==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-JAN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER DNA/TRANSFERASE 27-JUL-11 3T5H . COMPND 2 MOLECULE: DNA POLYMERASE IV; . SOURCE 2 ORGANISM_SCIENTIFIC: SULFOLOBUS SOLFATARICUS P2; . AUTHOR S.BANERJEE,P.P.CHRISTOV,A.KOZEKOVA,C.J.RIZZO,M.P.STONE . 341 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17924.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 251 73.6 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 . 23 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 116 34.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 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 1 0 0 1 1 2 1 2 0 0 0 0 1 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 93 0, 0.0 2,-0.5 0, 0.0 109,-0.0 0.000 360.0 360.0 360.0 116.8 -47.0 34.1 12.9 2 2 A I - 0 0 17 113,-0.1 109,-1.5 2,-0.0 2,-0.4 -0.973 360.0-171.0-125.0 122.1 -44.9 36.4 10.8 3 3 A V E -AB 110 145A 0 142,-2.9 142,-1.9 -2,-0.5 2,-0.5 -0.903 6.8-159.6-112.9 139.0 -41.2 36.9 11.3 4 4 A L E -AB 109 144A 0 105,-2.7 105,-2.6 -2,-0.4 2,-0.4 -0.974 8.7-163.3-120.8 117.4 -39.1 39.5 9.6 5 5 A F E -AB 108 143A 0 138,-3.3 138,-2.6 -2,-0.5 2,-0.5 -0.874 0.7-160.7-104.2 132.6 -35.4 38.9 9.3 6 6 A V E +AB 107 142A 0 101,-3.2 101,-1.8 -2,-0.4 2,-0.4 -0.954 10.3 178.0-115.5 130.3 -32.9 41.7 8.6 7 7 A D E -AB 106 141A 11 134,-2.2 134,-2.4 -2,-0.5 99,-0.2 -0.933 25.4-132.7-134.6 107.6 -29.4 41.0 7.3 8 8 A F E > - B 0 140A 1 97,-1.9 3,-0.8 -2,-0.4 132,-0.3 -0.325 30.5-108.3 -63.1 136.6 -27.1 44.0 6.4 9 9 A D T 3 S- 0 0 1 130,-2.0 5,-0.3 1,-0.3 130,-0.1 -0.445 82.0 -29.7 -71.7 135.9 -25.3 43.7 3.1 10 10 A Y T >> S- 0 0 37 -2,-0.2 4,-2.3 1,-0.1 3,-0.8 0.756 86.0-168.9 24.0 47.6 -21.6 43.0 3.0 11 11 A F H <> + 0 0 7 -3,-0.8 4,-2.2 1,-0.2 5,-0.2 0.664 68.4 43.8 -31.2 -62.4 -21.6 44.8 6.3 12 12 A Y H 3> S+ 0 0 39 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.924 119.9 45.0 -60.0 -41.5 -18.0 45.5 7.3 13 13 A A H <> S+ 0 0 0 -3,-0.8 4,-1.8 1,-0.2 -2,-0.2 0.896 111.4 52.5 -68.1 -40.0 -17.1 46.5 3.7 14 14 A Q H X S+ 0 0 8 -4,-2.3 4,-2.8 -5,-0.3 -1,-0.2 0.854 106.9 52.9 -66.5 -32.6 -20.3 48.7 3.4 15 15 A V H X S+ 0 