==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/DNA 22-DEC-03 1RYR . COMPND 2 MOLECULE: 5'-D(*GP*GP*GP*GP*GP*AP*AP*GP*GP*AP*TP*TP*C)-3'; . SOURCE 2 SYNTHETIC: YES; . AUTHOR H.LING,F.BOUDSOCQ,B.PLOSKY,R.WOODGATE,W.YANG . 341 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18150.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 249 73.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 9 2.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 60 17.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.6 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 . 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 . 21 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 35 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 114 33.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.2 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 0 0 1 2 1 1 2 0 0 0 1 0 0 1 2 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 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 0 PARALLEL BRIDGES PER LADDER . 2 0 0 1 2 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 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 0 101 0, 0.0 2,-0.5 0, 0.0 109,-0.0 0.000 360.0 360.0 360.0 140.2 47.2 17.4 15.0 2 2 A I - 0 0 22 113,-0.1 109,-2.0 2,-0.0 110,-0.4 -0.989 360.0-165.0-123.0 120.5 46.0 14.8 12.5 3 3 A V E -AB 110 145A 0 142,-3.2 142,-2.0 -2,-0.5 2,-0.5 -0.900 11.6-166.5-113.6 133.4 42.2 14.2 12.4 4 4 A L E -AB 109 144A 0 105,-2.8 105,-3.1 -2,-0.4 2,-0.4 -0.964 12.1-165.4-117.9 116.4 40.4 11.3 10.8 5 5 A F E -AB 108 143A 0 138,-3.9 138,-2.6 -2,-0.5 2,-0.5 -0.855 3.2-157.8-104.4 135.7 36.6 11.8 10.5 6 6 A V E -AB 107 142A 0 101,-2.7 101,-1.5 -2,-0.4 2,-0.5 -0.962 10.3-179.4-118.0 122.9 34.2 8.9 9.7 7 7 A D E -AB 106 141A 2 134,-2.8 134,-2.4 -2,-0.5 99,-0.2 -0.935 23.3-136.9-123.8 109.4 30.8 9.5 8.2 8 8 A F E > - B 0 140A 1 97,-2.4 3,-0.9 -2,-0.5 132,-0.2 -0.430 31.5-111.6 -66.6 130.4 28.5 6.5 7.5 9 9 A D T 3 S- 0 0 2 130,-1.7 5,-0.3 1,-0.3 130,-0.1 -0.399 80.3 -28.2 -68.9 139.9 26.8 6.8 4.1 10 10 A Y T 3> S- 0 0 44 1,-0.1 4,-2.9 3,-0.1 -1,-0.3 0.725 87.4-170.4 16.5 55.9 23.0 7.4 3.9 11 11 A F H <> + 0 0 6 -3,-0.9 4,-2.2 1,-0.2 5,-0.2 0.744 67.2 44.0 -40.5 -60.9 23.1 5.5 7.2 12 12 A Y H > S+ 0 0 41 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.948 120.2 43.6 -57.5 -48.4 19.5 4.7 8.1 13 13 A A H > S+ 0 0 0 1,-0.2 4,-2.0 -3,-0.2 -2,-0.2 0.907 111.8 53.9 -63.6 -39.8 18.7 3.7 4.6 14 14 A Q H