==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/DNA 04-OCT-06 2J6U . COMPND 2 MOLECULE: DNA POLYMERASE IV; . SOURCE 2 ORGANISM_SCIENTIFIC: SULFOLOBUS SOLFATARICUS; . AUTHOR R.L.EOFF,A.IRIMIA,F.P.GUENGERICH,M.EGLI . 344 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18068.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 255 74.1 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 17.4 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 . 1 0.3 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 . 36 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 116 33.7 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 0 2 2 0 0 0 0 1 0 1 1 1 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 H 0 0 84 0, 0.0 3,-0.2 0, 0.0 115,-0.1 0.000 360.0 360.0 360.0 -47.0 -3.7 34.9 15.3 2 2 A H - 0 0 131 1,-1.1 2,-0.3 113,-0.0 117,-0.0 0.544 360.0 -29.7-103.1 -30.2 -5.2 32.1 13.1 3 3 A H S S- 0 0 53 112,-0.1 -1,-1.1 147,-0.0 147,-0.1 -0.804 101.3 -63.0-177.3 149.9 -1.6 31.0 13.3 4 4 A M - 0 0 27 -2,-0.3 2,-0.4 -3,-0.2 109,-0.1 0.118 34.2-151.6 -45.9 156.7 1.4 33.3 13.6 5 5 A I - 0 0 3 2,-0.0 109,-2.3 142,-0.0 2,-0.4 -0.931 20.4-164.4-130.4 102.1 2.4 35.9 11.0 6 6 A V E -AB 113 148A 0 142,-2.7 142,-1.5 -2,-0.4 2,-0.5 -0.790 10.1-164.2 -99.3 134.7 6.2 36.3 11.2 7 7 A L E -AB 112 147A 0 105,-2.6 105,-2.5 -2,-0.4 2,-0.5 -0.966 10.7-167.4-115.5 119.3 8.0 39.2 9.7 8 8 A F E -AB 111 146A 0 138,-3.6 138,-2.7 -2,-0.5 2,-0.5 -0.902 3.2-164.5-112.3 131.8 11.8 38.8 9.3 9 9 A V E +AB 110 145A 0 101,-2.4 101,-1.4 -2,-0.5 2,-0.4 -0.961 7.9 178.8-120.4 130.0 14.2 41.5 8.5 10 10 A D E -AB 109 144A 7 134,-2.4 134,-2.3 -2,-0.5 2,-0.3 -0.974 28.1-127.3-130.8 117.0 17.8 41.0 7.4 11 11 A F E > - B 0 143A 3 97,-2.6 3,-1.1 -2,-0.4 132,-0.3 -0.445 32.2-108.6 -68.6 126.4 20.0 44.0 6.6 12 12 A D T 3 S- 0 0 4 130,-1.5 5,-0.3 -2,-0.3 130,-0.2 -0.266 85.0 -28.6 -57.4 131.4 21.7 43.8 3.1 13 13 A Y T >> S- 0 0 39 3,-0.1 4,-2.8 4,-0.1 3,-0.6 0.759 85.7-165.7 22.9 55.7 25.5 43.1 3.2 14 14 A F H <> + 0 0 9 -3,-1.1 4,-2.9 1,-0.2 5,-0.3 0.737 69.9 42.7 -33.9 -71.4 25.5 44.8 6.6 15 15 A Y H 3> S+ 0 0 36 