==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-DEC-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/DNA 05-MAR-09 3GIL . COMPND 2 MOLECULE: DNA POLYMERASE IV; . SOURCE 2 ORGANISM_SCIENTIFIC: SULFOLOBUS SOLFATARICUS P2; . AUTHOR O.RECHKOBLIT,L.MALININA,D.J.PATEL . 682 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 37336.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 492 72.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 19 2.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 121 17.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 35 5.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 68 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 228 33.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 0.9 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 4 1 3 3 3 0 0 0 0 1 1 3 3 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 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 PARALLEL BRIDGES PER LADDER . 4 0 0 2 3 3 2 2 2 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 4 2 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 G 0 0 83 0, 0.0 2,-0.4 0, 0.0 109,-0.0 0.000 360.0 360.0 360.0 120.7 14.4 26.0 9.4 2 2 A I - 0 0 17 113,-0.1 109,-2.0 2,-0.0 110,-0.5 -0.995 360.0-165.2-131.3 134.5 11.9 24.5 6.9 3 3 A V E -AB 110 145A 9 142,-3.1 142,-2.0 -2,-0.4 2,-0.5 -0.973 4.4-158.9-124.7 130.9 12.0 21.0 5.3 4 4 A L E -AB 109 144A 0 105,-3.5 105,-3.1 -2,-0.4 2,-0.5 -0.953 10.4-166.1-115.4 119.5 10.0 19.9 2.3 5 5 A F E -AB 108 143A 0 138,-3.3 138,-2.9 -2,-0.5 2,-0.4 -0.908 2.9-167.7-113.9 128.4 9.4 16.2 1.9 6 6 A V E +AB 107 142A 0 101,-2.5 101,-2.0 -2,-0.5 2,-0.4 -0.961 7.2 177.4-118.6 131.3 8.1 14.6 -1.3 7 7 A D E -AB 106 141A 9 134,-2.1 134,-1.9 -2,-0.4 99,-0.2 -0.934 28.2-126.9-138.9 111.0 6.9 11.0 -1.4 8 8 A F E > - B 0 140A 1 97,-2.5 3,-0.5 -2,-0.4 2,-0.3 -0.139 28.6-106.0 -63.5 149.1 5.5 9.7 -4.7 9 9 A D T 3 S- 0 0 4 130,-2.3 5,-0.3 1,-0.2 130,-0.2 -0.603 83.0 -31.2 -82.8 132.5 2.0 8.0 -4.8 10 10 A Y T 3> S- 0 0 36 -2,-0.3 4,-2.8 3,-0.1 3,-0.3 0.779 85.6-168.0 29.1 51.5 1.7 4.2 -5.2 11 11 A F H <> + 0 0 8 -3,-0.5 4,-2.7 1,-0.2 5,-0.2 0.729 67.9 40.8 -48.9 -59.8 4.9 4.6 -7.1 12 12 A Y H > S+ 0 0 34 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.949 120.9 45.1 -58.2 -48.8 5.6 1.2 -8.9 13 13 A A H > S+ 0 0 0 -3,-0.3 4,-2.2 1,-0.2 -1,-0.2 0.894 112.2 52.2 -58.0 -43.8 1.9 0.8 -9.8 14 14 A Q H X S+ 0 0 6 -4,-2.8 4,-2.1 -5,-0.3 -1,-0.2 0.900 105.7 54.0 -63.0 -39.9 1.6 4.5 -10.9 15 15 A V H X S+ 0 0 2 -4,-2.7 4,-3.0 1,-0.2 3,-0.3 0.958 109.3 48.9 -57.2 -48.5 4.6 4.1 -13.2 16 16 A E H X S+ 0 0 10 -4,-2.0 4,-1.3 1,-0.3 -1,-0.2 0.875 108.7 53.2 -58.7 -40.7 3.0 1.2 -14.9 17 17 A E H < S+ 0 0 6 -4,-2.2 7,-0.3 2,-0.2 -1,-0.3 0.836 111.9 45.9 -61.4 -35.0 -0.3 3.2 -15.2 18 18 A V H < S+ 0 0 49 -4,-2.1 -2,-0.2 -3,-0.3 -1,-0.2 0.895 113.3 48.0 -73.7 -41.2 1.7 5.9 -17.0 19 19 A L H < S+ 0 0 89 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.698 130.6 23.5 -67.8 -19.0 3.5 3.4 -19.2 20 20 A N >< - 0 0 66 -4,-1.3 3,-2.7 -5,-0.2 4,-0.4 -0.552 68.2-175.7-148.7 73.2 0.0 1.9 -19.9 21 21 A P G > S+ 0 0 95 0, 0.0 3,-0.7 0, 0.0 -4,-0.1 0.637 78.3 74.4 -53.1 -18.5 -2.8 4.4 -19.4 22 22 A S G 3 S+ 0 0 83 1,-0.2 -5,-0.1 -4,-0.0 -4,-0.1 0.850 89.8 61.4 -60.2 -32.9 -5.5 1.7 -20.1 23 23 A L G X S+ 0 0 9 -3,-2.7 3,-1.1 -7,-0.2 -1,-0.2 0.833 80.0 112.7 -57.2 -34.0 -4.6 0.3 -16.7 24 24 A K T < S+ 0 0 133 -3,-0.7 -10,-0.0 -4,-0.4 -6,-0.0 -0.065 76.2 23.0 -48.5 137.2 -5.8 3.6 -15.1 25 25 A G T 3 S+ 0 0 54 1,-0.2 -1,-0.2 3,-0.0 -2,-0.1 0.591 107.4 90.0 81.6 14.2 -8.9 3.3 -13.0 26 26 A K S < S- 0 0 96 -3,-1.1 -1,-0.2 46,-0.0 24,-0.2 -0.944 88.3 -78.8-137.1 160.3 -8.6 -0.4 -12.2 27 27 A P - 0 0 35 0, 0.0 45,-1.9 0, 0.0 2,-0.4 -0.365 49.4-178.0 -58.4 130.1 -6.9 -2.6 -9.6 28 28 A V E -e 72 0B 0 43,-0.2 19,-2.4 19,-0.1 2,-0.4 -0.998 8.6-174.8-136.0 132.3 -3.2 -2.9 -10.2 29 29 A V E -eF 73 46B 0 43,-2.4 45,-2.0 -2,-0.4 2,-0.4 -0.982 12.6-152.6-133.3 116.9 -0.8 -5.0 -8.1 30 30 A V E -eF 74 45B 0 15,-1.9 14,-2.9 -2,-0.4 15,-1.2 -0.790 24.9-160.7 -94.9 130.4 3.0 -5.0 -8.7 31 31 A C E -eF 75 43B 1 43,-2.6 45,-2.0 -2,-0.4 2,-0.8 -0.859 28.4-146.6-125.8 144.0 4.6 -8.3 -7.6 32 32 A V E - F 0 42B 64 10,-2.8 10,-1.2 -2,-0.3 2,-0.4 -0.892 27.7-157.2-106.5 99.6 7.9 -9.8 -6.7 33 33 A F E - F 0 41B 85 -2,-0.8 8,-0.3 8,-0.2 5,-0.1 -0.674 6.6-158.3 -82.9 127.7 7.7 -13.4 -8.0 34 34 A S - 0 0 35 6,-2.8 216,-0.3 -2,-0.4 7,-0.2 0.635 26.4-129.9 -83.8 -17.0 10.1 -15.7 -6.2 35 35 A G S S+ 0 0 46 5,-0.5 3,-0.1 2,-0.3 6,-0.1 0.370 77.5 112.9 85.9 -1.6 10.3 -18.4 -8.9 36 36 A R S S- 0 0 53 1,-0.2 2,-0.3 4,-0.1 5,-0.0 0.874 88.6 -26.7 -79.0 -43.1 9.6 -21.1 -6.3 37 37 A F S > S- 0 0 125 3,-0.0 3,-2.1 0, 0.0 -2,-0.3 -0.911 97.4 -48.1-153.5 179.0 6.1 -22.2 -7.6 38 38 A E T 3 S- 0 0 168 -2,-0.3 -2,-0.0 1,-0.3 0, 0.0 -0.359 127.2 -3.3 -57.6 118.1 3.3 -20.6 -9.5 39 39 A D T 3 S+ 0 0 46 1,-0.2 23,-0.4 -2,-0.2 2,-0.3 0.671 90.6 156.2 69.6 22.0 2.6 -17.1 -7.8 40 40 A