X S+ 0 0 8 -4,-2.9 4,-2.3 -5,-0.3 -1,-0.2 0.858 106.1 53.5 -63.8 -34.5 22.0 1.7 4.3 15 15 A V H X S+ 0 0 1 -4,-2.2 4,-2.2 -5,-0.2 -1,-0.2 0.866 105.9 51.7 -67.7 -36.9 21.1 -0.2 7.4 16 16 A E H X S+ 0 0 8 -4,-1.6 4,-0.7 2,-0.2 -1,-0.2 0.920 109.9 51.0 -66.0 -38.8 17.7 -1.2 6.1 17 17 A E H >< S+ 0 0 13 -4,-2.0 3,-1.0 2,-0.2 6,-0.3 0.942 109.2 50.1 -61.8 -47.7 19.5 -2.5 2.9 18 18 A V H 3< S+ 0 0 54 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.901 112.4 46.5 -58.5 -42.3 22.0 -4.5 5.0 19 19 A L H 3< S+ 0 0 91 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.601 132.3 22.0 -75.5 -9.8 19.1 -6.1 7.0 20 20 A N X< - 0 0 70 -3,-1.0 3,-2.0 -4,-0.7 -1,-0.3 -0.566 69.2-175.1-157.7 83.0 17.4 -6.7 3.6 21 21 A P G > S+ 0 0 69 0, 0.0 3,-2.0 0, 0.0 -3,-0.1 0.652 75.4 78.5 -57.1 -20.5 19.7 -6.8 0.6 22 22 A S G 3 S+ 0 0 69 1,-0.3 4,-0.1 -5,-0.1 -5,-0.1 0.694 84.6 67.3 -65.4 -12.4 16.9 -7.1 -1.9 23 23 A L G X S+ 0 0 8 -3,-2.0 3,-2.0 -6,-0.3 -1,-0.3 0.701 75.3 113.0 -78.3 -18.5 16.5 -3.4 -1.4 24 24 A K T < S+ 0 0 138 -3,-2.0 -10,-0.0 1,-0.3 0, 0.0 -0.307 81.1 18.2 -58.0 131.2 19.9 -2.8 -3.0 25 25 A G T 3 S+ 0 0 56 1,-0.4 -1,-0.3 3,-0.0 -2,-0.1 0.054 107.1 101.0 96.0 -24.0 19.5 -0.9 -6.3 26 26 A K S < S- 0 0 94 -3,-2.0 2,-0.4 -4,-0.1 -1,-0.4 -0.622 86.2-102.4 -93.4 150.8 16.1 0.3 -5.4 27 27 A P - 0 0 31 0, 0.0 45,-2.5 0, 0.0 2,-0.4 -0.617 42.7-166.0 -73.2 126.9 15.3 3.8 -4.1 28 28 A V E -e 72 0B 0 -2,-0.4 19,-2.4 43,-0.2 2,-0.5 -0.969 7.9-168.9-119.1 132.4 14.8 3.4 -0.3 29 29 A V E -eF 73 46B 0 43,-3.1 45,-2.6 -2,-0.4 2,-0.6 -0.978 10.2-152.3-124.3 117.3 13.2 6.1 1.8 30 30 A V E -eF 74 45B 0 15,-3.4 14,-2.0 -2,-0.5 15,-1.5 -0.807 26.0-163.5 -91.0 124.2 13.4 5.9 5.6 31 31 A C E -eF 75 43B 1 43,-4.2 45,-3.2 -2,-0.6 2,-0.6 -0.786 29.4-152.1-117.2 156.6 10.4 7.8 7.0 32 32 A V E - F 0 42B 65 10,-2.2 10,-0.8 -2,-0.3 2,-0.3 -0.920 26.6-153.1-119.1 96.3 9.1 9.3 10.2 33 33 A F E - F 0 41B 93 -2,-0.6 8,-0.3 8,-0.2 7,-0.1 -0.589 8.6-162.8 -76.3 131.3 5.3 9.2 10.1 34 34 A S - 0 0 42 6,-2.2 216,-0.3 -2,-0.3 7,-0.2 0.730 24.2-138.3 -84.8 -29.6 3.5 11.9 12.2 35 35 A G + 0 0 54 5,-0.6 6,-0.1 2,-0.3 -2,-0.1 0.204 69.0 116.9 93.2 -17.4 0.1 10.3 12.3 36 36 A R S S- 0 0 130 1,-0.0 2,-0.3 2,-0.0 -1,-0.1 0.741 93.6 -34.8 -58.0 -19.4 -2.3 13.3 11.7 37 37 A F S > S- 0 0 112 3,-0.0 3,-1.1 0, 0.0 2,-0.5 -0.939 98.4 -25.4-174.0-165.8 -3.3 11.5 8.5 38 38 A E T 3 S- 0 0 151 -2,-0.3 24,-0.1 1,-0.3 -2,-0.0 -0.539 125.3 -12.2 -70.0 116.6 -2.3 9.2 5.6 