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.881 121.3 43.7 -52.8 -40.4 29.1 45.6 7.6 16 16 A A H <> S+ 0 0 0 -3,-0.6 4,-1.9 2,-0.2 -1,-0.2 0.908 112.3 51.9 -73.0 -39.2 29.9 46.8 4.1 17 17 A Q H X S+ 0 0 5 -4,-2.8 4,-3.1 -5,-0.3 -2,-0.2 0.919 107.8 52.5 -64.2 -39.3 26.6 48.7 3.7 18 18 A V H X S+ 0 0 0 -4,-2.9 4,-2.5 1,-0.3 -1,-0.2 0.919 108.2 50.7 -60.0 -43.5 27.3 50.5 7.0 19 19 A E H < S+ 0 0 9 -4,-1.7 4,-0.5 -5,-0.3 -1,-0.3 0.857 110.2 51.2 -61.9 -34.2 30.8 51.5 5.7 20 20 A E H >< S+ 0 0 9 -4,-1.9 3,-1.5 1,-0.2 6,-0.3 0.953 108.2 50.9 -67.2 -47.0 29.0 52.8 2.6 21 21 A V H 3< S+ 0 0 45 -4,-3.1 -2,-0.2 1,-0.3 -1,-0.2 0.891 110.6 49.4 -56.8 -39.9 26.6 54.8 4.7 22 22 A L T 3< S+ 0 0 86 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.550 130.8 18.9 -78.3 -5.4 29.6 56.3 6.6 23 23 A N X - 0 0 72 -3,-1.5 3,-3.1 -4,-0.5 -1,-0.3 -0.408 67.8-176.0-162.8 72.5 31.3 57.1 3.3 24 24 A P G > S+ 0 0 79 0, 0.0 3,-0.9 0, 0.0 -3,-0.1 0.589 76.3 83.3 -50.3 -12.9 28.7 57.2 0.4 25 25 A S G 3 S+ 0 0 79 1,-0.2 -5,-0.1 -5,-0.1 -4,-0.1 0.773 83.9 62.5 -63.5 -23.5 31.7 57.8 -1.9 26 26 A L G X S+ 0 0 9 -3,-3.1 3,-2.3 -6,-0.3 -1,-0.2 0.775 75.3 115.4 -72.9 -29.3 32.0 54.0 -1.7 27 27 A K T < S+ 0 0 105 -3,-0.9 -10,-0.0 1,-0.3 0, 0.0 -0.110 78.1 21.1 -47.0 130.0 28.7 53.2 -3.3 28 28 A G T 3 S+ 0 0 58 1,-0.4 -1,-0.3 3,-0.0 -2,-0.1 0.221 105.2 96.9 96.7 -17.4 28.9 51.5 -6.6 29 29 A K S < S- 0 0 89 -3,-2.3 2,-0.5 -4,-0.0 -1,-0.4 -0.668 88.9 -94.5-101.9 158.1 32.4 50.2 -6.0 30 30 A P - 0 0 34 0, 0.0 45,-2.8 0, 0.0 2,-0.5 -0.638 45.1-164.6 -75.2 121.5 33.3 46.8 -4.7 31 31 A V E -e 75 0B 0 -2,-0.5 19,-2.3 43,-0.2 2,-0.5 -0.934 8.2-171.9-113.0 129.0 33.7 47.0 -0.9 32 32 A V E -eF 76 49B 0 43,-2.8 45,-2.5 -2,-0.5 2,-0.6 -0.963 11.5-152.7-124.3 117.2 35.4 44.4 1.2 33 33 A V E -eF 77 48B 0 15,-2.4 14,-2.8 -2,-0.5 15,-1.1 -0.779 25.6-157.1 -89.7 123.7 35.4 44.4 5.0 34 34 A C E -eF 78 46B 1 43,-4.0 45,-3.0 -2,-0.6 2,-0.6 -0.737 26.6-151.4-113.1 153.6 38.5 42.6 6.4 35 35 A V E - F 0 45B 62 10,-3.1 10,-1.5 -2,-0.3 2,-0.6 -0.852 23.6-158.7-116.7 90.2 39.6 40.9 9.5 36 36 A F E - F 0 44B 84 -2,-0.6 8,-0.3 8,-0.2 