==== 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 TRANSCRIPTION 25-MAY-07 2Q1Z . COMPND 2 MOLECULE: RPOE, ECF SIGE; . SOURCE 2 ORGANISM_SCIENTIFIC: RHODOBACTER SPHAEROIDES; . AUTHOR E.A.CAMPBELL,S.A.DARST . 706 7 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 28544.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 461 65.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 79 11.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 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 . 43 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 61 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 256 36.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 0.8 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 0 2 1 2 0 5 2 2 1 2 0 0 0 3 1 3 0 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 4 3 2 2 2 2 2 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 . 0 0 2 0 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 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 5 A S 0 0 119 0, 0.0 2,-0.2 0, 0.0 5,-0.0 0.000 360.0 360.0 360.0 167.9 44.5 4.6 170.7 2 6 A D > - 0 0 107 3,-0.1 3,-1.1 0, 0.0 7,-0.1 -0.709 360.0 -84.8-160.5 166.2 42.4 1.9 169.1 3 7 A R T 3 S+ 0 0 146 1,-0.2 0, 0.0 -2,-0.2 0, 0.0 0.524 131.0 45.4 -66.8 -1.5 41.1 1.1 165.6 4 8 A T T 3 S+ 0 0 82 24,-0.0 2,-1.1 1,-0.0 -1,-0.2 0.124 75.3 109.3-141.9 7.1 38.3 3.5 166.5 5 9 A D <> - 0 0 61 -3,-1.1 4,-2.0 1,-0.2 3,-0.3 -0.785 46.6-176.0 -98.0 88.5 40.1 6.5 168.0 6 10 A W H > S+ 0 0 43 -2,-1.1 4,-2.3 1,-0.2 -1,-0.2 0.790 74.2 55.8 -66.5 -36.4 39.5 8.9 165.1 7 11 A V H > S+ 0 0 20 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.924 111.3 44.5 -62.5 -46.0 41.4 11.9 166.4 8 12 A A H > S+ 0 0 27 -3,-0.3 4,-1.9 2,-0.2 -2,-0.2 0.882 112.0 52.3 -65.7 -41.5 44.6 9.8 166.7 9 13 A L H X S+ 0 0 17 -4,-2.0 4,-2.9 1,-0.2 -1,-0.2 0.882 107.4 53.8 -59.0 -41.7 44.0 8.2 163.3 10 14 A M H X S+ 0 0 2 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.804 108.9 47.4 -59.5 -37.0 43.7 11.7 161.9 11 15 A R H X S+ 0 0 45 -4,-1.4 4,-3.7 2,-0.2 5,-0.3 0.777 109.7 54.4 -75.6 -30.3 47.0 12.7 163.4 12 16 A A H X S+ 0 0 17 -4,-1.9 4,-1.9 2,-0.2 6,-1.5 0.950 108.6 47.5 -66.9 -46.4 48.5 9.4 162.0 13 17 A I H X S+ 0 0 0 -4,-2.9 4,-1.3 4,-0.2 -2,-0.2 0.982 120.6 41.0 -46.7 -58.1 47.2 10.5 158.5 14 18 A R H < S+ 0 0 60 -4,-2.2 -2,-0.2 1,-0.2 -3,-0.2 0.872 121.7 35.0 -61.1 -54.4 48.7 13.9 159.2 15 19 A D H < S+ 0 0 89 -4,-3.7 -1,-0.2 1,-0.1 -3,-0.2 0.717 135.3 17.6 -77.4 -25.6 52.1 13.1 160.8 16 20 A H H < S- 0 0 143 -4,-1.9 3,-0.2 -5,-0.3 -2,-0.2 0.300 92.5-116.1-132.9 15.7 53.0 