39 39 A D T 3 S+ 0 0 35 -2,-0.5 23,-0.6 1,-0.2 22,-0.3 0.588 90.9 162.3 70.0 12.7 1.5 9.6 4.9 40 40 A S < + 0 0 3 -3,-1.1 -6,-2.2 21,-0.1 -5,-0.6 -0.359 34.8 51.5 -64.2 141.3 1.8 12.7 7.2 41 41 A G E S-F 33 0B 26 -8,-0.3 20,-2.7 -7,-0.2 21,-0.4 -0.637 79.7 -72.3 125.0 177.4 5.3 13.5 8.2 42 42 A A E -FG 32 60B 44 -10,-0.8 -10,-2.2 18,-0.3 2,-0.4 -0.691 39.1-105.8-111.8 164.3 8.8 14.0 6.8 43 43 A V E -F 31 0B 5 16,-1.3 15,-3.2 13,-0.3 -12,-0.2 -0.757 19.8-162.6 -87.7 127.6 11.6 11.8 5.3 44 44 A A E - 0 0 27 -14,-2.0 2,-0.3 -2,-0.4 -13,-0.2 0.954 68.0 -30.6 -76.6 -50.6 14.5 11.1 7.6 45 45 A T E -F 30 0B 16 -15,-1.5 -15,-3.4 11,-0.1 -1,-0.3 -0.992 52.6-153.3-162.3 162.0 16.8 9.9 4.8 46 46 A A E -F 29 0B 0 -2,-0.3 -17,-0.2 -17,-0.2 11,-0.1 -0.961 26.3-110.4-137.7 153.9 16.9 8.2 1.5 47 47 A N > - 0 0 1 -19,-2.4 4,-1.8 -2,-0.3 3,-0.5 -0.278 44.9 -95.6 -76.3 173.4 19.6 6.2 -0.4 48 48 A Y H > S+ 0 0 66 1,-0.2 4,-1.5 2,-0.2 5,-0.1 0.778 121.6 63.4 -62.6 -27.6 21.2 7.7 -3.5 49 49 A E H 4 S+ 0 0 63 -23,-0.3 4,-0.3 1,-0.2 3,-0.2 0.938 110.9 40.2 -61.3 -42.5 18.8 6.0 -5.9 50 50 A A H >4>S+ 0 0 0 -3,-0.5 5,-1.3 -22,-0.2 3,-1.1 0.839 110.2 58.3 -74.1 -33.7 16.0 8.0 -4.3 51 51 A R H ><5S+ 0 0 90 -4,-1.8 3,-1.6 1,-0.2 -1,-0.2 0.746 89.6 72.3 -70.1 -22.2 18.1 11.2 -4.0 52 52 A K T 3<5S+ 0 0 152 -4,-1.5 -1,-0.2 1,-0.3 -2,-0.2 0.774 102.6 44.6 -61.9 -23.9 18.8 11.3 -7.8 53 53 A F T < 5S- 0 0 119 -3,-1.1 -1,-0.3 -4,-0.3 -2,-0.2 0.241 128.3 -92.0-106.2 12.9 15.1 12.3 -8.1 54 54 A G T < 5S+ 0 0 39 -3,-1.6 2,-0.7 1,-0.3 -3,-0.2 0.188 80.9 135.4 100.6 -17.7 14.9 14.9 -5.3 55 55 A V < + 0 0 0 -5,-1.3 -1,-0.3 9,-0.1 2,-0.3 -0.557 34.2 136.8 -69.8 110.3 13.7 12.6 -2.5 56 56 A K > - 0 0 123 -2,-0.7 3,-1.8 -3,-0.1 -13,-0.3 -0.924 56.9 -47.5-149.1 173.2 15.9 13.6 0.4 57 57 A A T 3 S+ 0 0 66 -2,-0.3 -13,-0.2 1,-0.2 -12,-0.1 -0.134 119.1 15.5 -46.9 122.7 16.0 14.3 4.2 58 58 A G T 3 S+ 0 0 48 -15,-3.2 -1,-0.2 1,-0.3 3,-0.1 -0.113 84.8 125.8 104.3 -36.7 13.2 16.6 5.1 59 59 A I S < S- 0 0 35 -3,-1.8 -16,-1.3 -17,-0.1 -1,-0.3 -0.301 72.6 -96.0 -63.4 137.7 10.8 16.5 2.2 60 60 A P B > -G 42 0B 67 0, 0.0 4,-2.1 0, 0.0 -18,-0.3 -0.177 26.2-127.1 -50.2 143.2 7.2 15.6 3.1 61 61 A I H > S+ 0 0 0 -20,-2.7 4,-2.3 -22,-0.3 5,-0.2 0.925 110.2 58.9 -57.8 -47.4 6.5 11.9 2.7 62 62 A V H > S+ 0 0 52 -23,-0.6 4,-0.7 -21,-0.4 -1,-0.2 0.883 108.7 44.7 -49.7 -44.6 3.4 12.9 0.6 63 63 A E H >> S+ 0 0 82 1,-0.2 4,-1.5 2,-0.2 3,-0.7 0.894 109.2 54.9 -71.3 -38.4 5.7 14.7 -1.8 64 64 A A H 3X S+ 0 0 0 -4,-2.1 4,-2.6 1,-0.2 -2,-0.2 0.861 106.8 52.6 -62.3 -33.2 8.3 11.9 -1.9 65 65 A K H 3< S+ 0 0 62 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.710 104.4 56.1 -75.9 -18.5 5.5 9.5 -2.9 66 66 A K H << S+ 0 0 143 -4,-0.7 -1,-0.2 -3,-0.7 -2,-0.2 0.831 114.0 39.7 -78.0 -35.0 4.5 11.8 -5.8 67 67 A I H < S+ 0 0 82 -4,-1.5 -2,-0.2 1,-0.2 -3,-0.1 0.932 135.6 17.4 -78.7 -50.9 8.0 11.6 -7.2 68 68 A L >< + 0 0 25 -4,-2.6 3,-1.8 -5,-0.2 -1,-0.2 -0.648 68.1 167.5-123.8 73.2 8.8 8.0 -6.5 69 69 A P T 3 S+ 0 0 85 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.708 81.9 45.4 -60.3 -19.8 5.4 6.2 -5.9 70 70 A N T 3 S+ 0 0 157 -3,-0.1 -5,-0.1 2,-0.1 -2,-0.0 0.294 86.0 114.8-106.4 8.6 7.0 2.8 -6.2 71 71 A A S < S- 0 0 11 -3,-1.8 2,-0.7 -7,-0.2 -43,-0.2 -0.255 79.2 -97.4 -70.1 166.9 10.0 3.5 -4.0 72 72 A V E -e 28 0B 40 -45,-2.5 -43,-3.1 -49,-0.1 2,-0.6 -0.812 38.3-164.2 -91.3 120.1 10.3 1.5 -0.8 73 73 A Y E +e 29 0B 38 -2,-0.7 -43,-0.2 -45,-0.2 -45,-0.0 -0.921 12.4 179.0-105.4 119.5 9.1 3.6 2.1 74 74 A L E -e 30 0B 39 -45,-2.6 -43,-4.2 -2,-0.6 2,-0.2 -0.922 29.5-112.0-123.2 146.8 10.1 2.3 5.5 75 75 A P E -e 31 0B 72 0, 0.0 -43,-0.2 0, 0.0 -45,-0.0 -0.550 44.0 -97.1 -78.7 140.9 9.5 3.5 9.1 76 76 A M - 0 0 60 -45,-3.2 2,-0.4 -2,-0.2 3,-0.1 -0.293 33.4-168.7 -54.8 127.2 12.5 4.8 11.0 77 77 A R > + 0 0 91 1,-0.2 4,-1.9 -3,-0.1 3,-0.4 -0.688 14.4 169.1-120.2 74.2 13.9 2.2 13.3 78 78 A K H > S+ 0 0 89 -2,-0.4 4,-2.9 1,-0.2 5,-0.2 0.902 72.0 58.9 -51.9 -49.7 16.2 4.3 15.4 79 79 A E H > S+ 0 0 119 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.871 108.2 46.1 -49.6 -46.3 16.9 1.6 18.0 80 80 A V H > S+ 0 0 36 -3,-0.4 4,-2.2 2,-0.2 -1,-0.2 0.921 113.7 47.6 -64.4 -46.3 18.2 -0.8 15.3 81 81 A Y H X S+ 0 0 0 -4,-1.9 4,-2.4 1,-0.2 -2,-0.2 0.861 109.9 54.0 -65.5 -35.2 20.4 1.9 13.7 82 82 A Q H X S+ 0 0 80 -4,-2.9 4,-2.7 2,-0.2 -1,-0.2 0.908 108.7 47.9 -66.2 -41.6 21.8 3.0 17.1 83 83 A Q H X S+ 0 0 133 -4,-1.8 4,-1.7 -5,-0.2 -2,-0.2 0.939 113.0 47.2 -65.3 -45.1 22.9 -0.6 17.9 84 84 A V H X S+ 0 0 10 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.921 113.0 52.1 -60.2 -41.4 24.6 -1.0 14.5 85 85 A S H X S+ 0 0 2 -4,-2.4 4,-2.8 1,-0.2 -2,-0.2 0.923 105.4 52.7 -59.3 -50.2 26.2 2.4 15.0 86 86 A S H X S+ 0 0 51 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.840 108.0 51.8 -56.2 -37.7 27.6 1.5 18.5 87 87 A R H X S+ 0 0 117 -4,-1.7 4,-1.7 2,-0.2 -1,-0.2 0.936 110.9 47.9 -67.4 -44.3 29.2 -1.6 17.1 