==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION 08-FEB-05 2BJV . COMPND 2 MOLECULE: PSP OPERON TRANSCRIPTIONAL ACTIVATOR; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR M.RAPPAS,J.SCHUMACHER,F.BEURON,H.NIWA,P.BORDES, . 236 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12604.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 160 67.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 23 9.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 1.3 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 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 15 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 22 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 85 36.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.3 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 2 0 2 1 0 0 2 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 0 3 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 PARALLEL BRIDGES PER LADDER . 0 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 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 10 A G 0 0 101 0, 0.0 169,-0.1 0, 0.0 6,-0.0 0.000 360.0 360.0 360.0 168.2 38.8 -36.6 -11.5 2 11 A E - 0 0 32 1,-0.1 5,-0.0 4,-0.1 164,-0.0 -0.083 360.0 -89.5 -65.4 159.1 37.1 -33.5 -13.1 3 12 A A > - 0 0 10 161,-0.1 4,-2.9 1,-0.1 3,-0.4 -0.175 36.2-106.5 -68.4 158.7 37.5 -32.7 -16.8 4 13 A N H > S+ 0 0 130 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.880 120.0 53.9 -50.2 -46.9 40.3 -30.5 -18.2 5 14 A S H > S+ 0 0 39 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.880 113.2 43.6 -60.7 -40.1 37.9 -27.5 -18.8 6 15 A F H > S+ 0 0 42 -3,-0.4 4,-2.1 2,-0.2 -2,-0.2 0.891 111.2 53.0 -72.1 -41.7 36.7 -27.7 -15.2 7 16 A L H X S+ 0 0 87 -4,-2.9 4,-2.5 1,-0.2 -2,-0.2 0.903 105.7 55.4 -56.9 -39.2 40.2 -28.1 -13.8 8 17 A E H X S+ 0 0 120 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.876 106.6 51.8 -62.8 -36.9 41.2 -25.0 -15.8 9 18 A V H X S+ 0 0 7 -4,-1.2 4,-2.8 2,-0.2 -1,-0.2 0.931 109.0 49.0 -58.8 -47.6 38.4 -23.2 -14.0 10 19 A L H X S+ 0 0 39 -4,-2.1 4,-1.8 1,-0.2 -2,-0.2 0.920 110.9 50.0 -64.5 -37.3 39.7 -24.3 -10.6 11 20 A E H X S+ 0 0 119 -4,-2.5 4,-1.4 2,-0.2 -1,-0.2 0.922 111.7 48.9 -64.9 -43.7 43.2 -23.2 -11.6 12 21 A Q H X S+ 0 0 51 -4,-2.3 4,-2.3 1,-0.2 3,-0.4 0.935 109.6 52.0 -59.6 -45.3 41.8 -19.7 -12.6 13 22 A V H X S+ 0 0 0 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.874 