7,-0.1 -0.611 8.2-165.9 -74.0 113.7 43.4 41.3 9.5 37 37 A S - 0 0 29 6,-1.0 7,-0.2 -2,-0.6 -1,-0.1 0.479 31.6-129.3 -79.8 -2.5 45.1 38.7 11.7 38 38 A G S S+ 0 0 41 5,-0.5 3,-0.1 2,-0.2 6,-0.1 0.612 75.6 119.2 66.1 10.2 48.4 40.5 11.8 39 39 A R S S- 0 0 44 1,-0.3 2,-0.3 215,-0.0 -1,-0.1 0.830 87.8 -25.5 -74.2 -31.9 50.4 37.4 10.8 40 40 A F S > S- 0 0 124 3,-0.0 3,-3.8 0, 0.0 -1,-0.3 -0.945 96.6 -48.8-173.7 160.2 51.6 39.2 7.7 41 41 A E T 3 S- 0 0 172 1,-0.3 -3,-0.1 -2,-0.3 -5,-0.0 0.441 131.2 -3.7 0.5 -61.7 50.8 42.0 5.2 42 42 A D T 3 S+ 0 0 29 2,-0.1 23,-0.5 -5,-0.0 -1,-0.3 -0.102 87.4 152.3-139.5 35.2 47.2 40.9 4.5 43 43 A S < + 0 0 5 -3,-3.8 -6,-1.0 21,-0.1 -5,-0.5 -0.372 42.6 59.9 -64.7 151.0 46.8 37.7 6.5 44 44 A G E S-F 36 0B 24 -8,-0.3 20,-1.2 -7,-0.2 21,-0.3 -0.849 75.5 -81.8 129.9-165.3 43.2 37.2 7.5 45 45 A A E -FG 35 63B 36 -10,-1.5 -10,-3.1 -2,-0.3 2,-0.5 -0.880 33.5 -96.7-140.6 170.7 39.8 36.8 6.1 46 46 A V E -F 34 0B 5 16,-1.9 15,-2.4 13,-0.3 -12,-0.2 -0.775 19.6-165.8 -91.2 129.0 36.8 38.7 4.6 47 47 A A E S- 0 0 31 -14,-2.8 2,-0.3 -2,-0.5 13,-0.2 0.847 71.4 -44.1 -79.9 -32.7 34.0 39.4 7.1 48 48 A T E -F 33 0B 19 -15,-1.1 -15,-2.4 11,-0.1 -1,-0.4 -0.938 54.6-148.4 178.1 168.0 31.7 40.3 4.2 49 49 A A E -F 32 0B 0 -2,-0.3 -17,-0.2 -17,-0.2 11,-0.1 -0.964 27.0-100.6-148.9 160.4 31.6 42.3 1.0 50 50 A N >> - 0 0 0 -19,-2.3 4,-2.5 -2,-0.3 3,-1.1 -0.409 42.1-100.9 -81.3 166.8 29.0 44.2 -1.0 51 51 A Y H 3> S+ 0 0 63 1,-0.3 4,-1.7 2,-0.2 5,-0.1 0.779 117.4 68.2 -56.6 -31.2 27.3 42.7 -4.1 52 52 A E H 34 S+ 0 0 56 -23,-0.3 -1,-0.3 1,-0.2 4,-0.2 0.912 115.4 28.2 -55.7 -41.0 29.6 44.6 -6.5 53 53 A A H X4>S+ 0 0 0 -3,-1.1 5,-1.7 -24,-0.2 3,-1.4 0.783 112.5 66.7 -88.7 -32.0 32.5 42.5 -5.3 54 54 A R H ><5S+ 0 0 75 -4,-2.5 3,-1.6 1,-0.3 -2,-0.2 0.775 90.3 64.8 -62.3 -26.9 30.4 39.5 -4.4 55 55 A K T 3<5S+ 0 0 151 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.1 0.752 100.2 52.1 -70.4 -20.0 29.5 38.9 -8.0 56 56 A F T < 5S- 0 0 121 -3,-1.4 -1,-0.3 -4,-0.2 -2,-0.2 0.167 130.4 -94.3 -98.7 16.6 33.2 38.2 -8.7 57 57 A G T < 5S+ 0 0 35 -3,-1.6 2,-1.0 1,-0.2 -3,-0.2 0.495 81.3 136.7 88.2 