9.9 159.0 17 21 A R < - 0 0 55 -4,-1.3 2,-0.5 1,-0.2 -4,-0.2 0.880 47.9-168.6 31.3 51.1 50.9 9.7 155.8 18 22 A D > - 0 0 60 -6,-1.5 4,-1.3 1,-0.2 -1,-0.2 -0.507 17.8-178.4 -72.0 110.1 49.4 6.6 157.6 19 23 A E H > S+ 0 0 38 -2,-0.5 4,-2.2 2,-0.2 -1,-0.2 0.862 83.1 53.9 -86.3 -39.0 47.4 4.7 155.0 20 24 A A H > S+ 0 0 70 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.852 108.1 54.2 -56.7 -36.3 46.2 1.9 157.3 21 25 A A H > S+ 0 0 3 1,-0.2 4,-1.4 2,-0.2 -2,-0.2 0.914 107.8 49.2 -60.0 -45.5 45.0 4.8 159.5 22 26 A F H X S+ 0 0 0 -4,-1.3 4,-2.6 2,-0.2 -2,-0.2 0.813 104.4 58.7 -62.8 -38.0 43.1 6.1 156.4 23 27 A A H X S+ 0 0 25 -4,-2.2 4,-2.9 1,-0.2 5,-0.2 0.926 105.9 49.7 -56.3 -43.4 41.6 2.6 155.9 24 28 A E H X S+ 0 0 42 -4,-1.7 4,-1.4 2,-0.2 -2,-0.2 0.890 113.1 44.8 -61.8 -44.2 40.1 2.8 159.4 25 29 A L H X S+ 0 0 0 -4,-1.4 4,-3.2 2,-0.2 5,-0.3 0.895 116.7 46.2 -68.5 -45.0 38.5 6.2 158.9 26 30 A F H X S+ 0 0 9 -4,-2.6 4,-2.7 2,-0.2 -2,-0.2 0.934 110.2 51.5 -58.3 -57.1 37.2 5.3 155.4 27 31 A Q H < S+ 0 0 123 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.834 120.2 36.8 -56.0 -34.4 35.7 2.0 156.4 28 32 A H H X S+ 0 0 40 -4,-1.4 4,-0.5 -5,-0.2 -2,-0.2 0.947 127.6 30.2 -80.5 -51.0 33.9 3.7 159.3 29 33 A F H X S+ 0 0 0 -4,-3.2 4,-2.8 -5,-0.2 5,-0.2 0.759 104.3 69.5 -91.8 -22.4 32.9 7.1 157.8 30 34 A A H X S+ 0 0 0 -4,-2.7 4,-2.7 -5,-0.3 -1,-0.2 0.917 104.2 43.4 -60.6 -45.1 32.4 6.4 154.1 31 35 A P H > S+ 0 0 22 0, 0.0 204,-2.7 0, 0.0 4,-2.1 0.767 115.7 51.5 -68.8 -23.4 29.2 4.3 154.6 32 36 A K H X S+ 0 0 21 -4,-0.5 4,-2.0 202,-0.2 -2,-0.2 0.845 110.1 46.5 -80.6 -40.1 28.0 6.9 157.1 33 37 A V H X S+ 0 0 0 -4,-2.8 4,-2.4 2,-0.2 5,-0.3 0.938 113.8 50.9 -62.0 -50.1 28.6 9.8 154.7 34 38 A K H X S+ 0 0 15 -4,-2.7 4,-1.6 -5,-0.2 -2,-0.2 0.950 112.5 44.6 -48.4 -56.3 26.9 7.7 152.0 35 39 A G H X S+ 0 0 4 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.858 113.5 52.7 -58.8 -37.8 23.8 7.1 154.3 36 40 A F H X S+ 0 0 4 -4,-2.0 4,-1.5 2,-0.2 -1,-0.2 0.938 107.5 47.6 -63.1 -51.5 23.8 10.7 155.4 37 41 A L H <>S+ 0 0 0 -4,-2.4 5,-2.9 2,-0.2 -1,-0.2 0.768 109.3 56.8 -63.7 -30.5 23.7 12.2 151.8 38 42 A M H ><5S+ 0 0 54 -4,-1.6 3,-1.5 -5,-0.3 -1,-0.2 0.913 105.7 47.5 -67.7 -44.2 20.9 9.8 150.9 39 43 A K H 3<5S+ 0 0 92 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.821 107.3 61.1 -61.6 -27.8 18.9 11.1 153.8 40 44 A S T 3<5S- 0 0 30 -4,-1.5 -1,-0.2 -5,-0.1 -2,-0.2 0.448 133.0 -90.6 -74.2 -2.9 19.8 14.6 152.4 41 45 A G T < 5S+ 0 0 66 -3,-1.5 -3,-0.2 1,-0.3 2,-0.2 0.442 82.6 135.7 107.9 -0.5 18.1 13.7 149.1 42 46 A S < - 0 0 34 -5,-2.9 -1,-0.3 -6,-0.1 