103.6 57.8 -62.4 -34.3 39.9 -19.4 -9.4 14 23 A S H < S+ 0 0 54 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.880 112.0 41.5 -67.5 -33.7 43.0 -20.2 -7.4 15 24 A H H < S+ 0 0 132 -4,-1.4 4,-0.3 -3,-0.4 -1,-0.2 0.832 118.3 45.6 -77.3 -36.3 44.7 -17.1 -9.0 16 25 A L H >< S+ 0 0 8 -4,-2.3 3,-1.6 1,-0.2 5,-0.3 0.832 95.8 74.6 -75.7 -33.9 41.7 -14.8 -8.8 17 26 A A T 3< S+ 0 0 0 -4,-2.4 28,-0.2 1,-0.3 -1,-0.2 0.870 90.8 54.1 -55.4 -45.6 40.7 -15.6 -5.2 18 27 A P T 3 S+ 0 0 76 0, 0.0 -1,-0.3 0, 0.0 27,-0.2 0.688 92.9 90.2 -65.1 -18.5 43.5 -13.5 -3.5 19 28 A L S < S- 0 0 67 -3,-1.6 2,-1.0 -4,-0.3 -3,-0.0 -0.482 73.8-138.6 -78.5 151.0 42.7 -10.4 -5.4 20 29 A D + 0 0 91 -2,-0.2 -1,-0.1 105,-0.1 -3,-0.1 -0.674 67.6 117.1-102.8 66.7 40.2 -7.8 -4.2 21 30 A K S S- 0 0 101 -2,-1.0 2,-0.1 -5,-0.3 -2,-0.1 -0.980 72.4-101.6-131.5 147.2 38.8 -7.4 -7.6 22 31 A P - 0 0 23 0, 0.0 132,-0.7 0, 0.0 131,-0.7 -0.425 36.1-156.5 -72.1 141.6 35.3 -8.1 -8.8 23 32 A V E -ab 127 154A 1 103,-1.8 105,-2.8 130,-0.2 2,-0.5 -0.968 7.0-151.2-123.2 139.7 34.7 -11.4 -10.6 24 33 A L E -ab 128 155A 7 130,-2.1 132,-2.6 -2,-0.4 2,-0.5 -0.941 9.3-160.1-109.7 126.2 32.0 -12.3 -13.1 25 34 A I E -ab 129 156A 0 103,-3.2 105,-1.9 -2,-0.5 2,-0.5 -0.927 4.1-162.5-108.7 125.7 31.0 -16.0 -13.3 26 35 A I E +ab 130 157A 33 130,-2.9 132,-3.1 -2,-0.5 2,-0.3 -0.940 31.9 122.5-109.2 125.5 29.1 -17.1 -16.4 27 36 A G - 0 0 2 103,-2.1 3,-0.1 -2,-0.5 105,-0.1 -0.898 53.9-100.1-176.0 156.2 27.3 -20.4 -16.4 28 37 A E > - 0 0 36 130,-0.3 3,-1.3 -2,-0.3 5,-0.3 -0.209 60.0 -73.9 -72.0 168.4 24.0 -22.3 -16.8 29 38 A R T 3 S+ 0 0 151 176,-0.2 -1,-0.2 1,-0.2 179,-0.1 -0.322 119.3 24.6 -59.4 145.3 21.8 -23.3 -13.9 30 39 A G T 3 S+ 0 0 13 177,-0.2 178,-2.0 178,-0.1 179,-0.3 0.628 86.1 111.5 75.8 14.4 23.3 -26.3 -12.0 31 40 A T S < S- 0 0 8 -3,-1.3 -2,-0.1 176,-0.2 -1,-0.1 0.487 91.5-105.6 -97.5 -3.1 26.9 -25.6 -12.9 32 41 A G > + 0 0 26 -4,-0.2 4,-2.1 3,-0.1 5,-0.2 0.770 62.6 153.7 90.1 31.2 27.9 -24.6 -9.4 33 42 A K H > S+ 0 0 20 -5,-0.3 4,-2.3 1,-0.2 5,-0.1 0.911 76.5 48.4 -58.4 -45.7 28.3 -20.9 -9.7 34 43 A E H > S+ 0 0 94 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.887 109.6 53.4 -64.8 -37.9 27.6 -20.3 -6.0 35 44 A L H > S+ 0 0 135 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.880 109.5 48.5 -60.9 -38.5 30.1 -23.0 -5.1 36 45 A I H X S+ 0 0 7 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.910 