4.0 33.3 35.6 -5.9 58 58 A V < + 0 0 0 -5,-1.7 2,-0.3 -8,-0.1 -1,-0.2 -0.760 31.2 136.9 -89.0 107.7 34.6 37.8 -3.1 59 59 A K > - 0 0 113 -2,-1.0 3,-1.7 -3,-0.1 -13,-0.3 -0.905 57.6 -54.3-143.9 171.9 32.5 36.9 -0.1 60 60 A A T 3 S+ 0 0 56 -2,-0.3 -13,-0.2 1,-0.2 -12,-0.1 -0.139 114.8 30.9 -49.1 135.3 32.7 36.2 3.7 61 61 A G T 3 S+ 0 0 62 -15,-2.4 -1,-0.2 1,-0.3 -14,-0.1 0.099 86.1 113.6 104.3 -24.3 35.2 33.4 4.6 62 62 A I S < S- 0 0 30 -3,-1.7 -16,-1.9 1,-0.1 -1,-0.3 -0.517 75.2 -97.4 -85.2 153.4 37.8 33.8 1.9 63 63 A P B >> -G 45 0B 67 0, 0.0 4,-1.6 0, 0.0 3,-0.5 -0.378 27.4-126.3 -64.2 144.0 41.4 34.9 2.7 64 64 A I H 3> S+ 0 0 0 -20,-1.2 4,-2.6 -22,-0.2 5,-0.3 0.913 110.4 61.5 -56.2 -41.0 42.0 38.6 2.1 65 65 A V H 3> S+ 0 0 65 -23,-0.5 4,-1.4 -21,-0.3 -1,-0.2 0.862 104.8 45.5 -54.1 -41.0 44.9 37.5 -0.1 66 66 A E H <> S+ 0 0 87 -3,-0.5 4,-1.6 2,-0.2 -1,-0.3 0.822 109.9 56.1 -74.0 -29.2 42.6 35.6 -2.5 67 67 A A H X S+ 0 0 0 -4,-1.6 4,-3.3 -3,-0.2 3,-0.3 0.951 109.0 45.0 -66.1 -48.0 40.2 38.5 -2.5 68 68 A K H < S+ 0 0 65 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.830 108.1 58.9 -65.3 -30.4 42.9 41.0 -3.6 69 69 A K H < S+ 0 0 159 -4,-1.4 -1,-0.2 -5,-0.3 -2,-0.2 0.883 114.3 37.2 -65.7 -35.9 44.0 38.4 -6.2 70 70 A I H < S+ 0 0 78 -4,-1.6 -2,-0.2 -3,-0.3 -1,-0.2 0.950 136.7 17.2 -80.1 -53.4 40.5 38.5 -7.7 71 71 A L >< + 0 0 28 -4,-3.3 3,-1.8 -5,-0.1 -1,-0.2 -0.662 66.8 170.8-120.0 75.7 39.8 42.2 -7.3 72 72 A P T 3 S+ 0 0 88 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.737 80.4 50.5 -58.3 -17.9 43.1 43.9 -6.7 73 73 A N T 3 S+ 0 0 150 -3,-0.1 -5,-0.1 2,-0.1 3,-0.0 0.416 81.6 112.5-103.5 3.9 41.4 47.2 -7.1 74 74 A A S < S- 0 0 12 -3,-1.8 2,-0.6 -7,-0.1 -43,-0.2 -0.151 78.4 -96.8 -67.4 168.9 38.4 46.9 -4.7 75 75 A V E -e 31 0B 36 -45,-2.8 -43,-2.8 -49,-0.1 2,-0.7 -0.820 38.1-158.2 -91.4 120.5 38.2 49.0 -1.5 76 76 A Y E +e 32 0B 37 -2,-0.6 -43,-0.2 -45,-0.2 -45,-0.1 -0.883 14.3 178.2-106.6 112.2 39.5 47.1 1.4 77 77 A L E -e 33 0B 38 -45,-2.5 -43,-4.0 -2,-0.7 2,-0.2 -0.856 28.5-117.6-113.8 142.8 38.4 48.2 4.9 78 78 A P E -e 34 0B 71 0, 0.0 -43,-0.2 0, 0.0 2,-0.1 -0.497 