2,-0.3 -0.517 54.6-119.0 -78.6 146.4 20.9 12.1 147.1 43 47 A V >> - 0 0 109 -2,-0.2 4,-2.2 1,-0.1 3,-1.3 -0.657 33.1-107.9 -83.2 145.3 20.6 8.9 145.1 44 48 A A H 3> S+ 0 0 45 -2,-0.3 4,-2.0 1,-0.3 5,-0.2 0.708 115.7 53.6 -42.0 -41.8 22.9 6.0 146.2 45 49 A S H 3> S+ 0 0 76 2,-0.2 4,-1.5 1,-0.2 -1,-0.3 0.873 114.6 40.1 -65.6 -44.3 25.3 6.3 143.2 46 50 A Q H <> S+ 0 0 127 -3,-1.3 4,-1.8 2,-0.2 -2,-0.2 0.807 112.8 55.1 -76.4 -36.1 26.0 10.0 143.7 47 51 A A H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.845 109.4 48.4 -62.6 -40.0 26.1 9.7 147.5 48 52 A E H X S+ 0 0 28 -4,-2.0 4,-2.0 -5,-0.2 -2,-0.2 0.908 110.6 50.9 -62.5 -46.4 28.8 6.9 147.1 49 53 A E H X S+ 0 0 101 -4,-1.5 4,-1.6 2,-0.2 -2,-0.2 0.890 114.1 44.3 -57.4 -41.6 30.7 9.1 144.7 50 54 A C H X S+ 0 0 26 -4,-1.8 4,-3.4 2,-0.2 -2,-0.2 0.922 109.2 54.5 -72.8 -50.5 30.6 12.0 147.2 51 55 A A H X S+ 0 0 0 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.852 110.7 49.1 -45.1 -44.5 31.5 9.9 150.3 52 56 A Q H X S+ 0 0 19 -4,-2.0 4,-1.2 2,-0.2 -2,-0.2 0.876 112.0 46.6 -66.4 -42.9 34.5 8.8 148.3 53 57 A D H X S+ 0 0 95 -4,-1.6 4,-1.7 2,-0.2 -2,-0.2 0.853 110.2 54.4 -67.2 -39.0 35.4 12.4 147.4 54 58 A V H X S+ 0 0 6 -4,-3.4 4,-1.7 1,-0.2 3,-0.3 0.951 109.1 47.1 -56.4 -49.9 34.9 13.4 151.1 55 59 A M H X S+ 0 0 0 -4,-2.0 4,-1.0 1,-0.3 -1,-0.2 0.762 109.1 54.9 -68.2 -27.1 37.3 10.8 152.3 56 60 A A H X S+ 0 0 29 -4,-1.2 4,-1.7 2,-0.2 -1,-0.3 0.799 108.1 48.8 -71.6 -35.8 39.8 11.9 149.6 57 61 A T H X S+ 0 0 26 -4,-1.7 4,-3.5 -3,-0.3 -2,-0.2 0.818 104.1 61.6 -68.0 -31.5 39.6 15.5 150.9 58 62 A V H < S+ 0 0 0 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.864 109.0 41.5 -65.9 -39.5 40.1 14.1 154.5 59 63 A W H < S+ 0 0 0 -4,-1.0 3,-0.4 2,-0.2 -1,-0.2 0.873 118.7 45.3 -73.1 -43.7 43.5 12.8 153.4 60 64 A Q H < S+ 0 0 105 -4,-1.7 3,-0.3 1,-0.2 -2,-0.2 0.905 124.2 31.9 -64.6 -48.9 44.4 15.9 151.4 61 65 A K S >X S+ 0 0 84 -4,-3.5 3,-1.9 1,-0.2 4,-0.5 0.170 76.6 125.6 -97.8 15.1 43.3 18.5 153.9 62 66 A A G >4 + 0 0 1 -3,-0.4 3,-0.8 1,-0.3 -1,-0.2 0.723 69.2 65.0 -47.9 -24.4 44.1 16.5 157.0 63 67 A H G 34 S+ 0 0 77 -3,-0.3 38,-0.4 1,-0.2 -1,-0.3 0.900 92.1 61.8 -66.2 -40.2 46.2 19.4 158.1 64 68 A L G <4 S+ 0 0 21 -3,-1.9 2,-0.5 36,-0.1 -1,-0.2 0.615 80.2 106.0 -59.5 -17.3 43.1 21.6 158.4 65 69 A F << - 0 0 8 -3,-0.8 36,-0.1 -4,-0.5 7,-0.1 -0.586 47.1-178.2 -77.3 122.9 41.7 19.3 161.1 66 70 A D >> - 0 0 6 -2,-0.5 3,-1.9 5,-0.1 4,-1.2 -0.934 14.8-165.9-122.7 103.4 41.8 20.8 164.6 67 71 A P T 34 S+ 0 0 1 0, 0.0 48,-0.1 0, 0.0 49,-0.1 0.412 85.7 69.3 -75.3 4.2 40.5 18.6 167.4 68 72 A S T 34 S+ 0 0 0 47,-0.1 