109.8 52.4 -67.6 -40.4 32.7 -21.2 -7.2 37 46 A A H X S+ 0 0 0 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.924 109.5 49.4 -59.8 -44.0 31.9 -17.9 -5.5 38 47 A S H X S+ 0 0 30 -4,-2.5 4,-2.7 1,-0.2 -1,-0.2 0.862 109.1 52.4 -62.1 -39.0 32.3 -19.6 -2.2 39 48 A R H X S+ 0 0 113 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.895 105.3 54.4 -66.2 -38.3 35.7 -21.0 -3.3 40 49 A L H < S+ 0 0 0 -4,-2.4 4,-0.2 2,-0.2 -2,-0.2 0.922 112.4 45.5 -61.0 -40.5 36.8 -17.5 -4.3 41 50 A H H >< S+ 0 0 0 -4,-1.9 3,-1.3 1,-0.2 5,-0.2 0.950 113.5 46.5 -64.5 -51.3 35.9 -16.3 -0.8 42 51 A Y H 3< S+ 0 0 123 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.736 113.3 48.9 -74.1 -18.4 37.6 -19.2 1.1 43 52 A L T 3< S+ 0 0 84 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.435 101.7 83.5 -93.8 0.8 40.8 -19.0 -0.9 44 53 A S S X S- 0 0 6 -3,-1.3 3,-1.2 -4,-0.2 -27,-0.1 -0.451 95.9-106.1 -94.8 173.9 41.0 -15.3 -0.4 45 54 A S T 3 S+ 0 0 100 1,-0.2 3,-0.4 -28,-0.2 -1,-0.1 0.620 117.6 66.0 -72.2 -11.6 42.5 -13.4 2.5 46 55 A R T > + 0 0 20 -5,-0.2 3,-2.5 1,-0.2 -1,-0.2 0.279 64.0 120.0 -89.8 10.5 38.8 -12.6 3.5 47 56 A W T < S+ 0 0 132 -3,-1.2 -1,-0.2 1,-0.3 -2,-0.1 0.714 72.7 50.2 -54.9 -26.4 38.1 -16.2 4.3 48 57 A Q T 3 S+ 0 0 162 -3,-0.4 -1,-0.3 36,-0.1 -2,-0.1 0.571 99.0 85.4 -90.3 -8.6 37.2 -15.6 7.9 49 58 A G S < S- 0 0 23 -3,-2.5 36,-0.2 35,-0.2 35,-0.1 -0.238 94.9 -72.0 -77.8 177.3 34.8 -12.8 6.9 50 59 A P - 0 0 46 0, 0.0 36,-2.3 0, 0.0 2,-0.5 -0.409 31.0-150.1 -76.4 152.0 31.2 -13.3 5.9 51 60 A F E -c 86 0A 46 34,-0.2 2,-0.3 -2,-0.1 36,-0.2 -0.978 23.6-178.2-118.6 111.9 30.0 -14.9 2.6 52 61 A I E -c 87 0A 22 34,-2.5 36,-2.7 -2,-0.5 2,-0.3 -0.860 5.8-165.9-115.3 144.4 26.7 -13.4 1.7 53 62 A S E +c 88 0A 33 -2,-0.3 2,-0.3 34,-0.2 36,-0.2 -0.963 8.7 177.8-132.4 146.4 24.6 -14.4 -1.3 54 63 A L E -c 89 0A 14 34,-2.2 36,-2.8 -2,-0.3 2,-0.8 -0.973 22.5-142.1-148.6 136.1 21.6 -12.8 -3.1 55 64 A N E > -c 90 0A 46 -2,-0.3 3,-1.1 34,-0.2 4,-0.3 -0.881 9.9-161.4 -99.5 107.5 19.6 -13.9 -6.2 56 65 A C G > S+ 0 0 2 34,-2.4 3,-0.7 -2,-0.8 35,-0.2 0.737 86.7 60.8 -56.8 -30.4 18.7 -10.7 -8.0 57 66 A A G 3 S+ 0 0 44 33,-0.3 -1,-0.2 1,-0.2 34,-0.1 0.776 92.5 67.1 -71.6 -21.6 16.0 -12.6 -10.0 58 67 A A G < S+ 0 0 76 -3,-1.1 2,-0.4 2,-0.0 -1,-0.2 0.655 96.3 59.3 -76.0 -17.0 14.0 -13.5 -6.9 59 68 A L S < S- 0 0 60 -3,-0.7 2,-0.0 -4,-0.3 0, 0.0 -0.893 