88 88 A I H X S+ 0 0 0 -4,-2.1 4,-1.5 2,-0.2 -2,-0.2 0.917 110.7 50.8 -62.9 -41.3 30.8 0.4 14.3 89 89 A M H >X S+ 0 0 4 -4,-2.8 4,-1.9 1,-0.2 3,-0.9 0.963 107.6 53.5 -60.5 -48.8 32.0 3.0 16.8 90 90 A N H 3< S+ 0 0 76 -4,-2.5 4,-0.4 1,-0.3 -1,-0.2 0.835 105.3 54.1 -55.4 -32.4 33.6 0.3 19.0 91 91 A L H >< S+ 0 0 25 -4,-1.7 3,-0.8 1,-0.2 -1,-0.3 0.875 108.6 51.7 -67.6 -33.1 35.4 -0.9 16.0 92 92 A L H X< S+ 0 0 0 -4,-1.5 3,-2.5 -3,-0.9 4,-0.4 0.832 93.7 67.4 -71.8 -34.7 36.7 2.6 15.7 93 93 A R T 3< S+ 0 0 106 -4,-1.9 3,-0.5 1,-0.3 -1,-0.2 0.671 91.2 69.0 -59.9 -12.9 37.9 2.9 19.3 94 94 A E T < S+ 0 0 140 -3,-0.8 -1,-0.3 -4,-0.4 -2,-0.2 0.635 97.2 49.2 -80.2 -14.4 40.5 0.3 18.1 95 95 A Y S < S+ 0 0 19 -3,-2.5 2,-0.2 1,-0.3 -1,-0.2 0.427 128.2 0.5-103.0 -0.9 42.2 2.8 15.9 96 96 A S - 0 0 3 -3,-0.5 -1,-0.3 -4,-0.4 15,-0.1 -0.818 47.0-144.4 177.3 142.8 42.5 5.5 18.6 97 97 A E S S+ 0 0 145 -2,-0.2 2,-1.2 1,-0.2 -1,-0.1 0.776 93.6 72.8 -83.0 -29.1 41.6 6.2 22.3 98 98 A K + 0 0 64 12,-0.4 12,-2.6 2,-0.0 2,-0.4 -0.720 68.2 149.7 -90.7 91.0 40.8 9.8 21.5 99 99 A I E -C 109 0A 13 -2,-1.2 2,-0.5 10,-0.2 10,-0.2 -0.970 32.6-159.3-127.9 139.3 37.5 9.5 19.7 100 100 A E E -C 108 0A 8 8,-2.7 8,-2.8 -2,-0.4 2,-1.0 -0.960 8.3-153.4-121.2 113.4 34.6 12.0 19.6 101 101 A I E +C 107 0A 55 -2,-0.5 6,-0.2 6,-0.2 3,-0.1 -0.748 15.0 179.5 -87.2 103.5 31.2 10.6 18.6 102 102 A A E - 0 0 24 -2,-1.0 2,-0.3 4,-0.9 5,-0.2 0.674 62.9 -30.5 -80.3 -16.3 29.5 13.6 17.1 103 103 A S E > S-C 106 0A 31 3,-1.4 3,-1.0 -3,-0.1 -1,-0.2 -0.973 83.4 -62.3-179.6-177.9 26.3 11.7 16.3 104 104 A I T 3 S+ 0 0 19 -2,-0.3 -1,-0.0 1,-0.2 3,-0.0 0.764 132.6 24.5 -57.4 -27.1 24.9 8.4 15.4 105 105 A D T 3 S+ 0 0 38 -97,-0.0 -97,-2.4 -98,-0.0 2,-0.4 0.241 113.0 71.2-126.1 16.6 26.8 8.2 12.1 106 106 A E E < +AC 7 103A 32 -3,-1.0 -3,-1.4 -99,-0.2 -4,-0.9 -0.992 46.3 167.7-136.3 142.2 29.8 10.5 12.7 107 107 A A E -AC 6 101A 0 -101,-1.5 -101,-2.7 -2,-0.4 2,-0.5 -0.989 22.1-143.0-154.4 141.3 33.0 10.2 14.7 108 108 A Y E -AC 5 100A 21 -8,-2.8 -8,-2.7 -2,-0.3 2,-0.5 -0.914 12.5-161.1-108.4 129.4 36.3 12.1 14.9 109 109 A L E -AC 4 99A 0 -105,-3.1 -105,-2.8 -2,-0.5 2,-1.0 -0.939 10.5-151.9-111.5 120.9 39.6 10.2 15.6 110 110 A D E +A 3 0A 23 -12,-2.6 -12,-0.4 -2,-0.5 -107,-0.2 -0.828 25.3 170.9 -87.8 104.0 42.6 12.2 16.8 111 111 A I >> + 0 0 0 -109,-2.0 3,-2.2 -2,-1.0 4,-1.9 0.140 34.1 118.5-105.5 22.3 45.2 9.9 15.4 112 112 A S G >4 S+ 0 0 36 -110,-0.4 3,-0.8 1,-0.3 -1,-0.2 0.955 