100,-0.2 1,-0.1 101,-0.1 0.470 113.7 30.5 -86.9 -4.7 40.4 21.5 169.9 69 73 A R T <4 S+ 0 0 42 -3,-1.9 2,-0.3 1,-0.3 96,-0.1 0.560 127.4 14.4-125.7 -19.8 37.5 22.8 167.7 70 74 A A < - 0 0 17 -4,-1.2 -1,-0.3 152,-0.0 2,-0.2 -0.980 62.2-118.5-152.7 159.0 35.8 19.7 166.3 71 75 A S > - 0 0 9 -2,-0.3 4,-1.8 -3,-0.1 5,-0.1 -0.479 42.2-109.0 -82.6 168.8 35.4 16.0 166.5 72 76 A V H > S+ 0 0 3 2,-0.2 4,-3.6 -2,-0.2 3,-0.2 0.968 120.7 54.8 -62.1 -55.0 36.4 14.0 163.4 73 77 A A H > S+ 0 0 8 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.864 110.0 48.4 -41.1 -47.6 32.7 13.2 162.6 74 78 A T H > S+ 0 0 5 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.902 113.0 44.7 -64.2 -45.3 32.0 17.0 162.7 75 79 A W H X S+ 0 0 25 -4,-1.8 4,-2.2 -3,-0.2 5,-0.2 0.967 114.0 50.0 -67.1 -47.6 34.9 17.9 160.4 76 80 A I H X S+ 0 0 0 -4,-3.6 4,-2.4 1,-0.2 -2,-0.2 0.953 111.3 49.6 -54.2 -54.1 34.1 15.1 158.0 77 81 A F H X S+ 0 0 2 -4,-2.7 4,-3.2 2,-0.2 5,-0.3 0.929 105.2 57.5 -40.6 -63.9 30.4 16.3 158.0 78 82 A T H X S+ 0 0 23 -4,-2.8 4,-1.6 1,-0.2 -1,-0.2 0.919 108.6 46.2 -30.1 -57.7 31.6 19.9 157.3 79 83 A I H < S+ 0 0 8 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.920 114.4 49.7 -57.3 -44.5 33.4 18.5 154.2 80 84 A A H >< S+ 0 0 0 -4,-2.4 3,-0.8 -5,-0.2 -2,-0.2 0.911 112.8 44.6 -64.6 -46.0 30.1 16.5 153.3 81 85 A R H 3< S+ 0 0 12 -4,-3.2 -1,-0.2 1,-0.2 -2,-0.2 0.694 106.0 60.8 -70.9 -23.0 27.8 19.5 153.7 82 86 A N T 3< S+ 0 0 2 -4,-1.6 11,-2.0 -5,-0.3 -1,-0.2 0.338 78.5 116.2 -89.5 1.1 30.0 22.0 151.8 83 87 A R S < S- 0 0 34 -3,-0.8 2,-0.5 9,-0.2 10,-0.3 -0.224 82.4 -83.5 -55.1 163.3 29.8 20.0 148.6 84 88 A R - 0 0 115 8,-0.2 2,-0.6 6,-0.1 8,-0.2 -0.638 35.2-168.4 -71.3 121.0 28.1 21.6 145.7 85 89 A I >> - 0 0 53 -2,-0.5 3,-2.0 6,-0.4 4,-1.5 -0.985 22.5-144.5-102.3 111.7 24.3 21.3 145.7 86 90 A D T 34 S+ 0 0 108 -2,-0.6 206,-0.4 1,-0.3 3,-0.1 0.793 92.2 50.3 -53.9 -44.0 23.8 22.5 142.1 87 91 A G T 34 S+ 0 0 60 1,-0.2 -1,-0.3 204,-0.1 206,-0.1 0.614 117.9 42.1 -71.4 -11.9 20.5 24.4 142.6 88 92 A L T <4 S+ 0 0 47 -3,-2.0 110,-3.0 1,-0.3 2,-0.3 0.669 123.8 3.5-104.1 -24.4 22.0 26.3 145.5 89 93 A R < - 0 0 0 -4,-1.5 -1,-0.3 108,-0.2 203,-0.1 -0.989 53.4-125.9-165.9 155.8 25.5 27.1 144.4 90 94 A K S S- 0 0 94 -2,-0.3 2,-0.2 2,-0.1 -6,-0.1 0.496 95.0 -6.8 -85.3 -12.1 28.1 27.1 141.5 91 95 A D S S- 0 0 101 -6,-0.1 -6,-0.4 1,-0.1 2,-0.1 -0.740 108.9 -27.3-156.2-160.0 30.8 25.3 143.6 92 96 A R S S- 0 0 90 -2,-0.2 -9,-0.2 -8,-0.2 -8,-0.2 -0.344 82.2 -82.5 -62.4 150.4 31.5 24.2 147.2 93 97 A Q - 0 0 2 -11,-2.0 -1,-0.2 -10,-0.3 2,-0.1 -0.288 53.3 -99.0 -59.4 129.8 29.7 