1.3 -2,-0.2 -3,-1.1 -1,-0.2 0.482 93.9 102.0 -81.7 -4.4 56.7 27.4 -16.2 445 445 A L S < S- 0 0 30 -4,-0.7 2,-0.6 -3,-0.3 -3,-0.0 -0.262 73.1-127.9 -76.0 167.4 57.7 24.0 -15.1 446 446 A D + 0 0 109 -35,-0.1 -2,-0.1 -2,-0.0 -3,-0.1 -0.929 41.2 162.0-120.3 103.4 60.0 21.6 -16.9 447 447 A L - 0 0 13 -2,-0.6 2,-0.3 -5,-0.1 -32,-0.0 -0.839 36.0-111.4-122.0 157.5 58.3 18.2 -17.2 448 448 A P - 0 0 12 0, 0.0 2,-0.1 0, 0.0 -2,-0.0 -0.665 27.9-119.6 -93.1 146.6 58.8 15.3 -19.5 449 449 A E > - 0 0 82 -2,-0.3 4,-1.9 1,-0.1 3,-0.3 -0.421 29.1-108.8 -77.8 157.1 56.4 14.1 -22.2 450 450 A Y H > S+ 0 0 33 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.917 116.5 49.5 -49.0 -58.7 54.9 10.6 -22.1 451 451 A S H > S+ 0 0 69 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.849 109.3 55.2 -52.9 -38.3 56.9 9.1 -25.0 452 452 A T H > S+ 0 0 77 -3,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.946 110.2 44.0 -60.7 -50.2 60.1 10.4 -23.5 453 453 A L H X S+ 0 0 5 -4,-1.9 4,-1.6 1,-0.2 -2,-0.2 0.881 113.5 51.9 -61.1 -40.7 59.4 8.7 -20.1 454 454 A Y H X S+ 0 0 17 -4,-2.5 4,-2.0 -5,-0.2 -1,-0.2 0.894 111.4 45.6 -66.4 -43.4 58.4 5.5 -21.8 455 455 A D H X S+ 0 0 84 -4,-2.5 4,-2.9 2,-0.2 5,-0.3 0.947 110.2 52.4 -65.8 -48.3 61.5 5.3 -24.0 456 456 A R H X S+ 0 0 128 -4,-2.5 4,-1.2 1,-0.2 -1,-0.2 0.856 109.8 53.0 -54.9 -34.5 63.9 6.1 -21.2 457 457 A W H < S+ 0 0 8 -4,-1.6 3,-0.3 2,-0.2 4,-0.3 0.925 109.3 45.5 -67.3 -47.4 62.1 3.3 -19.3 458 458 A L H >< S+ 0 0 46 -4,-2.0 3,-1.4 1,-0.2 -2,-0.2 0.926 112.7 52.0 -62.1 -44.4 62.6 0.7 -22.1 459 459 A D H 3< S+ 0 0 134 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.765 97.7 71.6 -60.6 -27.8 66.3 1.8 -22.4 460 460 A S T 3< 0 0 52 -4,-1.2 -1,-0.2 -3,-0.3 -2,-0.2 0.528 360.0 360.0 -69.8 -9.8 66.7 1.3 -18.7 461 461 A F < 0 0 130 -3,-1.4 -1,-0.2 -4,-0.3 -2,-0.1 0.196 360.0 360.0 -87.2 360.0 66.7 -2.5 -18.6