43.0 -94.7 -77.1 145.9 39.1 46.8 8.3 79 79 A M - 0 0 73 -45,-3.0 2,-0.4 -2,-0.2 -43,-0.1 -0.385 33.0-168.6 -62.5 131.0 36.2 45.5 10.3 80 80 A R > + 0 0 106 1,-0.2 4,-2.0 -2,-0.1 3,-0.3 -0.679 12.9 172.7-120.5 72.4 34.7 48.1 12.8 81 81 A K H > S+ 0 0 85 -2,-0.4 4,-2.9 1,-0.2 5,-0.2 0.856 71.0 53.5 -47.1 -53.8 32.4 45.8 14.8 82 82 A E H > S+ 0 0 132 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.899 109.4 49.1 -55.1 -45.5 31.4 48.3 17.5 83 83 A V H > S+ 0 0 49 -3,-0.3 4,-2.0 2,-0.2 5,-0.2 0.965 112.1 47.9 -59.5 -52.1 30.3 50.9 15.0 84 84 A Y H X S+ 0 0 0 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.918 109.6 54.8 -54.8 -45.0 28.2 48.3 13.1 85 85 A Q H X S+ 0 0 61 -4,-2.9 4,-2.6 1,-0.2 -1,-0.2 0.914 107.2 48.7 -54.5 -48.1 26.7 47.1 16.4 86 86 A Q H X S+ 0 0 129 -4,-2.3 4,-1.7 1,-0.2 -1,-0.2 0.854 111.4 49.7 -64.2 -33.8 25.5 50.6 17.3 87 87 A V H X S+ 0 0 9 -4,-2.0 4,-1.6 2,-0.2 -1,-0.2 0.900 109.9 52.8 -70.3 -37.7 24.0 51.1 13.8 88 88 A S H X S+ 0 0 2 -4,-2.5 4,-2.6 -5,-0.2 -2,-0.2 0.943 107.4 51.2 -60.3 -50.0 22.3 47.7 14.3 89 89 A S H X S+ 0 0 52 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.890 105.3 53.8 -56.9 -46.3 20.8 48.7 17.6 90 90 A R H X S+ 0 0 110 -4,-1.7 4,-1.7 1,-0.2 -1,-0.2 0.923 112.4 46.1 -58.1 -40.7 19.3 52.0 16.4 91 91 A I H X S+ 0 0 0 -4,-1.6 4,-2.2 1,-0.2 -2,-0.2 0.907 107.0 56.0 -68.7 -41.0 17.6 50.0 13.7 92 92 A M H X S+ 0 0 3 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.880 105.7 54.6 -58.3 -34.4 16.4 47.3 16.1 93 93 A N H X S+ 0 0 81 -4,-2.3 4,-0.5 2,-0.2 -1,-0.2 0.929 104.1 53.3 -64.4 -44.0 14.7 50.1 18.0 94 94 A L H >< S+ 0 0 25 -4,-1.7 3,-1.5 1,-0.2 -2,-0.2 0.938 111.6 45.6 -54.6 -48.7 12.9 51.2 14.9 95 95 A L H >< S+ 0 0 0 -4,-2.2 3,-2.3 1,-0.3 4,-0.4 0.872 100.4 67.6 -61.3 -38.8 11.5 47.7 14.5 96 96 A R H 3< S+ 0 0 103 -4,-2.2 3,-0.3 1,-0.3 -1,-0.3 0.636 92.3 64.8 -57.7 -12.7 10.7 47.6 18.2 97 97 A E T << S+ 0 0 152 -3,-1.5 -1,-0.3 -4,-0.5 -2,-0.2 0.130 97.9 52.5 -97.6 18.4 8.1 50.2 17.3 98 98 A Y S < S+ 0 0 38 -3,-2.3 2,-0.2 1,-0.4 -1,-0.2 0.353 124.8 0.2-128.5 -3.8 6.2 47.8 15.1 99 99 A S - 0 0 0 -4,-0.4 -1,-0.4 -3,-0.3 