77.6-120.5-122.7 143.7 13.0 -9.9 -6.0 60 69 A N > - 0 0 109 -2,-0.4 4,-3.0 1,-0.1 5,-0.2 -0.277 46.8 -92.2 -69.3 167.6 11.0 -7.1 -7.6 61 70 A E H > S+ 0 0 96 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.839 122.4 46.0 -53.2 -47.6 12.8 -3.8 -8.1 62 71 A N H > S+ 0 0 70 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.905 116.4 43.7 -69.1 -39.1 11.9 -2.1 -4.9 63 72 A L H > S+ 0 0 37 -3,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.888 112.3 54.5 -73.8 -37.7 12.7 -5.0 -2.6 64 73 A L H X S+ 0 0 0 -4,-3.0 4,-2.1 2,-0.2 5,-0.3 0.920 107.8 49.8 -60.9 -46.3 15.9 -5.7 -4.5 65 74 A D H X S+ 0 0 32 -4,-2.2 4,-2.5 -5,-0.2 5,-0.4 0.938 114.9 43.3 -57.2 -45.9 17.1 -2.1 -4.0 66 75 A S H X S+ 0 0 30 -4,-1.7 4,-2.0 1,-0.2 -2,-0.2 0.898 113.4 51.7 -69.5 -37.9 16.3 -2.3 -0.2 67 76 A E H < S+ 0 0 31 -4,-2.6 11,-2.3 1,-0.2 -1,-0.2 0.854 118.1 36.8 -71.0 -31.3 17.8 -5.8 0.1 68 77 A L H < S+ 0 0 0 -4,-2.1 11,-1.8 9,-0.3 12,-0.4 0.914 132.3 23.0 -85.4 -47.1 21.1 -4.8 -1.5 69 78 A F H < S- 0 0 23 -4,-2.5 8,-0.3 -5,-0.3 -3,-0.2 0.563 104.8-119.9-103.1 -10.2 21.6 -1.3 -0.3 70 79 A G < - 0 0 19 -4,-2.0 -1,-0.2 -5,-0.4 2,-0.2 -0.062 9.0-118.9 91.4 166.0 19.6 -1.2 2.9 71 80 A H 0 0 50 4,-1.7 -1,-0.1 3,-1.1 43,-0.1 -0.664 360.0 360.0-144.9 84.4 16.5 1.0 4.0 72 81 A E 0 0 137 -2,-0.2 -2,-0.0 3,-0.0 42,-0.0 0.611 360.0 360.0 -62.5 360.0 17.2 3.2 7.1 73 ! 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 74 91 A R 0 0 105 0, 0.0 -3,-1.1 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 -43.0 17.3 0.0 9.7 75 92 A H - 0 0 80 -5,-0.2 -4,-1.7 1,-0.1 2,-0.2 0.977 360.0-136.1 51.7 90.0 17.3 -3.2 7.7 76 93 A P - 0 0 54 0, 0.0 -6,-0.2 0, 0.0 -7,-0.1 -0.475 19.6-131.7 -65.2 136.8 21.0 -3.6 6.7 77 94 A G > - 0 0 0 -8,-0.3 4,-2.0 -2,-0.2 -9,-0.3 -0.248 27.2 -93.6 -83.8-178.5 21.4 -4.6 3.1 78 95 A R H > S+ 0 0 53 -11,-2.3 4,-1.0 1,-0.2 -10,-0.2 0.803 123.3 56.4 -70.9 -30.1 23.6 -7.4 1.7 79 96 A F H 4 S+ 0 0 6 -11,-1.8 3,-0.5 2,-0.2 4,-0.2 0.934 109.0 46.4 -64.9 -44.1 26.6 -5.0 1.1 80 97 A E H >4 S+ 0 0 79 -12,-0.4 3,-1.2 1,-0.2 -2,-0.2 0.909 112.3 51.0 -64.3 -39.8 26.6 -4.0 4.8 81 98 A R H 3< S+ 0 0 113 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.712 109.9 50.5 -68.0 -23.9 26.3 -7.6 5.9 82 99 A A T >< S+ 0 0 0 -4,-1.0 3,-2.9 -3,-0.5 43,-0.3 0.306 76.9 140.3 -95.7 3.1 29.2 -8.6 3.7 83 100 A D T < S+ 0 0 84 -3,-1.2 41,-0.2 1,-0.3 3,-0.1 -0.283 77.7 13.0 -55.2 132.8 