26.2 149.9 94 98 A P - 0 0 8 0, 0.0 -1,-0.1 0, 0.0 111,-0.1 -0.331 49.3-170.3 -46.2 119.8 31.6 29.4 150.8 95 99 A E - 0 0 63 -3,-0.1 3,-0.1 1,-0.1 110,-0.0 -0.900 22.4-100.9-116.8 152.0 33.5 28.5 153.9 96 100 A P - 0 0 22 0, 0.0 110,-0.1 0, 0.0 3,-0.1 -0.091 56.5 -61.9 -66.9 165.9 35.4 30.9 156.1 97 101 A E - 0 0 81 108,-0.3 2,-0.7 1,-0.1 113,-0.0 -0.006 61.7-104.6 -37.2 142.3 39.2 31.6 156.2 98 102 A D - 0 0 80 163,-0.1 2,-0.6 -3,-0.1 -1,-0.1 -0.722 36.1-176.0 -87.5 120.3 41.3 28.5 157.1 99 103 A L + 0 0 10 -2,-0.7 2,-0.3 -35,-0.1 -33,-0.1 -0.953 20.9 155.1-109.9 106.9 42.6 28.6 160.6 100 104 A F - 0 0 78 -2,-0.6 2,-0.4 72,-0.1 -36,-0.1 -0.922 49.3-102.1-128.0 158.0 44.8 25.6 161.1 101 105 A W - 0 0 31 -38,-0.4 5,-0.0 -2,-0.3 -36,-0.0 -0.689 47.8-116.1 -74.0 132.0 47.7 24.8 163.4 102 106 A G - 0 0 19 -2,-0.4 -1,-0.1 1,-0.1 74,-0.0 0.079 40.2 -83.6 -58.4-179.2 50.9 25.0 161.4 103 107 A P S S+ 0 0 145 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.652 126.9 51.5 -70.7 -11.9 53.1 22.0 160.8 104 108 A D S S+ 0 0 111 1,-0.1 -3,-0.1 2,-0.0 0, 0.0 0.517 92.6 54.1 -82.6-123.1 54.4 22.9 164.2 105 109 A S - 0 0 51 1,-0.1 -1,-0.1 70,-0.0 3,-0.1 0.336 56.1-155.5 -38.5 123.9 52.1 23.5 167.2 106 110 A E - 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0 0 17 -4,-0.6 36,-0.3 -3,-0.2 7,-0.1 -0.124 50.8-170.7 -45.7 134.4 32.9 16.2 195.9 430 70 C D >> - 0 0 8 5,-0.1 3,-1.7 34,-0.1 4,-0.6 -0.916 10.2-162.7-131.8 109.4 33.8 17.2 199.4 431 71 C P T 34 S+ 0 0 5 0, 0.0 48,-0.1 0, 0.0 5,-0.1 0.452 88.4 61.7 -72.1 -3.6 31.1 16.2 202.0 432 72 C S T 34 S+ 0 0 1 1,-0.1 94,-0.2 47,-0.1 3,-0.1 0.439 109.4 41.6 -98.5 -2.9 32.6 18.6 204.6 433 73 C R T <4 S- 0 0 44 -3,-1.7 2,-0.3 1,-0.2 143,-0.1 0.418 127.9 -4.8-118.2 -4.9 31.9 21.6 202.3 434 74 C A < - 0 0 14 -4,-0.6 2,-0.2 141,-0.1 -1,-0.2 -0.969 68.8 -97.3-166.0 179.0 28.5 20.6 201.0 435 75 C S > - 0 0 8 -2,-0.3 4,-3.1 -3,-0.1 5,-0.2 -0.660 39.9-109.7-102.9 169.0 25.7 18.0 200.9 436 76 C V H > S+ 0 0 2 -2,-0.2 4,-1.9 2,-0.2 5,-0.1 0.868 122.8 48.4 -66.6 -35.3 25.2 15.5 198.1 437 77 C A H > S+ 0 0 8 2,-0.2 4,-3.5 3,-0.2 5,-0.3 0.973 112.1 47.7 -64.9 -54.4 22.1 17.5 197.0 438 78 C T H > S+ 0 0 1 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.948 113.3 48.0 -50.9 -55.3 23.9 20.8 197.1 439 79 C W H X S+ 0 0 28 -4,-3.1 4,-1.1 1,-0.2 -1,-0.2 0.865 113.7 47.2 -54.1 -40.9 26.9 19.4 195.1 440 80 C I H X S+ 0 0 0 -4,-1.9 4,-1.8 2,-0.2 3,-0.2 0.862 108.5 54.3 -71.1 -36.1 24.5 17.9 192.6 441 81 C F H X S+ 0 0 2 -4,-3.5 4,-2.2 1,-0.2 5,-0.3 0.864 103.4 60.3 -55.8 -36.2 22.6 21.2 192.5 442 82 C T H X S+ 0 0 24 -4,-2.1 