15,-0.1 -0.746 47.1-145.4 176.0 136.2 5.8 45.0 17.6 100 100 A E S S+ 0 0 141 -2,-0.2 2,-1.6 1,-0.2 -1,-0.1 0.748 92.5 81.5 -78.5 -25.6 6.7 44.3 21.2 101 101 A K + 0 0 98 12,-0.4 12,-2.7 -3,-0.1 2,-0.4 -0.649 67.6 148.2 -82.6 87.5 7.1 40.6 20.2 102 102 A I E -C 112 0A 3 -2,-1.6 2,-0.5 10,-0.2 10,-0.2 -0.979 34.2-164.6-129.6 137.8 10.6 41.0 18.7 103 103 A E E -C 111 0A 15 8,-2.7 8,-2.5 -2,-0.4 2,-1.2 -0.935 9.5-155.8-124.5 106.5 13.5 38.5 18.5 104 104 A I E +C 110 0A 64 -2,-0.5 6,-0.2 6,-0.2 139,-0.2 -0.726 18.3 177.7 -81.2 101.3 16.9 40.0 17.7 105 105 A A E - 0 0 18 -2,-1.2 2,-0.3 4,-0.7 -1,-0.2 0.690 58.5 -19.2 -81.2 -23.2 18.5 36.8 16.3 106 106 A S E > S-C 109 0A 46 3,-1.3 3,-0.7 -3,-0.1 -1,-0.1 -0.935 87.4 -65.8-166.4-175.5 21.8 38.3 15.4 107 107 A I T 3 S+ 0 0 34 -2,-0.3 3,-0.0 1,-0.2 -3,-0.0 0.654 129.6 18.9 -63.3 -16.4 23.6 41.6 14.7 108 108 A D T 3 S+ 0 0 27 -17,-0.0 -97,-2.6 1,-0.0 2,-0.3 0.190 114.3 65.1-141.7 22.0 21.6 42.3 11.5 109 109 A E E < +AC 10 106A 28 -3,-0.7 -3,-1.3 -99,-0.2 -4,-0.7 -0.980 47.1 170.1-143.0 157.2 18.4 40.2 11.6 110 110 A A E -AC 9 104A 0 -101,-1.4 -101,-2.4 -2,-0.3 2,-0.4 -0.970 24.6-131.7-163.9 148.9 15.2 40.0 13.7 111 111 A Y E -AC 8 103A 20 -8,-2.5 -8,-2.7 -2,-0.3 2,-0.5 -0.856 17.3-161.6-106.3 141.2 11.8 38.3 13.8 112 112 A L E -AC 7 102A 0 -105,-2.5 -105,-2.6 -2,-0.4 2,-1.0 -0.987 14.6-143.2-122.9 127.7 8.7 40.2 14.5 113 113 A D E +A 6 0A 15 -12,-2.7 -12,-0.4 -2,-0.5 3,-0.2 -0.802 30.0 166.1 -87.7 106.4 5.5 38.6 15.6 114 114 A I >> + 0 0 0 -109,-2.3 3,-1.3 -2,-1.0 4,-0.6 -0.093 31.7 122.0-112.3 32.9 2.9 40.7 13.8 115 115 A S T 34 S+ 0 0 10 1,-0.3 3,-0.2 2,-0.2 -1,-0.2 0.825 81.7 38.4 -63.7 -33.5 -0.0 38.3 14.2 116 116 A D T 34 S+ 0 0 105 -3,-0.2 -1,-0.3 1,-0.2 3,-0.1 -0.154 109.7 60.5-111.6 38.3 -2.1 41.0 16.0 117 117 A K T <4 S+ 0 0 67 -3,-1.3 2,-0.3 1,-0.4 -2,-0.2 0.306 113.5 21.5-134.9 -6.6 -1.0 44.0 13.9 118 118 A V < - 0 0 17 -4,-0.6 -1,-0.4 -3,-0.2 2,-0.4 -0.985 60.2-146.1-160.1 156.9 -2.3 42.6 10.7 119 119 A R S > S+ 0 0 151 -2,-0.3 4,-0.6 1,-0.2 5,-0.1 -0.998 73.7 3.8-130.2 133.7 -4.8 40.1 9.2 120 120 A D H > S- 0 0 85 -2,-0.4 4,-0.7 