0 1 -4,-2.2 4,-2.9 -5,-0.2 -1,-0.2 0.934 106.9 51.9 -66.9 -43.2 -19.5 50.5 6.6 16 16 A E H X S+ 0 0 9 -4,-1.7 4,-0.6 1,-0.2 -1,-0.2 0.864 111.3 48.7 -59.3 -36.6 -16.0 51.3 5.3 17 17 A E H >< S+ 0 0 4 -4,-1.8 3,-1.2 2,-0.2 6,-0.2 0.939 108.8 51.8 -68.8 -47.1 -17.7 52.7 2.2 18 18 A V H 3< S+ 0 0 51 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.925 112.4 46.9 -54.5 -44.6 -20.2 54.8 4.2 19 19 A L H 3< S+ 0 0 88 -4,-2.9 -1,-0.3 1,-0.3 -2,-0.2 0.608 130.3 22.5 -73.5 -11.9 -17.2 56.2 6.1 20 20 A N X< - 0 0 73 -3,-1.2 3,-2.5 -4,-0.6 -1,-0.3 -0.464 69.0-175.4-157.0 75.6 -15.3 56.9 2.8 21 21 A P G > S+ 0 0 80 0, 0.0 3,-1.2 0, 0.0 -3,-0.1 0.607 76.0 77.1 -47.1 -24.3 -17.7 57.1 -0.2 22 22 A S G 3 S+ 0 0 78 1,-0.3 -5,-0.1 -5,-0.1 4,-0.1 0.736 87.0 63.5 -65.0 -17.8 -14.9 57.4 -2.7 23 23 A L G X S+ 0 0 9 -3,-2.5 3,-2.3 -6,-0.2 -1,-0.3 0.766 77.6 115.2 -74.3 -26.2 -14.5 53.7 -2.2 24 24 A K T < S+ 0 0 119 -3,-1.2 -10,-0.0 1,-0.3 0, 0.0 -0.068 78.3 18.9 -46.1 138.2 -18.0 53.1 -3.6 25 25 A G T 3 S+ 0 0 56 1,-0.3 -1,-0.3 3,-0.0 -2,-0.1 0.194 107.1 97.9 84.8 -20.1 -18.0 51.1 -6.9 26 26 A K S < S- 0 0 93 -3,-2.3 2,-0.5 -4,-0.1 23,-0.3 -0.584 88.5 -93.0 -97.0 162.5 -14.5 49.8 -6.4 27 27 A P - 0 0 32 0, 0.0 45,-2.5 0, 0.0 2,-0.5 -0.651 45.2-166.5 -78.8 123.8 -13.6 46.4 -5.0 28 28 A V E -e 72 0B 0 -2,-0.5 19,-2.0 43,-0.2 2,-0.5 -0.954 7.6-168.4-116.7 126.6 -13.1 46.7 -1.2 29 29 A V E -eF 73 46B 0 43,-3.4 45,-3.0 -2,-0.5 2,-0.7 -0.934 7.4-158.5-118.7 112.1 -11.5 44.0 1.0 30 30 A V E -eF 74 45B 0 15,-2.4 14,-2.6 -2,-0.5 15,-1.4 -0.793 26.0-169.2 -89.3 117.8 -11.7 44.2 4.8 31 31 A C E -eF 75 43B 1 43,-3.6 45,-2.8 -2,-0.7 2,-0.6 -0.750 30.1-142.7-115.7 158.5 -8.8 42.1 6.2 32 32 A V E - F 0 42B 67 10,-3.1 10,-1.5 -2,-0.3 2,-0.6 -0.930 25.3-153.4-114.7 102.3 -7.6 40.6 9.4 33 33 A F E - F 0 41B 91 -2,-0.6 8,-0.3 8,-0.2 5,-0.0 -0.692 9.8-167.3 -82.6 119.1 -3.8 40.8 9.4 34 34 A S - 0 0 30 6,-1.6 7,-0.2 -2,-0.6 -1,-0.1 0.620 28.5-134.0 -80.6 -14.3 -2.1 38.1 11.6 35 35 A G S S+ 0 0 51 5,-0.7 3,-0.1 2,-0.3 6,-0.1 0.449 72.0 118.9 77.1 -1.5 1.3 39.7 11.6 36 36 A R S S- 0 0 50 1,-0.2 2,-0.3 215,-0.1 -1,-0.1 0.783 87.8 -34.6 -67.5 -26.4 3.2 36.5 10.8 37 37 