S < + 0 0 4 -3,-2.1 -6,-2.8 21,-0.1 -5,-0.5 -0.588 37.7 50.9 -74.8 137.6 5.1 -17.6 -5.0 41 41 A G E S-F 33 0B 31 -2,-0.3 20,-1.7 -8,-0.3 21,-0.4 -0.872 79.3 -77.9 134.2-166.2 6.4 -14.3 -3.6 42 42 A A E -FG 32 60B 37 -10,-1.2 -10,-2.8 -2,-0.3 2,-0.3 -0.848 38.6 -96.1-133.2 169.4 5.0 -11.0 -2.2 43 43 A V E -F 31 0B 6 16,-2.4 15,-2.6 13,-0.3 -12,-0.3 -0.675 18.4-162.6 -88.2 136.3 3.5 -7.8 -3.4 44 44 A A E S- 0 0 31 -14,-2.9 2,-0.3 1,-0.4 -13,-0.2 0.895 70.7 -41.7 -82.0 -46.2 5.7 -4.7 -3.8 45 45 A T E -F 30 0B 19 -15,-1.2 -15,-1.9 12,-0.1 -1,-0.4 -0.950 53.5-149.4-164.5 177.7 2.8 -2.3 -3.8 46 46 A A E -F 29 0B 0 -2,-0.3 -17,-0.2 -17,-0.2 11,-0.2 -0.976 28.0-101.0-154.3 156.4 -0.7 -1.9 -5.3 47 47 A N >> - 0 0 0 -19,-2.4 4,-2.1 -2,-0.3 3,-0.7 -0.268 41.5 -98.1 -83.1 171.4 -2.8 1.0 -6.4 48 48 A Y H 3> S+ 0 0 68 1,-0.3 4,-1.8 2,-0.2 -1,-0.1 0.856 122.9 58.6 -63.4 -32.0 -5.6 2.6 -4.3 49 49 A E H 34 S+ 0 0 62 1,-0.2 4,-0.4 -23,-0.2 -1,-0.3 0.915 110.0 44.5 -60.2 -42.2 -8.3 0.6 -6.1 50 50 A A H X4>S+ 0 0 0 -3,-0.7 3,-1.5 -22,-0.2 5,-1.5 0.856 107.0 59.7 -70.0 -35.2 -6.6 -2.6 -5.1 51 51 A R H ><5S+ 0 0 80 -4,-2.1 3,-1.9 1,-0.3 -2,-0.2 0.831 90.1 69.3 -66.7 -28.3 -6.1 -1.4 -1.5 52 52 A K T 3<5S+ 0 0 167 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.821 102.8 48.4 -54.3 -27.5 -9.8 -1.0 -1.1 53 53 A F T < 5S- 0 0 119 -3,-1.5 -1,-0.3 -4,-0.4 -2,-0.2 0.332 125.7 -97.5-102.4 9.3 -9.8 -4.8 -1.2 54 54 A G T < 5S+ 0 0 38 -3,-1.9 2,-0.6 1,-0.3 -3,-0.2 0.424 79.4 135.0 95.0 -0.2 -7.0 -5.5 1.3 55 55 A V < + 0 0 0 -5,-1.5 -1,-0.3 -8,-0.1 2,-0.3 -0.734 28.5 143.5 -85.7 120.6 -4.2 -5.9 -1.2 56 56 A K > - 0 0 119 -2,-0.6 3,-1.8 -3,-0.1 -13,-0.3 -0.969 53.9 -58.1-153.8 166.1 -1.1 -4.0 -0.1 57 57 A A T 3 S+ 0 0 56 -2,-0.3 -13,-0.2 1,-0.2 -12,-0.1 -0.131 115.4 22.6 -47.3 129.9 2.7 -4.0 0.0 58 58 A G T 3 S+ 0 0 58 -15,-2.6 -1,-0.2 1,-0.3 3,-0.1 -0.079 87.8 115.2 111.0 -35.0 4.0 -7.0 1.8 59 59 A I S < S- 0 0 22 -3,-1.8 -16,-2.4 1,-0.1 -1,-0.3 -0.213 74.3 -90.0 -70.0 160.4 1.3 -9.6 1.6 60 60 A P B >> -G 42 0B 43 0, 0.0 4,-2.3 0, 0.0 3,-0.8 -0.484 26.3-126.6 -70.0 140.0 1.7 -12.8 -0.3 61 61 A I H 3> S+ 0 0 0 -20,-1.7 4,-2.6 1,-0.3 5,-0.2 0.856 113.1 55.1 -51.4 -37.9 0.8 -12.9 -4.0 62 62 A V H 3> S+ 0 0 76 -21,-0.4 4,-1.5 -23,-0.4 -1,-0.3 0.850 106.3 50.6 -69.5 -31.5 -1.5 -16.0 -3.2 63 63 A E H <> S+ 0 0 107 -3,-0.8 4,-1.9 2,-0.2 -2,-0.2 0.907 111.5 49.9 -65.8 -41.6 -3.3 -13.9 -0.5 64 64 A A H X S+ 0 0 0 -4,-2.3 4,-2.9 1,-0.2 -2,-0.2 0.967 111.3 45.7 -58.9 -54.6 -3.8 -11.1 -3.1 65 65 A K H < S+ 0 0 58 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.819 109.2 58.2 -64.3 -29.9 -5.2 -13.4 -5.8 66 66 A K H < S+ 0 0 174 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.942 118.9 28.4 -61.6 -49.1 -7.4 -15.1 -3.2 67 67 A I H < S+ 0 0 79 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.690 136.4 28.1 -88.9 -19.4 -9.2 -11.8 -2.3 68 68 A L >< + 0 0 16 -4,-2.9 3,-0.9 -5,-0.2 -1,-0.2 -0.556 66.7 160.7-142.3 72.8 -8.7 -9.9 -5.6 69 69 A P T 3 S+ 0 0 85 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.861 72.6 51.0 -60.2 -42.5 -8.6 -12.5 -8.5 70 70 A N T 3 S+ 0 0 161 2,-0.1 -5,-0.1 -5,-0.0 3,-0.0 0.308 81.8 111.9 -90.0 6.9 -9.4 -10.2 -11.4 71 71 A A S < S- 0 0 12 -3,-0.9 2,-0.6 1,-0.1 -43,-0.2 -0.286 78.7-100.2 -69.5 163.8 -6.9 -7.4 -10.7 72 72 A V E -e 28 0B 40 -45,-1.9 -43,-2.4 -49,-0.1 2,-0.6 -0.787 37.5-160.1 -84.8 122.0 -4.0 -6.9 -13.2 73 73 A Y E +e 29 0B 34 -2,-0.6 -43,-0.2 -45,-0.2 -45,-0.0 -0.928 13.2 178.3-109.8 118.0 -0.9 -8.5 -11.7 74 74 A L E -e 30 0B 36 -45,-2.0 -43,-2.6 -2,-0.6 2,-0.2 -0.850 27.9-114.2-115.2 148.8 2.4 -7.2 -13.2 75 75 A P E -e 31 0B 71 0, 0.0 2,-0.4 0, 0.0 -43,-0.2 -0.507 38.5 -98.5 -81.4 159.0 6.0 -8.2 -12.2 76 76 A M - 0 0 63 -45,-2.0 2,-0.5 -2,-0.2 3,-0.1 -0.616 31.9-175.7 -82.8 126.3 8.3 -5.7 -10.6 77 77 A R > + 0 0 95 -2,-0.4 4,-1.8 1,-0.1 3,-0.2 -0.841 6.2 177.1-116.5 89.4 10.8 -4.0 -12.9 78 78 A K H > S+ 0 0 89 -2,-0.5 4,-3.3 1,-0.2 5,-0.2 0.886 77.0 56.9 -66.1 -37.6 12.9 -2.0 -10.4 79 79 A E H > S+ 0 0 127 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.893 105.5 50.3 -61.4 -43.8 15.2 -0.6 -13.0 80 80 A V H > S+ 0 0 31 2,-0.2 4,-1.4 1,-0.2 3,-0.2 0.942 114.8 44.0 -59.4 -45.1 12.4 0.9 -15.0 81 81 A Y H X S+ 0 0 0 -4,-1.8 4,-2.7 1,-0.2 -2,-0.2 0.874 109.8 57.0 -69.6 -37.0 11.0 2.6 -11.8 82 82 A Q H X S+ 0 0 70 -4,-3.3 4,-2.2 1,-0.2 -1,-0.2 0.805 102.8 54.9 -62.2 -32.8 14.5 3.6 -10.8 83 83 A Q H X S+ 0 0 120 -4,-1.7 4,-1.6 -3,-0.2 -1,-0.2 0.928 110.7 44.4 -67.9 -42.8 14.9 5.5 -14.1 84 84 A V H X S+ 0 0 12 -4,-1.4 4,-2.2 1,-0.2 -2,-0.2 0.940 111.8 54.3 -66.6 -43.6 11.8 7.5 -13.5 85 85 A S H X S+ 0 0 3 -4,-2.7 4,-3.3 1,-0.2 -2,-0.2 0.914 106.9 49.9 -55.0 -46.7 12.8 8.1 -9.9 86 86 A S H X S+ 0 0 57 -4,-2.2 4,-1.7 1,-0.2 -1,-0.2 0.852 109.4 51.8 -63.9 -35.7 16.2 9.6 -10.9 87 87 A R H X S+ 0 0 121 -4,-1.6 4,-1.2 2,-0.2 -1,-0.2 0.879 112.9 45.1 -66.6 -38.1 14.5 11.9 -13.4 88 88 A I H >X S+ 0 0 0 -4,-2.2 4,-2.7 2,-0.2 3,-0.5 0.947 107.5 58.1 -70.3 -47.5 12.2 13.1 -10.7 89 89 A M H 3X S+ 0 0 5 -4,-3.3 4,-2.1 1,-0.2 -2,-0.2 0.863 105.8 50.6 -47.9 -39.6 15.0 13.5 -8.2 90 90 A N H 3X S+ 0 0 90 -4,-1.7 4,-0.7 2,-0.2 -1,-0.2 0.843 106.4 53.5 -72.8 -32.6 16.7 15.9 -10.6 91 91 A L H X< S+ 0 0 38 -4,-1.2 3,-1.4 -3,-0.5 4,-0.3 0.945 109.0 49.9 -59.0 -47.2 13.6 18.0 -11.0 92 92 A L H >X S+ 0 0 1 -4,-2.7 3,-2.2 1,-0.3 4,-1.4 0.923 103.3 62.2 -57.4 -40.9 13.6 18.2 -7.2 93 93 A R H 3< S+ 0 0 112 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.717 93.6 61.7 -55.8 -25.4 17.2 19.2 -7.4 94 94 A E T << S+ 0 0 171 -3,-1.4 -1,-0.3 -4,-0.7 -2,-0.2 0.486 105.9 46.6 -86.7 -2.0 16.3 22.4 -9.4 95 95 A Y T <4 S+ 0 0 36 -3,-2.2 2,-0.3 1,-0.3 -2,-0.2 0.654 131.3 4.3-101.7 -29.8 14.3 23.7 -6.5 96 96 A S < - 0 0 2 -4,-1.4 -1,-0.3 1,-0.1 15,-0.1 -0.905 46.8-160.2-155.4 136.0 16.9 22.9 -3.9 97 97 A E S S+ 0 0 136 -2,-0.3 2,-1.4 1,-0.1 -1,-0.1 0.746 84.2 83.4 -77.0 -25.8 20.5 21.6 -4.0 98 98 A K S S+ 0 0 84 12,-0.3 12,-2.2 2,-0.0 2,-0.4 -0.646 70.0 153.0 -83.5 90.6 20.2 20.7 -0.3 99 99 A I E -C 109 0A 9 -2,-1.4 2,-0.5 10,-0.2 10,-0.2 -0.962 37.2-161.1-133.9 138.0 18.5 17.3 -0.9 100 100 A E E -C 108 0A 28 8,-3.4 8,-2.8 -2,-0.4 2,-0.7 -0.937 9.9-157.4-122.2 111.9 18.2 13.9 0.9 101 101 A I E +C 107 0A 46 -2,-0.5 6,-0.3 6,-0.3 139,-0.2 -0.782 17.4 172.6 -89.1 114.5 17.1 10.9 -1.1 102 102 A A E - 0 0 29 4,-1.5 2,-0.3 -2,-0.7 5,-0.2 0.694 59.5 -7.1-101.0 -26.9 15.7 8.4 1.4 103 103 A S E > S-C 106 0A 31 3,-1.3 3,-0.8 0, 0.0 -1,-0.2 -0.936 86.3 -78.6-155.2 176.9 14.2 5.7 -0.8 104 104 A I T 3 S+ 0 0 27 -2,-0.3 3,-0.0 1,-0.2 -3,-0.0 0.742 130.5 29.6 -55.7 -21.9 13.4 4.9 -4.4 105 105 A D T 3 S+ 0 0 26 -97,-0.1 -97,-2.5 1,-0.0 2,-0.3 0.349 111.1 60.8-125.9 9.4 10.4 7.2 -4.1 106 106 A E E < +AC 7 103A 25 -3,-0.8 -4,-1.5 -99,-0.2 -3,-1.3 -0.969 45.7 174.6-140.8 157.3 11.0 9.9 -1.5 107 107 A A E -AC 6 101A 0 -101,-2.0 -101,-2.5 -2,-0.3 2,-0.5 -0.985 22.0-134.9-158.8 146.5 13.3 12.8 -0.8 108 108 A Y E -AC 5 100A 24 -8,-2.8 -8,-3.4 -2,-0.3 2,-0.5 -0.923 18.2-165.4-108.7 131.2 13.8 15.7 1.8 109 109 A L E -AC 4 99A 0 -105,-3.1 -105,-3.5 -2,-0.5 2,-0.7 -0.951 15.4-144.8-115.3 131.4 14.6 19.2 0.7 110 110 A D E +A 3 0A 36 -12,-2.2 -12,-0.3 -2,-0.5 -107,-0.2 -0.865 25.2 172.3 -88.4 120.1 15.8 21.9 3.0 111 111 A I >> + 0 0 0 -109,-2.0 4,-2.1 -2,-0.7 3,-1.5 0.108 35.9 118.5-121.2 24.7 14.2 25.0 1.6 112 112 A S T 34 S+ 0 0 39 -110,-0.5 -1,-0.1 1,-0.3 -109,-0.1 0.645 81.3 45.6 -65.8 -21.2 15.1 27.6 4.2 113 113 A D T 34 S+ 0 0 151 -3,-0.2 -1,-0.3 -111,-0.1 3,-0.1 0.278 113.8 48.9-105.7 6.5 17.0 29.7 1.7 114 114 A K T <4 S+ 0 0 100 -3,-1.5 2,-0.3 1,-0.2 -2,-0.2 0.677 113.5 39.6-108.8 -36.3 14.4 29.5 -1.0 115 115 A V < - 0 0 13 -4,-2.1 -1,-0.2 1,-0.1 3,-0.1 -0.866 59.8-149.8-118.6 152.7 11.2 30.5 1.0 116 116 A R S S- 0 0 212 -2,-0.3 2,-0.3 1,-0.1 -1,-0.1 0.748 77.0 -14.1 -84.0 -32.1 10.6 33.0 3.8 117 117 A D S > S- 0 0 63 -115,-0.0 4,-1.9 1,-0.0 -1,-0.1 -0.915 83.2 -72.2-162.0-177.7 7.8 31.1 5.6 118 118 A Y H > S+ 0 0 46 -2,-0.3 4,-2.5 1,-0.2 5,-0.1 0.721 121.8 57.5 -66.8 -23.3 5.3 28.2 5.5 119 119 A R H > S+ 0 0 154 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.948 109.4 42.6 -70.3 -51.2 3.0 30.0 3.1 120 120 A E H > S+ 0 0 68 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.828 113.3 56.6 -65.0 -30.7 5.8 30.3 0.4 121 121 A A H X S+ 0 0 0 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.960 106.7 47.4 -62.1 -53.3 6.7 26.7 1.3 122 122 A Y H X S+ 0 0 89 -4,-2.5 4,-1.4 1,-0.2 -2,-0.2 0.877 111.0 51.8 -53.8 -42.9 3.2 25.5 0.6 123 123 A N H X S+ 0 0 72 -4,-2.3 4,-1.8 2,-0.2 -1,-0.2 0.886 109.5 49.7 -66.4 -35.7 3.3 27.5 -2.7 124 124 A L H X S+ 0 0 24 -4,-2.0 4,-3.3 1,-0.2 -2,-0.2 0.916 107.1 55.7 -63.7 -43.7 6.6 25.8 -3.6 125 125 A G H X S+ 0 0 0 -4,-2.6 4,-1.6 1,-0.2 -1,-0.2 0.793 108.4 47.1 -60.2 -29.7 5.1 22.5 -2.8 126 126 A L H X S+ 0 0 66 -4,-1.4 4,-2.1 2,-0.2 -1,-0.2 0.795 111.3 51.6 -78.5 -36.3 2.3 23.1 -5.3 127 127 A E H X S+ 0 0 105 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.919 110.8 48.4 -59.5 -48.9 4.8 24.2 -7.8 128 128 A I H X S+ 0 0 0 -4,-3.3 4,-2.1 2,-0.2 5,-0.2 0.918 110.5 50.9 -62.1 -44.2 6.8 21.0 -7.3 129 129 A K H X S+ 0 0 23 -4,-1.6 4,-2.0 -5,-0.2 -1,-0.2 0.945 111.4 48.7 -57.2 -47.5 3.6 18.9 -7.6 130 130 A N H X S+ 0 0 96 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.896 109.8 51.3 -59.0 -44.1 2.7 20.6 -10.9 131 131 A K H X S+ 0 0 69 -4,-2.2 4,-2.8 1,-0.2 5,-0.3 0.906 110.5 46.8 -65.0 -44.1 6.2 20.1 -12.3 132 132 A I H X>S+ 0 0 1 -4,-2.1 4,-2.3 1,-0.2 6,-1.1 0.874 112.5 51.8 -65.8 -35.9 6.4 16.4 -11.7 133 133 A L H X5S+ 0 0 83 -4,-2.0 4,-0.6 4,-0.2 -2,-0.2 0.870 114.5 42.1 -68.2 -38.1 2.9 16.0 -13.1 134 134 A E H <5S+ 0 0 132 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.915 121.9 38.6 -71.6 -43.5 3.8 17.9 -16.3 135 135 A K H <5S+ 0 0 126 -4,-2.8 -2,-0.2 -5,-0.2 -3,-0.2 0.820 139.1 6.7 -84.9 -34.4 7.2 16.3 -16.8 136 136 A E H <5S- 0 0 40 -4,-2.3 -3,-0.2 -5,-0.3 -2,-0.1 0.406 88.0-124.1-127.1 -1.8 6.6 