4,-1.1 -5,-0.3 -2,-0.2 0.852 107.4 41.8 -62.1 -37.9 26.1 22.6 191.7 443 83 C I H < S+ 0 0 9 -4,-1.1 -1,-0.2 -3,-0.2 -2,-0.2 0.805 113.2 56.1 -77.4 -29.1 26.3 20.5 188.5 444 84 C A H < S+ 0 0 2 -4,-1.8 -2,-0.2 2,-0.2 3,-0.2 0.815 111.0 39.6 -79.5 -31.1 22.7 21.2 187.6 445 85 C R H X S+ 0 0 14 -4,-2.2 4,-0.7 1,-0.2 3,-0.5 0.787 117.0 51.4 -83.8 -27.1 23.0 25.0 187.6 446 86 C N T < S+ 0 0 14 -4,-1.1 11,-0.3 -5,-0.3 -2,-0.2 0.428 118.5 40.8 -80.4 1.4 26.4 24.7 186.0 447 87 C R T 4 S+ 0 0 38 -3,-0.2 -1,-0.2 2,-0.1 -2,-0.2 0.228 104.8 57.3-138.9 10.1 24.7 22.5 183.4 448 88 C R T >4>S+ 0 0 24 -3,-0.5 5,-0.9 2,-0.1 3,-0.5 0.538 94.3 68.0-112.5 -19.6 21.3 24.0 182.6 449 89 C I T 3<5S+ 0 0 2 -4,-0.7 6,-2.3 1,-0.2 -3,-0.1 0.595 93.2 64.9 -70.6 -11.8 22.9 27.2 181.5 450 90 C D T 3 5S+ 0 0 2 4,-0.2 -291,-1.0 -291,-0.1 -292,-0.8 0.811 106.9 40.0 -78.0 -36.0 24.3 25.0 178.6 451 91 C G T < 5S+ 0 0 10 -3,-0.5 2,-4.3 -294,-0.2 -296,-0.1 -0.775 125.6 8.0-110.4 162.5 20.8 24.4 177.3 452 92 C L T 5S+ 0 0 88 -298,-0.3 2,-0.8 -2,-0.3 -3,-0.1 -0.237 135.1 51.0 63.4 -57.6 17.9 26.8 176.9 453 93 C R S > - 0 0 111 1,-0.2 4,-1.5 54,-0.1 3,-0.9 -0.178 45.0-126.9 -44.4 124.9 38.6 14.9 209.3 473 113 C Q H 3> S+ 0 0 75 1,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.767 106.6 59.3 -48.4 -30.7 35.5 12.7 210.0 474 114 C A H 3> S+ 0 0 38 2,-0.2 4,-2.7 1,-0.2 -1,-0.3 0.910 100.8 52.4 -69.6 -43.3 34.2 15.3 212.5 475 115 C D H <> S+ 0 0 51 -3,-0.9 4,-1.8 2,-0.2 5,-0.2 0.896 110.4 50.5 -57.0 -40.7 34.1 18.1 209.9 476 116 C V H X S+ 0 0 11 -4,-1.5 4,-2.1 1,-0.2 3,-0.3 0.954 112.0 45.8 -62.0 -53.1 32.0 15.7 207.7 477 117 C Y H < S+ 0 0 146 -4,-2.3 4,-0.4 1,-0.2 -1,-0.2 0.863 117.0 45.9 -52.2 -42.4 29.6 14.9 210.6 478 118 C E H X S+ 0 0 108 -4,-2.7 4,-1.7 2,-0.2 -1,-0.2 0.666 110.6 49.8 -85.2 -19.2 29.4 18.7 211.4 479 119 C M H X S+ 0 0 2 -4,-1.8 4,-1.2 -3,-0.3 -1,-0.2 0.822 112.5 47.9 -83.6 -33.9 28.8 20.0 207.9 480 120 C Q H X S+ 0 0 32 -4,-2.1 4,-1.7 -5,-0.2 -2,-0.2 0.681 111.5 54.5 -75.2 -16.4 26.1 17.5 207.3 481 121 C Q H > S+ 0 0 83 -4,-0.4 4,-1.6 2,-0.2 -2,-0.2 0.926 109.9 41.8 -80.0 -51.4 24.8 18.6 210.6 482 122 C E H X S+ 0 0 51 -4,-1.7 4,-1.1 1,-0.2 -2,-0.2 0.736 114.2 57.3 -66.0 -22.4 24.6 22.3 209.7 483 123 C N H X S+ 0 0 22 -4,-1.2 4,-1.9 2,-0.2 3,-0.2 0.928 105.4 46.4 -74.5 -43.6 23.3 21.1 206.4 484 124 C A H X S+ 0 0 50 -4,-1.7 4,-1.9 1,-0.2 -2,-0.2 0.803 111.7 54.4 -64.0 -28.8 20.3 19.2 208.0 485 125 C R H X S+ 0 0 117 -4,-1.6 4,-1.0 2,-0.2 -1,-0.2 0.793 107.6 48.6 -74.5 -30.1 19.7 22.3 210.1 486 126 C L H X S+ 0 0 12 -4,-1.1 4,-1.0 -3,-0.2 -2,-0.2 0.797 113.5 46.9 -79.2 -32.2 19.6 24.5 207.0 487 127 C G H X S+ 0 0 29 -4,-1.9 4,-1.7 2,-0.2 -2,-0.2 0.841 108.7 55.6 -71.8 -35.8 17.1 22.0 205.4 488 128 C R H < S+ 0 0 169 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.858 111.2 45.7 -61.6 -33.0 15.2 22.0 208.7 489 129 C A H < S+ 0 0 40 -4,-1.0 -1,-0.2 2,-0.2 -2,-0.2 0.691 108.1 53.2 -89.3 -22.6 14.9 25.8 208.4 490 130 C I H < 0 0 54 -4,-1.0 -2,-0.2 -3,-0.1 -1,-0.1 0.921 360.0 360.0 -78.5 -49.9 13.9 26.1 204.8 491 131 C A < 0 0 119 -4,-1.7 -2,-0.2 -5,-0.1 -3,-0.1 0.992 360.0 360.0 -67.5 360.0 10.9 23.7 205.0 492 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 493 139 C A > 0 0 81 0, 0.0 4,-1.6 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -60.4 8.5 32.1 197.6 494 140 C L H > + 0 0 59 2,-0.2 4,-1.8 1,-0.2 14,-0.1 0.952 360.0 43.0 -63.2 -51.2 11.4 34.6 197.6 495 141 C I H > S+ 0 0 45 1,-0.2 4,-1.3 2,-0.2 3,-0.3 0.952 111.7 52.9 -61.0 -53.7 14.1 31.9 197.8 496 142 C E H > S+ 0 0 54 1,-0.2 4,-1.0 2,-0.2 3,-0.4 0.883 109.5 51.9 -48.1 -40.4 12.5 29.6 195.2 497 143 C R H >X S+ 0 0 124 -4,-1.6 4,-1.3 1,-0.2 3,-0.6 0.887 100.9 60.7 -68.0 -39.6 12.4 32.6 192.9 498 144 C A H 3< S+ 0 0 19 -4,-1.8 4,-0.3 -3,-0.3 -1,-0.2 0.868 111.1 40.6 -51.4 -37.5 16.1 33.3 193.4 499 145 C F H 3< S+ 0 0 7 -4,-1.3 -1,-0.2 -3,-0.4 -2,-0.2 0.585 118.7 39.9-100.2 -11.2 16.9 29.9 192.0 500 146 C F H << S- 0 0 26 -4,-1.0 2,-0.2 -3,-0.6 -3,-0.1 0.868 128.3 -17.3 -99.7 -57.2 14.5 29.5 189.1 501 147 C G S < S+ 0 0 57 -4,-1.3 2,-0.3 -5,-0.2 -2,-0.1 -0.710 82.2 112.3-160.7 102.8 14.3 32.9 187.3 502 148 C D - 0 0 41 -4,-0.3 46,-0.1 -2,-0.2 44,-0.1 -0.903 50.2-115.1-170.1 142.2 15.3 36.3 188.7 503 149 C L > - 0 0 75 -2,-0.3 3,-0.7 1,-0.1 46,-0.1 0.265 47.6 -81.8 -68.8-165.6 18.0 39.0 187.9 504 150 C T T 3 S+ 0 0 46 1,-0.2 -1,-0.1 44,-0.1 39,-0.1 0.116 107.8 91.8 -85.7 22.8 20.9 40.2 190.0 505 151 C H T 3 S+ 0 0 97 35,-0.0 2,-0.4 1,-0.0 -1,-0.2 0.610 71.7 64.4 -99.2 -14.7 18.4 42.5 191.8 506 152 C R < - 0 0 66 -3,-0.7 2,-0.4 33,-0.2 3,-0.1 -0.919 45.5-176.3-122.6 140.5 17.2 40.5 194.8 507 153 C E > + 0 0 30 -2,-0.4 3,-1.0 1,-0.1 4,-0.4 -0.838 10.4 168.0-130.7 94.5 18.9 39.1 197.9 508 154 C L T 3 S+ 0 0 21 -2,-0.4 3,-0.4 1,-0.3 -1,-0.1 0.728 79.6 72.6 -74.7 -23.4 16.5 37.0 200.1 509 155 C A T 3 S+ 0 0 23 1,-0.2 -1,-0.3 4,-0.1 29,-0.0 0.599 90.3 68.6 -61.0 -8.8 19.6 35.8 202.0 510 156 C A S < S- 0 0 76 -3,-1.0 -1,-0.2 2,-0.1 -2,-0.2 0.942 122.9 -3.6 -76.2 -52.4 19.2 39.4 203.1 511 157 C E S S+ 0 0 86 -4,-0.4 2,-9.9 -3,-0.4 -3,-0.1 0.785 129.0 57.2-106.9 -78.3 16.0 39.1 205.2 512 158 C T S S+ 0 0 56 1,-0.1 2,-1.9 2,-0.1 -1,-0.1 0.073 88.8 