A F S > S- 0 0 130 3,-0.1 3,-2.5 0, 0.0 -2,-0.3 -0.973 97.1 -29.7-176.4 178.2 4.5 38.0 7.6 38 38 A E T 3 S- 0 0 158 1,-0.3 24,-0.1 -2,-0.3 -2,-0.0 -0.239 127.7 -14.1 -48.7 113.5 3.8 40.3 4.6 39 39 A D T 3 S+ 0 0 40 1,-0.2 23,-0.5 -2,-0.1 -1,-0.3 0.774 90.9 160.8 61.1 28.3 -0.0 40.2 4.1 40 40 A S < + 0 0 5 -3,-2.5 -6,-1.6 21,-0.1 -5,-0.7 -0.618 34.4 63.6 -79.4 141.0 -0.5 37.1 6.3 41 41 A G E S-F 33 0B 26 -2,-0.3 20,-1.8 -8,-0.3 21,-0.3 -0.894 75.5 -78.4 142.6-171.2 -4.1 36.8 7.4 42 42 A A E -FG 32 60B 39 -10,-1.5 -10,-3.1 -2,-0.3 2,-0.5 -0.836 35.4-105.8-127.6 165.1 -7.6 36.2 6.2 43 43 A V E -F 31 0B 4 16,-1.9 15,-2.8 13,-0.3 -12,-0.3 -0.799 19.8-165.1 -91.2 128.5 -10.4 38.3 4.6 44 44 A A E - 0 0 29 -14,-2.6 2,-0.3 -2,-0.5 -13,-0.2 0.908 69.2 -41.7 -76.6 -46.2 -13.2 39.1 7.0 45 45 A T E -F 30 0B 19 -15,-1.4 -15,-2.4 11,-0.1 -1,-0.4 -0.964 53.7-150.2-170.7 169.5 -15.5 40.2 4.1 46 46 A A E -F 29 0B 0 -2,-0.3 -17,-0.2 -17,-0.2 11,-0.2 -0.983 26.5-104.2-148.6 155.9 -15.5 42.0 0.8 47 47 A N > - 0 0 0 -19,-2.0 4,-2.1 -2,-0.3 3,-0.5 -0.237 44.5 -97.2 -75.1 174.3 -18.0 44.0 -1.2 48 48 A Y H > S+ 0 0 63 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.761 119.4 66.6 -64.4 -26.6 -19.7 42.6 -4.3 49 49 A E H 4 S+ 0 0 51 -23,-0.3 -1,-0.2 1,-0.2 4,-0.2 0.942 112.1 35.9 -59.3 -43.7 -17.2 44.2 -6.7 50 50 A A H >4>S+ 0 0 0 -3,-0.5 5,-1.6 -24,-0.2 3,-1.5 0.861 111.8 60.6 -77.0 -36.1 -14.6 42.0 -5.2 51 51 A R H ><5S+ 0 0 83 -4,-2.1 3,-1.6 1,-0.3 -1,-0.2 0.754 91.2 66.5 -65.3 -26.3 -16.8 38.9 -4.7 52 52 A K T 3<5S+ 0 0 148 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.1 0.666 102.8 49.5 -71.3 -10.0 -17.6 38.5 -8.3 53 53 A F T < 5S- 0 0 121 -3,-1.5 -1,-0.3 -4,-0.2 -2,-0.2 0.179 129.6 -92.2-109.2 14.5 -14.0 37.6 -8.9 54 54 A G T < 5S+ 0 0 37 -3,-1.6 2,-0.7 1,-0.3 -3,-0.2 0.351 82.4 134.2 93.8 -6.8 -13.7 35.1 -6.1 55 55 A V < + 0 0 0 -5,-1.6 2,-0.3 -6,-0.1 -1,-0.3 -0.697 32.1 135.6 -82.4 118.4 -12.6 37.4 -3.3 56 56 A K > - 0 0 122 -2,-0.7 3,-1.5 -3,-0.1 -13,-0.3 -0.960 57.3 -54.7-154.9 169.5 -14.6 36.6 -0.2 57 57 A A T 3 S+ 0 0 58 -2,-0.3 -13,-0.2 1,-0.2 -12,-0.1 -0.142 115.4 24.5 -49.2 135.9 -14.7 36.0 3.6 58 58 A G T 3 S+ 0 0 60 -15,-2.8 -1,-0.2 1,-0.3 -14,-0.1 -0.109 88.3 112.9 101.5 -39.1 -12.3 33.2 4.6 59 59 A I S < S- 0 0 33 -3,-1.5 -16,-1.9 1,-0.1 -1,-0.3 -0.348 76.8 -93.1 -70.3 152.7 -9.7 33.2 1.8 60 60 A P B > -G 42 0B 69 0, 0.0 4,-1.7 0, 0.0 3,-0.4 -0.311 24.6-126.9 -63.9 146.6 -6.1 34.2 2.6 61 61 A I H > S+ 0 0 0 -20,-1.8 4,-2.2 1,-0.2 5,-0.2 0.901 110.3 58.5 -60.9 -40.4 -5.2 37.9 2.0 62 62 A V H > S+ 0 0 47 -23,-0.5 4,-1.0 -21,-0.3 -1,-0.2 0.829 107.5 46.2 -58.6 -34.9 -2.3 36.8 -0.1 63 63 A E H > S+ 0 0 89 -3,-0.4 4,-1.3 2,-0.2 -1,-0.2 0.806 107.8 56.0 -79.2 -29.9 -4.6 34.9 -2.5 64 64 A A H X S+ 0 0 0 -4,-1.7 4,-3.1 1,-0.2 -2,-0.2 0.915 107.1 51.4 -66.9 -40.0 -7.0 37.8 -2.7 65 65 A K H < S+ 0 0 61 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.791 103.9 55.5 -67.6 -30.8 -4.2 40.1 -3.8 66 66 A K H < S+ 0 0 153 -4,-1.0 -1,-0.2 -5,-0.2 -2,-0.2 0.845 116.1 39.5 -70.7 -31.9 -3.1 37.7 -6.6 67 67 A I H < S+ 0 0 82 -4,-1.3 -2,-0.2 1,-0.2 -1,-0.1 0.917 135.0 18.4 -81.0 -48.3 -6.7 37.9 -8.0 68 68 A L >< + 0 0 25 -4,-3.1 3,-1.5 -5,-0.1 -1,-0.2 -0.657 67.7 166.0-125.6 74.0 -7.3 41.6 -7.4 69 69 A P T 3 S+ 0 0 84 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.756 78.8 48.8 -60.5 -23.6 -3.9 43.2 -6.9 70 70 A N T 3 S+ 0 0 155 -3,-0.1 -5,-0.1 2,-0.1 -2,-0.0 0.335 84.3 112.0-102.1 8.5 -5.4 46.7 -7.3 71 71 A A S < S- 0 0 13 -3,-1.5 2,-0.6 -7,-0.1 -43,-0.2 -0.181 77.5 -98.0 -72.0 171.4 -8.4 46.4 -4.9 72 72 A V E -e 28 0B 38 -45,-2.5 -43,-3.4 -49,-0.1 2,-0.6 -0.849 36.4-160.3 -96.5 122.7 -8.5 48.5 -1.7 73 73 A Y E -e 29 0B 39 -2,-0.6 -43,-0.2 -45,-0.2 -45,-0.0 -0.912 12.4-179.4-106.9 121.5 -7.4 46.5 1.3 74 74 A L E -e 30 0B 38 -45,-3.0 -43,-3.6 -2,-0.6 2,-0.3 -0.939 29.9-114.8-124.8 142.8 -8.5 47.7 4.7 75 75 A P E -e 31 0B 72 0, 0.0 -43,-0.2 0, 0.0 -45,-0.1 -0.555 44.5-102.6 -74.2 134.1 -7.8 46.4 8.3 76 76 A M - 0 0 62 -45,-2.8 2,-0.3 -2,-0.3 -43,-0.1 -0.321 29.6-163.1 -57.4 131.6 -11.0 45.3 10.0 77 77 A R >> + 0 0 94 1,-0.2 4,-1.6 -65,-0.1 3,-1.0 -0.585 13.9 174.1-119.5 67.8 -12.3 47.8 12.5 78 78 A K H 3> S+ 0 0 90 -2,-0.3 4,-2.7 1,-0.2 5,-0.2 0.804 73.7 56.2 -38.1 -52.9 -14.7 45.7 14.6 79 79 A E H 3> S+ 0 0 122 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.891 