12.6 -15.8 137 137 A K << + 0 0 145 -5,-0.7 2,-0.4 -4,-0.6 -4,-0.2 0.750 65.8 137.9 55.1 28.7 2.8 12.5 -15.2 138 138 A I - 0 0 1 -6,-1.1 2,-0.4 -9,-0.1 -1,-0.2 -0.884 46.2-144.1-101.5 135.0 3.4 11.2 -11.6 139 139 A T - 0 0 26 -2,-0.4 -130,-2.3 -130,-0.2 2,-0.3 -0.802 23.2-176.5 -97.3 142.0 1.4 12.5 -8.7 140 140 A V E -B 8 0A 1 -2,-0.4 2,-0.5 -132,-0.3 -132,-0.2 -0.817 25.0-120.1-133.3 164.6 3.2 12.9 -5.4 141 141 A T E -B 7 0A 0 -134,-1.9 -134,-2.1 -2,-0.3 2,-0.4 -0.957 23.6-156.5-112.6 123.0 2.5 13.8 -1.8 142 142 A V E -Bd 6 163A 0 20,-1.9 22,-1.6 -2,-0.5 2,-0.4 -0.810 8.0-173.1 -96.6 137.0 4.3 16.9 -0.2 143 143 A G E -Bd 5 164A 0 -138,-2.9 -138,-3.3 -2,-0.4 2,-0.4 -0.997 5.9-169.0-126.7 126.6 4.8 17.3 3.6 144 144 A I E +Bd 4 165A 0 20,-3.0 22,-2.7 -2,-0.4 2,-0.3 -0.966 22.9 127.6-119.0 127.7 6.2 20.5 5.0 145 145 A S E -Bd 3 166A 0 -142,-2.0 -142,-3.1 -2,-0.4 22,-0.1 -0.942 68.7 -82.3-156.4-173.4 7.4 21.2 8.6 146 146 A K S S+ 0 0 40 20,-0.5 2,-0.3 -2,-0.3 -142,-0.1 0.532 106.2 17.5 -72.8 -10.3 10.3 22.4 10.7 147 147 A N S > S- 0 0 3 -144,-0.2 4,-2.5 1,-0.1 5,-0.2 -0.995 81.8 -97.0-158.0 169.9 12.1 19.0 10.4 148 148 A K H > S+ 0 0 22 87,-0.5 4,-2.2 -2,-0.3 5,-0.2 0.898 116.6 51.3 -54.2 -48.4 12.5 15.7 8.7 149 149 A V H > S+ 0 0 9 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.952 115.0 41.3 -56.8 -52.9 10.4 13.7 11.1 150 150 A F H > S+ 0 0 2 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.806 109.7 57.6 -72.5 -27.9 7.4 16.1 11.0 151 151 A A H X S+ 0 0 0 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.919 111.1 45.3 -60.7 -43.3 7.7 16.6 7.2 152 152 A K H X S+ 0 0 53 -4,-2.2 4,-2.1 -5,-0.2 -2,-0.2 0.904 112.3 49.4 -67.0 -46.6 7.3 12.8 6.9 153 153 A I H X S+ 0 0 9 -4,-2.3 4,-1.5 2,-0.2 -2,-0.2 0.906 111.2 51.6 -55.7 -42.1 4.4 12.7 9.4 154 154 A A H X S+ 0 0 0 -4,-2.5 4,-0.9 1,-0.2 3,-0.3 0.919 109.1 49.1 -66.5 -42.5 2.7 15.5 7.5 155 155 A A H >X S+ 0 0 0 -4,-2.1 4,-1.2 1,-0.2 3,-1.0 0.908 107.3 56.1 -60.0 -41.0 3.0 13.6 4.2 156 156 A D H 3< S+ 0 0 70 -4,-2.1 -1,-0.2 1,-0.3 3,-0.2 0.840 105.8 51.5 -63.5 -32.3 1.6 10.5 5.8 157 157 A M H 3< S+ 0 0 92 -4,-1.5 -1,-0.3 -3,-0.3 -2,-0.2 0.690 114.4 42.4 -75.0 -21.9 -1.5 12.3 6.8 158 158 A A H << S+ 0 0 21 -3,-1.0 -2,-0.2 -4,-0.9 -1,-0.2 0.501 82.7 157.6-106.8 -7.1 -2.1 13.7 3.4 159 159 A K < + 0 0 82 -4,-1.2 4,-0.1 -3,-0.2 -3,-0.0 -0.031 45.3 50.6 -42.7 152.5 -1.4 10.6 1.2 160 160 A P S S- 0 0 54 0, 0.0 -20,-0.1 0, 0.0 -152,-0.1 0.770 132.6 -29.2 19.4 117.3 -2.8 10.3 -2.2 161 161 