174.2 -43.5 42.1 14.6 35.6 205.0 513 159 C G + 0 0 35 -2,-9.9 -1,-0.1 -3,-0.2 -4,-0.1 -0.461 30.2 149.3 -70.9 81.5 18.2 35.3 206.3 514 160 C L + 0 0 72 -2,-1.9 2,-1.6 2,-0.1 -1,-0.2 -0.295 29.6 144.5 -94.8 40.5 18.6 31.6 207.2 515 161 C P - 0 0 60 0, 0.0 2,-0.2 0, 0.0 -2,-0.1 -0.529 37.7-158.6 -83.8 64.0 22.2 32.5 206.2 516 162 C L - 0 0 41 -2,-1.6 -2,-0.1 1,-0.1 -30,-0.0 -0.596 11.5-147.2 -62.2 143.8 24.0 30.3 208.7 517 163 C G S > S+ 0 0 47 -2,-0.2 4,-0.8 2,-0.1 -1,-0.1 -0.321 72.6 60.9 147.6 -67.0 26.8 30.8 209.5 518 164 C T T 4 S+ 0 0 45 2,-0.2 -36,-0.1 3,-0.2 -2,-0.0 0.134 91.5 69.8-127.4 10.3 29.1 27.9 210.4 519 165 C I T > S+ 0 0 9 3,-0.2 4,-3.8 2,-0.1 5,-0.1 0.629 103.1 51.0 -87.2 -28.9 29.0 26.1 207.1 520 166 C K H > S+ 0 0 53 2,-0.2 4,-4.3 3,-0.2 -2,-0.2 0.993 121.5 28.6 -65.1 -63.3 31.0 29.2 206.1 521 167 C S H X S+ 0 0 64 -4,-0.8 4,-0.7 2,-0.3 -3,-0.2 0.796 125.1 51.0 -71.9 -27.6 33.5 28.9 208.9 522 168 C R H >> S+ 0 0 33 2,-0.2 4,-1.8 1,-0.1 3,-1.5 0.984 117.9 37.7 -60.8 -62.2 32.9 25.1 208.8 523 169 C I H 3X S+ 0 0 8 -4,-3.8 4,-1.4 1,-0.3 -2,-0.3 0.858 115.0 57.8 -53.8 -36.6 33.5 25.3 205.0 524 170 C R H 3X S+ 0 0 98 -4,-4.3 4,-0.8 1,-0.2 -1,-0.3 0.633 107.4 46.3 -75.1 -16.3 36.3 27.9 205.7 525 171 C L H > - 0 0 47 1,-0.1 4,-1.7 -2,-0.1 3,-1.7 -0.475 26.3-117.2 -68.8 132.9 27.7 41.9 197.1 538 9 D D H 3> S+ 0 0 56 1,-0.3 4,-2.4 2,-0.2 5,-0.3 0.876 117.6 65.0 -30.9 -48.2 25.4 39.3 198.5 539 10 D A H 3> S+ 0 0 29 1,-0.2 4,-1.5 2,-0.2 -1,-0.3 0.891 105.4 40.0 -45.5 -52.8 23.2 40.3 195.6 540 11 D L H <> S+ 0 0 12 -3,-1.7 4,-3.6 1,-0.2 3,-0.4 0.944 110.5 57.0 -65.6 -50.2 25.8 39.0 193.1 541 12 D L H X S+ 0 0 0 -4,-1.7 4,-3.5 1,-0.3 -1,-0.2 0.840 108.6 49.4 -48.0 -37.3 26.6 35.9 195.1 542 13 D T H X S+ 0 0 8 -4,-2.4 4,-1.0 -5,-0.3 -1,-0.3 0.863 112.0 46.5 -74.0 -37.0 22.9 35.0 195.0 543 14 D A H X>S+ 0 0 4 -4,-1.5 5,-2.3 -3,-0.4 4,-1.1 0.921 118.7 42.5 -69.7 -44.1 22.7 35.5 191.2 544 15 D Y H ><5S+ 0 0 2 -4,-3.6 3,-1.2 2,-0.2 -2,-0.2 0.978 113.9 50.8 -59.5 -58.1 25.9 33.5 190.8 545 16 D A H 3<5S+ 0 0 0 -4,-3.5 -1,-0.2 -5,-0.3 -2,-0.2 0.707 116.8 42.4 -55.5 -21.9 24.9 30.9 193.3 546 17 D A H 3<5S- 0 0 1 -4,-1.0 -1,-0.3 -5,-0.1 -2,-0.2 0.552 110.9-118.9-103.9 -12.9 21.5 30.6 191.4 547 18 D G T <<5S+ 0 0 3 -3,-1.2 -3,-0.2 -4,-1.1 -4,-0.1 0.801 80.9 112.8 81.2 32.6 22.9 30.7 187.8 548 19 D T < + 0 0 40 -5,-2.3 2,-0.5 -6,-0.1 -4,-0.2 0.141 47.1 108.0-116.1 16.7 21.2 33.8 186.5 549 20 D L S S- 0 0 8 -6,-0.6 5,-0.1 -5,-0.2 -46,-0.0 -0.852 75.8-113.4 -99.9 125.1 24.4 35.8 186.2 550 21 D S >> - 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