81.0 45.4 -47.7 -60.9 48.4 12.0 16.0 113 113 A D G 34 S+ 0 0 120 1,-0.2 -1,-0.3 -3,-0.2 3,-0.1 0.134 115.7 49.4 -73.1 22.1 49.9 9.3 18.2 114 114 A K G <4 S+ 0 0 109 -3,-2.2 2,-0.3 1,-0.4 -1,-0.2 0.517 114.7 31.4-131.0 -24.6 49.0 6.6 15.7 115 115 A V << - 0 0 11 -4,-1.9 -1,-0.4 -3,-0.8 3,-0.1 -0.963 53.1-157.9-137.4 155.3 50.3 8.0 12.5 116 116 A R S S+ 0 0 206 -2,-0.3 2,-0.3 1,-0.2 -1,-0.1 0.743 76.6 11.2-102.3 -32.6 53.2 10.3 11.5 117 117 A D S > S- 0 0 66 1,-0.1 4,-1.5 -115,-0.0 3,-0.2 -0.893 80.5 -98.3-140.8 171.7 52.0 11.7 8.1 118 118 A Y H > S+ 0 0 48 -2,-0.3 4,-4.5 1,-0.2 5,-0.3 0.857 118.2 61.7 -61.6 -36.1 48.9 11.8 5.9 119 119 A R H > S+ 0 0 154 1,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.937 109.8 42.0 -54.0 -48.4 50.1 8.9 3.8 120 120 A E H > S+ 0 0 35 -3,-0.2 4,-1.4 2,-0.2 -1,-0.3 0.781 115.1 51.4 -68.9 -28.2 49.9 6.8 6.9 121 121 A A H X S+ 0 0 0 -4,-1.5 4,-2.4 2,-0.2 -2,-0.2 0.945 109.7 48.8 -72.0 -49.0 46.7 8.5 7.9 122 122 A Y H X S+ 0 0 90 -4,-4.5 4,-2.1 1,-0.3 -2,-0.2 0.927 112.3 49.2 -54.7 -47.4 45.2 7.7 4.5 123 123 A N H X S+ 0 0 71 -4,-2.4 4,-1.6 -5,-0.3 -1,-0.3 0.827 108.4 51.8 -65.0 -31.4 46.3 4.1 4.8 124 124 A L H X S+ 0 0 24 -4,-1.4 4,-2.7 2,-0.2 -1,-0.2 0.867 106.3 58.6 -71.0 -32.4 44.8 3.9 8.3 125 125 A G H X S+ 0 0 0 -4,-2.4 4,-3.2 1,-0.2 -2,-0.2 0.975 103.4 48.4 -56.9 -59.4 41.7 5.2 6.7 126 126 A L H X S+ 0 0 59 -4,-2.1 4,-3.3 2,-0.2 5,-0.3 0.880 110.3 53.0 -49.3 -43.8 41.5 2.3 4.2 127 127 A E H X S+ 0 0 109 -4,-1.6 4,-3.3 2,-0.2 5,-0.3 0.990 111.6 45.3 -54.9 -61.8 42.0 -0.2 7.0 128 128 A I H X S+ 0 0 0 -4,-2.7 4,-1.9 1,-0.2 -2,-0.2 0.890 114.3 49.2 -47.3 -50.0 39.1 1.4 9.0 129 129 A K H X S+ 0 0 23 -4,-3.2 4,-2.4 1,-0.2 3,-0.2 0.960 114.1 44.3 -58.0 -52.4 36.9 1.5 5.8 130 130 A N H X S+ 0 0 84 -4,-3.3 4,-3.0 1,-0.2 5,-0.3 0.903 110.5 55.3 -59.3 -43.9 37.6 -2.2 5.0 131 131 A K H X S+ 0 0 69 -4,-3.3 4,-2.5 -5,-0.3 5,-0.3 0.876 111.5 44.1 -57.2 -39.4 37.2 -3.3 8.5 132 132 A I H X>S+ 0 0 0 -4,-1.9 4,-2.5 -5,-0.3 6,-1.0 0.888 114.0 48.9 -75.3 -38.6 33.7 -1.7 8.7 133 133 A L H X5S+ 0 0 74 -4,-2.4 4,-0.9 4,-0.2 -2,-0.2 0.912 118.0 41.5 -65.4 -42.3 32.7 -3.1 5.2 134 134 A E H <5S+ 0 0 129 -4,-3.0 -2,-0.2 -5,-0.2 -3,-0.2 0.940 122.4 37.9 -69.8 -51.4 33.8 -6.5 6.2 135 135 A K H <5S+ 0 0 125 -4,-2.5 -3,-0.2 -5,-0.3 -2,-0.2 0.897 139.2 9.8 -70.1 -43.5 32.5 -6.6 9.7 136 136 A E H <5S- 0 0 33 -4,-2.5 -3,-0.2 -5,-0.3 -2,-0.2 0.524 88.1-125.0-118.0 -8.4 29.2 -4.7 9.2 137 137 A K << + 0 0 