31.5 -5.9 5.0 84 101 A G T 3 S+ 0 0 31 39,-2.6 -1,-0.3 1,-0.3 -35,-0.2 0.494 130.4 58.4 72.5 7.0 35.0 -7.4 5.3 85 102 A G S < S- 0 0 0 -3,-2.9 40,-2.2 38,-0.5 2,-0.4 -0.320 92.6 -67.6-137.0-146.9 33.9 -10.4 3.3 86 103 A T E -cd 51 125A 0 -36,-2.3 -34,-2.5 38,-0.2 2,-0.5 -0.977 27.3-155.8-125.8 137.8 32.4 -11.4 -0.1 87 104 A L E -cd 52 126A 0 38,-2.4 40,-2.6 -2,-0.4 2,-0.5 -0.970 7.8-158.4-114.4 128.2 29.0 -10.8 -1.6 88 105 A F E -cd 53 127A 0 -36,-2.7 -34,-2.2 -2,-0.5 2,-0.6 -0.923 5.6-168.1-106.5 118.6 27.7 -13.1 -4.4 89 106 A L E -cd 54 128A 0 38,-2.4 40,-2.3 -2,-0.5 3,-0.4 -0.931 9.8-161.3-109.2 110.1 25.0 -11.7 -6.6 90 107 A D E +c 55 0A 30 -36,-2.8 -34,-2.4 -2,-0.6 -33,-0.3 -0.509 66.4 17.4 -92.8 155.2 23.3 -14.2 -8.8 91 108 A E S > S+ 0 0 84 -36,-0.2 3,-2.1 -2,-0.2 39,-0.2 0.884 70.8 172.8 54.6 47.9 21.3 -13.7 -11.9 92 109 A L G > + 0 0 1 37,-2.6 3,-2.1 -3,-0.4 38,-0.2 0.752 64.3 71.8 -56.9 -34.7 22.8 -10.2 -12.3 93 110 A A G 3 S+ 0 0 18 1,-0.3 -1,-0.3 36,-0.2 -2,-0.1 0.715 91.5 60.3 -58.3 -20.4 21.2 -9.7 -15.7 94 111 A T G < S+ 0 0 67 -3,-2.1 -1,-0.3 2,-0.1 -2,-0.2 0.413 75.8 115.5 -83.6 -3.1 17.8 -9.3 -14.0 95 112 A A S < S- 0 0 5 -3,-2.1 -38,-0.1 -4,-0.2 -34,-0.0 -0.529 73.0-116.4 -69.0 130.6 18.9 -6.4 -11.9 96 113 A P >> - 0 0 27 0, 0.0 4,-2.1 0, 0.0 3,-0.6 -0.292 25.9-105.8 -65.9 158.7 16.9 -3.3 -12.9 97 114 A M H 3> S+ 0 0 73 1,-0.3 4,-2.0 2,-0.2 5,-0.2 0.873 119.5 56.5 -57.0 -36.9 18.7 -0.4 -14.5 98 115 A M H 3> S+ 0 0 83 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.891 108.7 46.2 -58.8 -44.8 18.4 1.7 -11.2 99 116 A V H <> S+ 0 0 1 -3,-0.6 4,-2.6 2,-0.2 -1,-0.2 0.872 108.5 56.8 -67.1 -37.4 20.0 -1.0 -9.2 100 117 A Q H X S+ 0 0 1 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.927 107.3 48.1 -61.9 -42.1 22.8 -1.4 -11.8 101 118 A E H X S+ 0 0 93 -4,-2.0 4,-1.7 1,-0.2 -2,-0.2 0.947 112.6 48.3 -64.8 -42.1 23.7 2.3 -11.5 102 119 A K H X S+ 0 0 72 -4,-1.9 4,-2.0 1,-0.2 -1,-0.2 0.878 108.9 54.6 -64.9 -37.4 23.8 2.1 -7.8 103 120 A L H X S+ 0 0 1 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.916 103.8 54.4 -61.8 -41.4 25.9 -1.0 -7.9 104 121 A L H X S+ 0 0 15 -4,-2.0 4,-2.3 2,-0.2 5,-0.2 0.933 106.8 52.6 -58.3 -43.0 28.5 0.7 -10.1 105 122 A R H X>S+ 0 0 47 -4,-1.7 4,-2.8 2,-0.2 5,-0.6 0.933 108.9 48.1 -63.6 -42.1 28.8 3.4 -7.4 106 123 A V H X5S+ 0 0 10 -4,-2.0 4,-1.8 1,-0.2 -1,-0.2 0.934 112.1 50.9 -62.2 -42.2 29.4 0.9 -4.7 