A N S S+ 0 0 100 1,-0.2 2,-0.2 -22,-0.1 -20,-0.2 0.842 104.7 130.1 53.1 47.9 -2.0 13.4 -4.1 162 162 A G - 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0 0 39 -2,-0.8 4,-2.4 -3,-0.1 5,-0.2 -0.112 51.1 -73.1 -92.2-166.2 7.1 -0.3 15.7 188 188 A N H > S+ 0 0 144 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.926 128.2 48.8 -56.4 -53.4 5.0 -3.0 17.4 189 189 A I H > S+ 0 0 120 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.942 115.5 41.9 -56.5 -54.9 7.6 -4.1 19.8 190 190 A T H > S+ 0 0 20 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.825 111.0 57.3 -66.3 -34.2 8.6 -0.7 21.0 191 191 A A H X S+ 0 0 16 -4,-2.4 4,-1.7 2,-0.2 -1,-0.2 0.926 106.5 49.6 -60.4 -45.0 5.0 0.5 21.2 192 192 A E H X S+ 0 0 122 -4,-2.4 4,-2.2 1,-0.2 3,-0.3 0.932 109.8 50.5 -59.6 -48.8 4.2 -2.4 23.6 193 193 A K H X S+ 0 0 88 -4,-1.9 4,-1.0 1,-0.2 -1,-0.2 0.907 109.2 51.3 -57.2 -43.0 7.1 -1.6 25.8 194 194 A L H <>S+ 0 0 0 -4,-2.1 5,-3.3 1,-0.2 -1,-0.2 0.806 108.3 52.6 -66.7 -29.3 6.0 2.1 26.0 195 195 A K H ><5S+ 0 0 142 -4,-1.7 3,-2.2 -3,-0.3 -1,-0.2 0.900 101.2 59.6 -68.9 -42.0 2.5 1.0 27.0 196 196 A K H 3<5S+ 0 0 185 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.783 109.2 44.5 -56.8 -29.1 3.9 -1.1 29.8 197 197 A L T 3<5S- 0 0 53 -4,-1.0 -1,-0.3 -5,-0.2 -2,-0.2 0.365 119.9-114.7 -91.4 1.9 5.4 2.1 31.2 198 198 A G T < 5 + 0 0 45 -3,-2.2 2,-0.7 1,-0.2 -3,-0.2 0.849 66.6 146.7 67.0 36.3 2.1 3.9 30.5 199 199 A I < + 0 0 6 -5,-3.3 -1,-0.2 1,-0.1 -2,-0.1 -0.921 6.6 153.4-107.8 107.4 3.7 6.2 27.9 200 200 A N + 0 0 76 -2,-0.7 -20,-2.8 1,-0.2 2,-0.3 0.612 59.0 35.0-110.4 -21.7 1.1 6.9 25.2 201 201 A K B > S-H 179 0C 72 -22,-0.2 3,-1.5 -21,-0.1 4,-0.3 -0.939 84.3-107.8-137.2 153.9 2.1 10.2 23.7 202 202 A L G > S+ 0 0 3 -24,-0.8 3,-2.2 -28,-0.3 4,-0.3 0.867 117.5 61.9 -49.4 -40.0 5.4 11.9 23.0 203 203 A V G > S+ 0 0 53 -28,-1.7 3,-1.6 1,-0.3 4,-0.3 0.824 90.2 69.7 -61.3 -28.8 4.8 14.3 25.9 204 204 A D G X S+ 0 0 50 -3,-1.5 3,-0.6 1,-0.3 -1,-0.3 0.649 87.1 66.7 -61.6 -15.7 4.8 11.4 28.3 205 205 A T G X S+ 0 0 1 -3,-2.2 3,-0.6 -4,-0.3 -1,-0.3 0.678 90.6 61.0 -82.5 -16.1 8.6 10.9 27.7 206 206 A L G < S+ 0 0 69 -3,-1.6 -1,-0.2 -4,-0.3 -2,-0.2 0.554 98.9 58.9 -84.1 -10.0 9.5 14.2 29.5 207 207 A S G < S+ 0 0 110 -3,-0.6 2,-0.3 -4,-0.3 -1,-0.2 -0.190 94.2 77.9-113.0 37.4 8.0 13.0 32.8 208 208 A I S < S- 0 0 38 -3,-0.6 2,-0.0 0, 0.0 5,-0.0 -0.995 88.5 -96.6-146.3 143.9 10.1 9.9 33.2 209 209 A E > - 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