127 -4,-0.9 2,-0.5 -5,-0.8 -4,-0.2 0.848 66.6 134.4 64.8 33.7 28.8 -4.4 5.4 138 138 A I - 0 0 2 -6,-1.0 2,-0.4 -9,-0.1 -1,-0.2 -0.958 48.8-143.8-116.3 128.2 28.4 -0.6 5.8 139 139 A T + 0 0 27 -2,-0.5 -130,-1.7 -130,-0.1 2,-0.3 -0.768 24.2 179.4 -91.5 140.8 30.3 1.8 3.5 140 140 A V E -B 8 0A 2 -2,-0.4 2,-0.4 -132,-0.2 -132,-0.2 -0.894 24.5-124.6-134.3 164.1 31.5 5.0 5.1 141 141 A T E -B 7 0A 0 -134,-2.4 -134,-2.8 -2,-0.3 2,-0.4 -0.943 20.5-150.5-114.9 133.0 33.5 8.1 4.0 142 142 A V E -Bd 6 163A 0 20,-1.9 22,-2.0 -2,-0.4 2,-0.4 -0.850 8.0-168.2-106.4 136.2 36.7 9.2 5.7 143 143 A G E -Bd 5 164A 0 -138,-2.6 -138,-3.9 -2,-0.4 2,-0.4 -0.983 7.8-171.9-121.8 132.9 37.9 12.8 5.9 144 144 A I E +Bd 4 165A 0 20,-2.4 22,-1.9 -2,-0.4 2,-0.3 -0.991 24.1 112.3-130.9 132.3 41.4 13.5 7.0 145 145 A S E S-B 3 0A 0 -142,-2.0 -142,-3.2 -2,-0.4 22,-0.1 -0.923 71.7 -65.4-169.6-164.5 43.0 16.9 7.8 146 146 A K S S+ 0 0 46 20,-0.5 2,-0.3 -2,-0.3 -142,-0.1 0.680 106.7 11.3 -78.7 -20.6 44.5 19.2 10.5 147 147 A N S > S- 0 0 5 -144,-0.1 4,-2.1 1,-0.1 5,-0.2 -0.946 83.3 -93.2-150.0 171.6 41.4 19.8 12.5 148 148 A K H > S+ 0 0 10 87,-0.3 4,-1.6 -2,-0.3 5,-0.1 0.855 117.9 52.3 -54.8 -42.2 37.8 18.6 13.0 149 149 A V H > S+ 0 0 4 2,-0.2 4,-2.6 1,-0.2 3,-0.4 0.967 114.0 39.2 -63.5 -55.7 36.2 21.1 10.7 150 150 A F H > S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.799 111.7 58.6 -69.7 -22.9 38.4 20.4 7.6 151 151 A A H X S+ 0 0 0 -4,-2.1 4,-1.5 2,-0.2 -1,-0.2 0.878 110.1 44.5 -71.0 -31.7 38.3 16.7 8.4 152 152 A K H X S+ 0 0 33 -4,-1.6 4,-2.9 -3,-0.4 -2,-0.2 0.926 112.2 50.7 -73.9 -44.7 34.5 17.0 8.1 153 153 A I H X S+ 0 0 4 -4,-2.6 4,-1.6 1,-0.2 -2,-0.2 0.863 106.4 56.6 -60.3 -35.2 34.8 19.1 4.9 154 154 A A H X S+ 0 0 0 -4,-2.2 4,-1.3 -5,-0.2 3,-0.2 0.956 110.2 44.3 -61.7 -45.8 37.1 16.4 3.5 155 155 A A H X S+ 0 0 0 -4,-1.5 4,-1.8 1,-0.2 3,-0.4 0.920 108.5 57.4 -63.2 -44.1 34.3 13.8 4.1 156 156 A D H < S+ 0 0 66 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.828 109.7 45.5 -55.6 -35.0 31.6 16.1 2.6 157 157 A M H < S+ 0 0 85 -4,-1.6 -1,-0.2 -3,-0.2 -2,-0.2 0.759 117.6 42.9 -81.2 -25.7 33.6 16.3 -0.6 158 158 A A H < S+ 0 0 20 -4,-1.3 -2,-0.2 -3,-0.4 -1,-0.2 0.561 88.2 148.0 -99.9 -7.9 34.3 12.6 -0.8 159 159 A K < + 0 0 72 -4,-1.8 2,-0.1 2,-0.1 4,-0.0 -0.467 38.4 53.6 -77.4 149.1 31.0 11.1 0.1 160 160 A P S S- 0 0 58 0, 0.0 3,-0.1 0, 0.0 -20,-0.1 0.524 132.5 -23.9 -87.1 167.9 29.6 8.6 -0.7 161 161 A N S S+ 0 0 97 1,-0.1 -20,-0.2 -22,-0.1 