107.7 49.0 -54.5 -44.8 -15.5 48.4 17.2 80 80 A V H <> S+ 0 0 46 -3,-1.0 4,-2.1 2,-0.2 -1,-0.2 0.929 112.6 46.6 -63.1 -46.5 -16.7 50.9 14.6 81 81 A Y H X S+ 0 0 0 -4,-1.6 4,-2.9 1,-0.2 -2,-0.2 0.884 109.7 56.0 -64.5 -35.9 -18.9 48.3 12.8 82 82 A Q H X S+ 0 0 85 -4,-2.7 4,-2.5 -5,-0.2 -1,-0.2 0.904 108.1 46.8 -63.2 -40.6 -20.3 47.3 16.2 83 83 A Q H X S+ 0 0 132 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.881 113.4 47.5 -70.8 -36.0 -21.4 50.8 17.0 84 84 A V H X S+ 0 0 10 -4,-2.1 4,-1.7 2,-0.2 -2,-0.2 0.927 111.9 52.6 -68.4 -40.7 -23.0 51.3 13.6 85 85 A S H X S+ 0 0 2 -4,-2.9 4,-2.3 1,-0.2 -2,-0.2 0.923 106.2 53.0 -57.5 -46.8 -24.7 48.0 14.1 86 86 A S H X S+ 0 0 53 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.908 106.5 52.2 -56.2 -45.1 -26.0 49.1 17.5 87 87 A R H X S+ 0 0 111 -4,-1.9 4,-1.1 1,-0.2 -1,-0.2 0.863 110.2 49.1 -61.5 -35.4 -27.6 52.2 16.0 88 88 A I H X S+ 0 0 0 -4,-1.7 4,-1.9 2,-0.2 3,-0.3 0.894 107.2 53.9 -72.3 -37.9 -29.3 50.1 13.4 89 89 A M H X S+ 0 0 5 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.890 105.0 55.7 -62.6 -37.0 -30.6 47.6 15.9 90 90 A N H X S+ 0 0 86 -4,-2.1 4,-0.7 1,-0.2 -1,-0.2 0.843 105.6 51.8 -64.8 -31.6 -32.2 50.6 17.8 91 91 A L H >< S+ 0 0 21 -4,-1.1 3,-0.8 -3,-0.3 -1,-0.2 0.915 108.7 49.9 -69.0 -41.9 -34.0 51.6 14.6 92 92 A L H >< S+ 0 0 0 -4,-1.9 3,-2.2 1,-0.2 4,-0.4 0.856 99.2 66.9 -63.7 -36.2 -35.4 48.1 14.2 93 93 A R H >< S+ 0 0 108 -4,-2.0 3,-1.2 1,-0.3 -1,-0.2 0.802 90.0 64.7 -54.4 -31.9 -36.6 48.1 17.8 94 94 A E T << S+ 0 0 134 -3,-0.8 -1,-0.3 -4,-0.7 -2,-0.2 0.338 99.8 54.0 -76.0 7.7 -39.1 50.9 16.9 95 95 A Y T < S+ 0 0 21 -3,-2.2 -1,-0.2 1,-0.4 2,-0.2 0.446 124.3 2.8-117.3 -8.7 -40.8 48.3 14.6 96 96 A S < - 0 0 0 -3,-1.2 -1,-0.4 -4,-0.4 15,-0.1 -0.803 48.7-145.4-177.8 134.5 -41.3 45.6 17.2 97 97 A E S S+ 0 0 136 -2,-0.2 2,-1.0 1,-0.2 14,-0.1 0.715 94.3 74.2 -76.1 -21.0 -40.7 45.1 21.0 98 98 A K + 0 0 79 12,-0.4 12,-2.5 -3,-0.1 2,-0.4 -0.806 67.7 150.6 -97.7 98.0 -40.0 41.5 20.2 99 99 A I E -C 109 0A 6 -2,-1.0 2,-0.6 10,-0.2 10,-0.2 -0.987 34.0-156.3-132.8 138.7 -36.6 41.5 18.5 100 100 A E E -C 108 0A 0 8,-3.0 8,-2.0 -2,-0.4 2,-1.2 -0.909 