107 124 A I H <5S+ 0 0 49 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.902 120.6 32.0 -61.0 -44.4 32.1 -0.8 -6.8 108 125 A E H <5S+ 0 0 140 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.832 132.7 27.5 -87.9 -33.8 34.0 2.4 -7.6 109 126 A Y H <5S- 0 0 79 -4,-2.8 -3,-0.2 -5,-0.2 -2,-0.2 0.593 89.1-136.9-103.7 -18.6 33.5 4.5 -4.5 110 127 A G << + 0 0 25 -4,-1.8 12,-2.9 -5,-0.6 2,-0.3 0.804 65.5 112.2 63.9 30.5 33.0 1.8 -1.8 111 128 A E E -E 121 0B 38 -6,-0.4 2,-0.4 10,-0.3 10,-0.3 -0.960 58.8-142.4-136.4 148.5 30.1 3.7 -0.2 112 129 A L E -E 120 0B 4 8,-3.4 8,-1.8 -2,-0.3 2,-0.1 -0.925 33.2-113.3-104.0 137.1 26.3 3.3 0.2 113 130 A E - 0 0 104 -2,-0.4 2,-0.4 6,-0.2 -7,-0.0 -0.406 26.8-166.6 -71.3 144.2 24.1 6.4 -0.1 114 131 A R - 0 0 58 1,-0.2 3,-0.2 -2,-0.1 -43,-0.0 -0.983 12.7-147.5-134.1 122.6 22.2 7.6 3.0 115 132 A V - 0 0 118 -2,-0.4 2,-0.3 1,-0.2 -1,-0.2 0.961 63.0 -39.8 -59.2 -75.5 19.5 10.3 2.6 116 133 A G 0 0 77 0, 0.0 -1,-0.2 0, 0.0 0, 0.0 -0.893 360.0 360.0-163.0 134.9 19.6 12.3 5.8 117 134 A G 0 0 131 -2,-0.3 -3,-0.0 -3,-0.2 0, 0.0 -0.992 360.0 360.0 141.6 360.0 20.1 11.7 9.5 118 ! 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 0.0 119 137 A P 0 0 125 0, 0.0 2,-0.5 0, 0.0 -6,-0.2 0.000 360.0 360.0 360.0 168.3 26.7 7.4 4.2 120 138 A L E -E 112 0B 78 -8,-1.8 -8,-3.4 2,-0.0 2,-0.4 -0.877 360.0-151.0-104.2 127.4 28.1 4.0 4.8 121 139 A Q E -E 111 0B 87 -2,-0.5 2,-0.3 -10,-0.3 -10,-0.3 -0.755 22.0-171.0 -85.9 136.6 31.6 3.0 3.6 122 140 A V - 0 0 17 -12,-2.9 2,-0.5 -2,-0.4 -42,-0.1 -0.971 23.0-152.9-135.0 154.4 31.8 -0.8 2.9 123 141 A N + 0 0 89 -2,-0.3 -39,-2.6 -44,-0.2 -38,-0.5 -0.878 37.2 151.7-128.9 87.8 34.7 -3.1 2.1 124 142 A V - 0 0 29 -2,-0.5 2,-0.6 -41,-0.2 -38,-0.2 -0.980 41.6-139.6-131.3 133.3 33.2 -6.0 0.1 125 143 A R E - d 0 86A 5 -40,-2.2 -38,-2.4 -2,-0.4 2,-0.4 -0.863 31.5-144.3 -90.2 123.9 34.7 -8.3 -2.5 126 144 A L E + d 0 87A 10 -2,-0.6 -103,-1.8 -40,-0.2 2,-0.4 -0.775 24.0 176.5-102.0 132.7 32.1 -8.7 -5.2 127 145 A V E -ad 23 88A 0 -40,-2.6 -38,-2.4 -2,-0.4 2,-0.3 -1.000 12.0-174.9-128.2 123.9 31.4 -11.9 -7.2 128 146 A C E -ad 24 89A 0 -105,-2.8 -103,-3.2 -2,-0.4 2,-0.3 -0.899 6.2-157.7-116.4 160.3 28.4 -11.9 -9.7 129 147 A A E +a 25 0A 0 -40,-2.3 -37,-2.6 -2,-0.3 2,-0.3 -0.968 17.8 152.4-137.3 148.6 26.9 -14.6 -11.8 130 148 A T E -a 26 0A 4 -105,-1.9 -103,-2.1 -2,-0.3 -2,-0.0 -0.962 35.8-153.2-155.9 160.7 