2,-0.2 0.807 107.3 131.7 39.9 44.2 32.0 5.7 -0.1 162 162 A G - 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0 0 14 -3,-2.5 -1,-0.2 -6,-0.2 2,-0.2 -0.832 50.4-176.9 -93.2 117.6 26.8 27.2 9.3 187 187 A G >> - 0 0 36 -2,-0.7 4,-3.8 -3,-0.1 3,-0.7 -0.505 42.8 -80.3-107.4 179.5 23.2 26.6 8.3 188 188 A N H 3> S+ 0 0 136 1,-0.3 4,-2.3 2,-0.2 5,-0.2 0.859 126.3 49.2 -45.1 -49.5 20.7 28.2 5.9 189 189 A I H 3> S+ 0 0 116 1,-0.2 4,-1.0 2,-0.2 -1,-0.3 0.840 118.5 38.2 -65.9 -33.3 19.8 31.1 8.3 190 190 A T H <> S+ 0 0 18 -3,-0.7 4,-1.8 2,-0.2 -2,-0.2 0.852 112.5 59.0 -83.5 -35.0 23.4 32.0 9.0 191 191 A A H X S+ 0 0 17 -4,-3.8 4,-1.2 1,-0.2 -2,-0.2 0.925 107.3 46.1 -56.6 -47.5 24.5 31.3 5.4 192 192 A E H X S+ 0 0 129 -4,-2.3 4,-1.2 1,-0.2 3,-0.3 0.888 110.4 52.0 -64.8 -41.5 22.1 33.9 4.0 193 193 A K H < S+ 0 0 81 -4,-1.0 -1,-0.2 1,-0.2 -2,-0.2 0.829 107.2 54.2 -65.6 -30.2 23.0 36.6 6.6 194 194 A L H ><>S+ 0 0 0 -4,-1.8 5,-2.4 1,-0.2 3,-1.1 0.789 103.7 54.9 -72.6 -28.5 26.7 36.0 5.6 195 195 A K H ><5S+ 0 0 158 -4,-1.2 3,-1.2 -3,-0.3 -1,-0.2 0.822 100.8 61.3 -71.4 -29.7 25.8 36.7 2.0 196 196 A K T 3<5S+ 0 0 157 -4,-1.2 -1,-0.2 1,-0.3 -2,-0.2 0.348 103.8 49.2 -78.3 4.9 24.3 40.0 3.2 197 197 A L T < 5S- 0 0 31 -3,-1.1 -1,-0.3 2,-0.2 -2,-0.2 0.278 121.7-102.6-123.3 4.2 27.7 41.1 4.5 198 198 A G T < 5S+ 0 0 46 -3,-1.2 2,-0.6 1,-0.3 3,-0.2 0.675 78.4 139.8 80.8 16.5 29.6 40.3 1.3 199 199 A I < + 0 0 3 -5,-2.4 -1,-0.3 1,-0.2 -2,-0.2 -0.862 3.7 138.1 -99.9 115.2 30.9 37.1 2.9 200 200 A N + 0 0 74 -2,-0.6 -20,-3.0 1,-0.2 2,-0.3 0.468 68.8 43.7-126.0 -20.3 31.0 34.1 0.6 201 201 A K B > S-H 179 0C 62 -22,-0.2 3,-0.9 -3,-0.2 4,-0.3 -0.901 85.5-113.8-128.0 156.9 34.4 32.7 1.6 202 202 A L G > S+ 0 0 0 -24,-0.6 3,-1.8 -28,-0.4 4,-0.3 0.902 114.0 61.7 -55.3 -43.6 36.1 32.2 4.9 203 203 A V G > S+ 0 0 57 -28,-2.2 3,-1.8 1,-0.3 4,-0.3 0.811 89.1 71.5 -54.0 -33.1 38.7 34.8 4.1 204 204 A D G X> S+ 0 0 47 -3,-0.9 4,-1.0 1,-0.3 3,-0.8 0.677 83.9 68.1 -59.9 -19.7 36.0 37.5 3.8 205 205 A T G <4 S+ 0 0 2 -3,-1.8 -1,-0.3 -4,-0.3 -2,-0.2 0.616 88.5 66.5 -76.4 -12.9 35.4 37.6 7.6 206 206 A L G <4 S+ 0 0 82 -3,-1.8 -1,-0.2 -4,-0.3 -2,-0.2 0.643 103.2 44.1 -82.5 -14.2 38.9 39.1 8.2 207 207 A S T <4 S+ 0 0 104 -3,-0.8 -2,-0.2 -4,-0.3 -1,-0.2 0.781 95.8 85.8 -98.7 -33.4 38.0 42.3 6.5 208 208 A I S < S- 0 0 29 -4,-1.0 2,-0.5 1,-0.1 3,-0.1 -0.089 93.0 -91.9 -62.4 167.1 34.6 43.0 7.9 209 209 A E >> - 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