7.3-157.1-117.9 105.1 -33.8 38.9 18.4 101 101 A I E +C 107 0A 60 -2,-0.6 6,-0.2 6,-0.2 139,-0.2 -0.687 17.3 175.8 -81.2 99.9 -30.3 40.3 17.7 102 102 A A E - 0 0 19 -2,-1.2 2,-0.3 4,-0.9 -1,-0.2 0.779 58.2 -24.0 -78.4 -29.2 -28.6 37.2 16.3 103 103 A S E > S-C 106 0A 42 3,-1.4 3,-0.8 0, 0.0 -1,-0.1 -0.937 86.0 -63.7-165.1-175.5 -25.2 38.7 15.4 104 104 A I T 3 S+ 0 0 29 -2,-0.3 3,-0.0 1,-0.2 -3,-0.0 0.665 134.2 17.6 -59.0 -14.6 -23.4 42.0 14.6 105 105 A D T 3 S+ 0 0 32 1,-0.1 -97,-1.9 -17,-0.0 2,-0.4 0.305 110.1 79.8-143.7 16.4 -25.6 42.2 11.4 106 106 A E E < +AC 7 103A 38 -3,-0.8 -3,-1.4 -99,-0.2 -4,-0.9 -0.967 44.1 165.9-127.4 144.0 -28.6 39.9 11.7 107 107 A A E -AC 6 101A 0 -101,-1.8 -101,-3.2 -2,-0.4 2,-0.4 -0.972 20.9-150.0-159.0 140.5 -31.9 40.4 13.6 108 108 A Y E -AC 5 100A 19 -8,-2.0 -8,-3.0 -2,-0.3 2,-0.4 -0.899 12.1-161.6-111.1 140.9 -35.4 38.8 13.6 109 109 A L E -AC 4 99A 0 -105,-2.6 -105,-2.7 -2,-0.4 2,-1.1 -0.984 15.4-143.1-124.8 132.7 -38.5 40.8 14.4 110 110 A D E +A 3 0A 20 -12,-2.5 -12,-0.4 -2,-0.4 3,-0.3 -0.832 30.3 166.0 -92.0 99.6 -41.8 39.2 15.5 111 111 A I > + 0 0 0 -109,-1.5 4,-1.5 -2,-1.1 -108,-0.1 -0.080 30.2 124.5-107.3 33.6 -44.2 41.5 13.7 112 112 A S T 4 S+ 0 0 39 -110,-0.2 -1,-0.2 2,-0.2 -109,-0.1 0.817 81.8 37.9 -60.8 -32.5 -47.2 39.3 14.1 113 113 A D T 4 S+ 0 0 106 -3,-0.3 -1,-0.2 1,-0.1 -2,-0.1 0.956 110.3 55.7 -81.6 -60.4 -49.1 42.1 15.8 114 114 A K T 4 S+ 0 0 88 -4,-0.2 2,-0.3 -19,-0.1 -2,-0.2 0.741 115.1 42.1 -44.7 -30.5 -48.0 45.1 13.7 115 115 A V < - 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0 0 13 -7,-0.1 -20,-2.3 2,-0.0 2,-0.3 -0.621 50.0-148.5-128.3-172.5 -33.5 42.7 -1.5 163 163 A I E +d 142 0A 27 -22,-0.2 2,-0.3 -2,-0.2 -20,-0.2 -0.941 19.9 177.7-158.8 138.4 -36.7 41.8 0.3 164 164 A K E -d 143 0A 52 -22,-2.2 -20,-2.7 -2,-0.3 2,-0.4 -0.991 20.6-150.0-154.3 143.7 -38.7 38.6 0.0 165 165 A V E -d 144 0A 29 -2,-0.3 2,-0.6 -22,-0.2 -20,-0.2 -0.909 6.6-160.5-111.1 136.1 -41.7 36.8 1.4 166 166 A I - 0 0 0 -22,-3.0 -20,-0.5 -2,-0.4 -12,-0.1 -0.912 20.8-158.3-117.6 98.8 -41.9 33.0 1.6 167 167 A D >> - 0 0 53 -2,-0.6 4,-2.5 -22,-0.1 3,-0.6 -0.244 33.9 -98.4 -73.1 164.5 -45.6 32.1 1.9 168 168 