24.8 -14.7 -14.9 131 149 A N S S+ 0 0 97 -2,-0.3 2,-0.1 -105,-0.2 -105,-0.1 0.214 70.9 102.6-115.4 13.0 24.0 -16.9 -18.0 132 150 A A S S- 0 0 33 -105,-0.1 2,-1.1 1,-0.1 -2,-0.1 -0.374 83.5-109.7 -82.8 168.5 23.0 -13.9 -20.1 133 151 A D > - 0 0 98 1,-0.2 4,-1.9 -2,-0.1 5,-0.2 -0.842 36.2-174.8 -98.2 94.2 25.1 -12.3 -22.8 134 152 A L H > S+ 0 0 3 -2,-1.1 4,-2.3 1,-0.2 -1,-0.2 0.892 79.8 54.3 -63.3 -45.1 25.9 -9.1 -21.0 135 153 A P H > S+ 0 0 77 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.901 109.6 50.2 -55.2 -37.6 27.6 -7.4 -23.9 136 154 A A H > S+ 0 0 27 1,-0.2 4,-1.7 2,-0.2 -2,-0.2 0.911 109.3 49.9 -67.6 -37.8 24.5 -8.1 -26.0 137 155 A M H X>S+ 0 0 37 -4,-1.9 5,-2.1 2,-0.2 6,-1.0 0.846 105.9 57.1 -69.3 -32.7 22.3 -6.6 -23.3 138 156 A V H ><5S+ 0 0 34 -4,-2.3 3,-1.0 4,-0.2 -1,-0.2 0.945 107.2 48.6 -59.0 -46.7 24.5 -3.5 -23.2 139 157 A N H 3<5S+ 0 0 145 -4,-1.8 -2,-0.2 1,-0.3 -1,-0.2 0.854 111.6 50.9 -62.1 -35.4 23.9 -3.1 -27.0 140 158 A E H 3<5S- 0 0 146 -4,-1.7 -1,-0.3 -5,-0.1 -2,-0.2 0.582 114.0-116.3 -77.4 -13.5 20.1 -3.5 -26.3 141 159 A G T <<5S+ 0 0 49 -3,-1.0 -3,-0.2 -4,-0.9 -2,-0.1 0.559 89.7 105.9 89.7 5.8 20.1 -0.9 -23.6 142 160 A T S - 0 0 77 -2,-0.3 4,-2.1 1,-0.2 5,-0.1 -0.503 14.3-152.9 -70.3 128.4 24.7 -0.6 -18.3 145 163 A A H > S+ 0 0 50 -2,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.907 96.7 53.5 -63.2 -42.2 27.9 -0.4 -20.3 146 164 A D H > S+ 0 0 59 1,-0.2 4,-1.2 2,-0.2 5,-0.2 0.932 108.5 49.4 -63.0 -42.3 29.7 1.5 -17.5 147 165 A L H >> S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 3,-0.6 0.922 111.3 48.7 -62.5 -44.5 28.7 -1.2 -14.9 148 166 A L H 3X S+ 0 0 29 -4,-2.1 4,-1.5 1,-0.2 -1,-0.2 0.887 106.6 57.5 -65.7 -33.1 30.0 -3.9 -17.2 149 167 A D H 3< S+ 0 0 141 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.768 118.1 32.2 -65.3 -29.7 33.3 -2.0 -17.8 150 168 A A H << S+ 0 0 23 -4,-1.2 3,-0.3 -3,-0.6 -2,-0.2 0.686 116.1 56.3 -99.7 -23.3 33.9 -2.0 -14.0 151 169 A L H < S+ 0 0 0 -4,-2.5 2,-1.5 1,-0.2 3,-0.3 0.875 93.6 63.4 -78.1 -40.5 32.4 -5.3 -13.0 152 170 A A < + 0 0 33 -4,-1.5 -1,-0.2 1,-0.2 3,-0.1 -0.496 47.9 152.3 -97.7 65.2 34.1 -7.8 -15.2 153 171 A F S S- 0 0 102 -2,-1.5 2,-0.3 -131,-0.7 -1,-0.2 0.927 85.8 -10.4 -51.9 -47.9 37.8 -7.5 -13.9 154 172 A D E S-b 23 0A 75 -132,-0.7 -130,-2.1 -3,-0.3 2,-0.4 -0.966 72.9-132.7-149.8 164.0 37.9 -11.1 -15.1 155 173 A V E -b 24 0A 40 -2,-0.3 2,-0.6 -132,-0.2 -130,-0.2 -0.981 5.8-159.8-123.6 127.8 35.4 -13.7 -16.2 156 174 A V E -b 25 0A 0 -132,-2.6 -130,-2.9 -2,-0.4 2,-0.6 -0.942 13.4-160.5-103.6 118.7 35.1 -17.3 -15.1 157 175 A Q E -b 26 0A 136 -2,-0.6 -130,-0.2 -132,-0.2 -132,-0.1 -0.895 5.2-151.1-107.2 113.4 33.2 -19.4 -17.6 158 176 A L - 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0 0 22 -5,-2.6 -1,-0.2 -6,-0.2 3,-0.1 -0.704 40.8-135.4 -79.2 136.9 21.4 -51.6 -2.2 186 204 A P S S+ 0 0 107 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.789 79.7 3.0 -65.2 -27.5 24.5 -53.7 -1.7 187 205 A L S S- 0 0 118 -7,-0.1 37,-0.0 3,-0.0 -10,-0.0 -0.986 71.9-112.4-157.3 142.6 26.2 -52.6 -4.9 188 206 A F - 0 0 26 -2,-0.3 37,-0.1 1,-0.1 3,-0.1 -0.747 30.5-151.3 -75.7 119.1 25.6 -50.3 -7.8 189 207 A P - 0 0 30 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 0.470 37.6-114.3 -83.1 8.4 25.1 -52.8 -10.6 190 208 A G - 0 0 21 38,-0.1 39,-2.8 37,-0.1 2,-0.5 -0.196 29.3 -72.5 93.7 172.0 26.4 -50.4 -13.4 191 209 A F B -f 229 0C 15 37,-0.2 39,-0.2 -3,-0.1 -18,-0.0 -0.937 40.1-129.8-106.9 132.8 24.9 -48.7 -16.4 192 210 A T > - 0 0 27 37,-2.4 4,-2.5 -2,-0.5 5,-0.2 -0.245 31.1-106.6 -65.5 161.2 23.9 -50.6 -19.6 193 211 A E H > S+ 0 0 133 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.915 123.3 56.4 -56.8 -39.5 25.2 -49.2 -22.9 194 212 A R H > S+ 0 0 125 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.939 107.9 48.0 -55.8 -44.9 21.6 -48.0 -23.5 195 213 A A H > S+ 0 0 0 34,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.905 109.9 51.9 -61.6 -42.7 21.7 -46.1 -20.3 196 214 A R H X S+ 0 0 91 -4,-2.5 4,-2.5 2,-0.2 5,-0.2 0.898 108.1 51.5 -62.6 -40.3 25.0 -44.6 -21.2 197 215 A E H X S+ 0 0 104 -4,-2.5 4,-1.8 2,-0.2 5,-0.2 0.917 110.3 49.3 -60.8 -41.1 23.7 -43.5 -24.6 198 216 A T H X S+ 0 0 43 -4,-2.1 4,-1.7 1,-0.2 -2,-0.2 0.950 114.6 45.3 -63.6 -47.6 20.8 -41.8 -22.8 199 217 A L H < S+ 0 0 0 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.850 117.8 41.0 -63.3 -39.5 23.1 -40.1 -20.4 200 218 A L H < S+ 0 0 51 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.702 114.9 50.0 -90.7 -17.9 25.7 -38.9 -23.0 201 219 A N H < S+ 0 0 137 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.793 89.9 94.7 -89.0 -27.1 23.2 -37.9 -25.7 202 220 A Y S < S- 0 0 65 -4,-1.7 -4,-0.0 -5,-0.2 0, 0.0 -0.361 73.1-136.7 -72.2 145.2 21.0 -35.7 -23.4 203 221 A R - 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