1,-0.1 3,-0.2 0.267 91.2 -87.6 70.3 154.4 -4.0 38.3 6.0 121 121 A Y H > S+ 0 0 35 1,-0.2 4,-3.6 2,-0.2 5,-0.3 0.730 117.2 71.7 -70.4 -24.9 -0.6 38.7 4.2 122 122 A R H > S+ 0 0 147 1,-0.3 4,-2.4 2,-0.2 5,-0.2 0.960 102.0 44.7 -56.1 -51.2 -1.6 41.7 2.1 123 123 A E H X S+ 0 0 76 -4,-0.6 4,-1.6 -3,-0.2 -1,-0.3 0.812 114.3 52.9 -61.3 -29.0 -1.5 43.9 5.2 124 124 A A H X S+ 0 0 0 -4,-0.7 4,-1.7 2,-0.2 -2,-0.2 0.968 106.8 48.8 -69.4 -55.6 1.7 42.1 6.1 125 125 A Y H X S+ 0 0 94 -4,-3.6 4,-1.9 1,-0.3 3,-0.3 0.896 112.9 49.1 -51.2 -44.9 3.4 42.8 2.8 126 126 A N H X S+ 0 0 65 -4,-2.4 4,-1.9 -5,-0.3 -1,-0.3 0.885 107.7 53.8 -65.2 -37.6 2.4 46.5 3.1 127 127 A L H X S+ 0 0 16 -4,-1.6 4,-2.0 -5,-0.2 -1,-0.2 0.773 107.1 53.9 -67.0 -24.3 3.7 46.6 6.6 128 128 A G H X S+ 0 0 0 -4,-1.7 4,-3.6 -3,-0.3 5,-0.2 0.911 107.3 47.1 -74.9 -44.0 7.0 45.3 5.2 129 129 A L H X S+ 0 0 75 -4,-1.9 4,-2.7 1,-0.2 5,-0.2 0.870 111.7 55.1 -63.0 -34.3 7.3 48.0 2.6 130 130 A E H X S+ 0 0 106 -4,-1.9 4,-2.1 -5,-0.2 -2,-0.2 0.943 113.0 39.7 -63.0 -49.0 6.5 50.3 5.5 131 131 A I H X S+ 0 0 2 -4,-2.0 4,-2.7 2,-0.2 5,-0.3 0.935 115.7 50.1 -69.0 -47.8 9.4 49.0 7.6 132 132 A K H X S+ 0 0 26 -4,-3.6 4,-2.7 1,-0.2 5,-0.3 0.980 115.1 45.1 -52.2 -58.2 11.8 48.7 4.7 133 133 A N H X S+ 0 0 88 -4,-2.7 4,-2.2 -5,-0.2 -1,-0.2 0.842 111.3 53.6 -54.0 -39.9 11.0 52.3 3.7 134 134 A K H X S+ 0 0 70 -4,-2.1 4,-2.7 -5,-0.2 5,-0.2 0.982 111.5 43.6 -60.7 -57.3 11.2 53.5 7.3 135 135 A I H X>S+ 0 0 1 -4,-2.7 4,-3.1 1,-0.2 5,-0.8 0.910 112.7 51.8 -54.2 -49.9 14.7 52.1 7.9 136 136 A L H X5S+ 0 0 83 -4,-2.7 4,-1.6 -5,-0.3 -1,-0.2 0.937 113.0 48.0 -53.8 -46.2 16.0 53.3 4.6 137 137 A E H <5S+ 0 0 117 -4,-2.2 -2,-0.2 -5,-0.3 -1,-0.2 0.957 118.8 35.4 -60.1 -55.6 14.7 56.7 5.5 138 138 A K H <5S+ 0 0 131 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.837 139.6 11.8 -71.9 -37.1 16.1 57.0 9.0 139 139 A E H <5S- 0 0 38 -4,-3.1 -3,-0.2 -5,-0.2 -2,-0.2 0.408 91.6-123.8-122.9 -0.6 19.4 55.2 8.6 140 140 A K << + 0 0 150 -4,-1.6 2,-0.5 -5,-0.8 -4,-0.2 0.837 63.6 142.1 59.3 33.6 19.8 54.9 4.8 141 141 A I - 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