A D H 3> S+ 0 0 75 1,-0.3 4,-1.4 2,-0.2 -1,-0.1 0.776 125.1 58.3 -54.6 -28.1 -47.0 28.9 3.3 169 169 A E H 3> S+ 0 0 159 1,-0.2 4,-1.2 2,-0.2 -1,-0.3 0.930 110.3 41.4 -68.9 -43.7 -47.4 27.7 -0.3 170 170 A E H <> S+ 0 0 30 -3,-0.6 4,-2.6 2,-0.2 5,-0.2 0.831 103.6 66.2 -73.0 -33.8 -43.6 28.1 -0.9 171 171 A V H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 5,-0.2 0.959 103.6 48.4 -50.3 -51.4 -42.6 26.8 2.4 172 172 A K H X S+ 0 0 125 -4,-1.4 4,-0.9 1,-0.2 -1,-0.2 0.872 110.2 48.5 -58.5 -43.5 -44.0 23.4 1.3 173 173 A R H X S+ 0 0 86 -4,-1.2 4,-1.9 1,-0.2 -1,-0.2 0.856 113.0 50.3 -67.9 -30.5 -42.2 23.4 -2.1 174 174 A L H X S+ 0 0 8 -4,-2.6 4,-3.0 2,-0.2 28,-0.3 0.893 102.1 59.7 -71.5 -39.7 -39.0 24.3 -0.3 175 175 A I H < S+ 0 0 15 -4,-2.6 28,-2.2 -5,-0.2 -1,-0.2 0.768 120.0 30.3 -58.7 -24.0 -39.4 21.5 2.2 176 176 A R H < S+ 0 0 141 -4,-0.9 -1,-0.2 -3,-0.2 -2,-0.2 0.644 130.9 35.4-107.9 -21.0 -39.3 19.2 -0.8 177 177 A E H < S+ 0 0 108 -4,-1.9 -3,-0.2 -5,-0.2 -2,-0.2 0.769 88.2 99.5-106.3 -30.5 -37.1 21.2 -3.2 178 178 A L S < S- 0 0 26 -4,-3.0 24,-0.6 -5,-0.2 2,-0.2 -0.377 77.7-114.6 -68.6 131.6 -34.5 23.0 -1.0 179 179 A D B > -H 201 0C 60 1,-0.2 3,-2.1 -2,-0.2 22,-0.2 -0.455 24.9-134.5 -59.9 125.0 -31.0 21.5 -0.8 180 180 A I G > S+ 0 0 0 20,-2.3 3,-1.7 1,-0.3 -1,-0.2 0.769 103.4 68.1 -58.0 -24.2 -30.8 20.5 2.9 181 181 A A G 3 S+ 0 0 40 19,-0.3 -1,-0.3 1,-0.3 5,-0.2 0.812 91.6 61.2 -65.9 -27.1 -27.3 22.1 3.0 182 182 A D G < S+ 0 0 104 -3,-2.1 -1,-0.3 2,-0.1 -2,-0.2 0.450 81.1 105.2 -80.6 4.1 -29.0 25.4 2.5 183 183 A V S X S- 0 0 3 -3,-1.7 3,-1.7 -4,-0.2 -33,-0.0 -0.702 83.1-108.2 -84.8 130.6 -30.9 25.0 5.7 184 184 A P T 3 S+ 0 0 26 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.321 105.5 32.3 -58.8 135.9 -29.4 27.2 8.6 185 185 A G T 3 S+ 0 0 51 1,-0.1 2,-0.7 -4,-0.1 5,-0.1 0.370 93.5 107.9 97.1 -4.4 -27.6 25.2 11.2 186 186 A I < + 0 0 11 -3,-1.7 -1,-0.1 -5,-0.2 -3,-0.1 -0.842 46.6 172.6-110.1 95.3 -26.5 22.7 8.6 187 187 A G > - 0 0 43 -2,-0.7 4,-2.0 -3,-0.1 5,-0.2 -0.007 51.4 -77.5 -85.2-164.9 -22.8 23.1 7.9 188 188 A N H > S+ 0 0 152 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.896 127.6 49.8 -62.8 -43.5 -20.4 21.0 5.8 189 189 A I H > S+ 0 0 125 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.915 113.9 42.8 -65.2 -45.5 -20.0 18.2 8.4 190 190 A T H > S+ 0 0 20 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.876 112.6 54.3 -70.3 -35.6 -23.7 17.8 9.0 191 191 A A H X S+ 0 0 11 -4,-2.0 4,-1.7 2,-0.2 -2,-0.2 0.921 108.9 47.7 -63.7 -43.9 -24.6 18.0 5.3 192 192 A E H X S+ 0 0 119 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.920 111.3 50.8 -63.1 -43.5 -22.1 15.2 4.4 193 193 A K H X S+ 0 0 72 -4,-1.8 4,-0.8 1,-0.2 -1,-0.2 0.900 110.6 49.9 -60.3 -40.5 -23.5 13.0 7.2 194 194 A L H <>S+ 0 0 0 -4,-2.3 5,-2.5 1,-0.2 -1,-0.2 0.781 106.2 56.7 -68.8 -28.5 -27.0 13.6 5.9 195 195 A K H ><5S+ 0 0 82 -4,-1.7 3,-2.7 1,-0.2 -2,-0.2 0.946 102.6 53.2 -66.8 -50.4 -25.9 12.7 2.4 196 196 A K H 3<5S+ 0 0 147 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.758 107.8 53.3 -57.5 -23.8 -24.6 9.3 3.5 197 197 A L T 3<5S- 0 0 20 -4,-0.8 -1,-0.3 -5,-0.2 -2,-0.2 0.448 120.0-112.0 -89.9 -2.3 -28.1 8.8 5.0 198 198 A G T < 5S+ 0 0 45 -3,-2.7 2,-0.8 1,-0.2 -3,-0.2 0.524 74.1 134.7 85.2 5.4 -29.7 9.6 1.7 199 199 A I < + 0 0 0 -5,-2.5 -1,-0.2 1,-0.2 -2,-0.2 -0.796 7.9 147.3 -93.3 108.1 -31.2 12.9 2.9 200 200 A N + 0 0 56 -2,-0.8 -20,-2.3 1,-0.2 2,-0.3 0.451 68.4 40.1-114.7 -7.4 -30.7 15.7 0.4 201 201 A K B > S-H 179 0C 63 -22,-0.2 3,-2.4 -21,-0.1 4,-0.4 -0.969 86.8-113.1-139.4 151.5 -33.9 17.6 1.1 202 202 A L G > S+ 0 0 2 -24,-0.6 3,-2.3 -28,-0.3 4,-0.2 0.905 116.9 65.0 -50.9 -40.3 -35.8 18.4 4.3 203 203 A V G > S+ 0 0 54 -28,-2.2 3,-0.8 1,-0.3 -1,-0.3 0.703 90.9 64.0 -57.3 -21.5 -38.5 16.0 3.0 204 204 A D G X S+ 0 0 38 -3,-2.4 3,-1.0 1,-0.2 -1,-0.3 0.632 83.1 77.6 -78.8 -12.3 -36.1 13.1 3.2 205 205 A T G < S+ 0 0 2 -3,-2.3 3,-0.3 -4,-0.4 -1,-0.2 0.565 89.9 55.2 -74.2 -7.3 -35.8 13.4 7.0 206 206 A L G < S+ 0 0 88 -3,-0.8 -1,-0.2 -4,-0.2 -2,-0.1 0.531 95.1 66.0 -99.9 -8.9 -39.2 11.7 7.4 207 207 A S S < S+ 0 0 90 -3,-1.0 2,-0.3 -4,-0.2 -1,-0.2 -0.023 94.9 75.2 -99.8 28.7 -38.2 8.6 5.4 208 208 A I S S- 0 0 40 -3,-0.3 2,-0.3 -9,-0.0 3,-0.0 -0.964 90.9-103.2-137.3 150.8 -35.6 7.7 8.1 209 209 A E >> - 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