==== 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 BIOSYNTHETIC PROTEIN 30-JUL-07 2V7J . COMPND 2 MOLECULE: PRNB; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS FLUORESCENS; . AUTHOR J.H.NAISMITH . 344 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15015.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 254 73.8 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 . 4 1.2 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 . 0 0.0 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 . 7 2.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 44 12.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 188 54.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 2.3 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 3 0 1 1 1 1 1 1 3 0 0 0 0 0 0 1 1 0 0 0 0 0 0 1 1 0 1 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 . 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 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 4 A T 0 0 182 0, 0.0 2,-2.7 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 -30.7 3.1 41.8 16.2 2 5 A L > + 0 0 50 1,-0.2 3,-1.7 175,-0.1 4,-0.3 -0.405 360.0 167.4 -72.6 63.4 6.1 39.3 16.0 3 6 A D T > + 0 0 123 -2,-2.7 3,-0.8 1,-0.3 4,-0.3 0.694 58.0 66.9 -61.3 -24.7 7.3 41.7 13.3 4 7 A R T 3> S+ 0 0 77 1,-0.2 4,-0.7 -3,-0.2 3,-0.4 0.661 84.5 74.4 -73.6 -16.7 10.9 40.3 13.1 5 8 A V H <> S+ 0 0 39 -3,-1.7 4,-2.6 1,-0.2 3,-0.4 0.843 78.6 75.7 -61.0 -38.3 9.7 36.9 11.6 6 9 A G H <> S+ 0 0 46 -3,-0.8 4,-2.5 -4,-0.3 -1,-0.2 0.850 93.0 47.4 -46.7 -52.6 9.0 38.4 8.2 7 10 A V H > S+ 0 0 94 -3,-0.4 4,-2.0 -4,-0.3 -1,-0.2 0.892 114.0 47.0 -63.1 -40.6 12.5 38.6 6.9 8 11 A F H X S+ 0 0 44 -4,-0.7 4,-2.2 -3,-0.4 -1,-0.2 0.929 112.5 49.4 -66.7 -44.7 13.5 35.1 8.0 9 12 A A H X S+ 0 0 43 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.876 109.8 53.5 -59.0 -40.0 10.3 33.6 6.5 10 13 A A H X S+ 0 0 63 -4,-2.5 4,-1.5 -5,-0.3 -1,-0.2 0.896 107.3 49.5 -63.5 -42.3 11.1 35.5 3.3 11 14 A T H X S+ 0 0 77 -4,-2.0 4,-0.9 1,-0.2 -2,-0.2 0.906 112.4 49.2 -64.5 -38.9 14.6 34.0 3.1 12 15 A H H >X S+ 0 0 12 -4,-2.2 4,-2.1 1,-0.2 3,-0.8 0.919 106.4 55.7 -61.2 -45.6 13.1 30.5 3.6 13 16 A A H 3X S+ 0 0 54 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.824 97.8 63.9 -60.4 -34.2 10.5 31.1 0.9 14 17 A A H 3< S+ 0 0 46 -4,-1.5 4,-0.3 2,-0.2 -1,-0.2 0.888 108.4 40.1 -54.7 -42.2 13.3 31.9 -1.6 15 18 A V H X< S+ 0 0 4 -4,-0.9 3,-1.4 -3,-0.8 -2,-0.2 0.919 113.5 54.3 -75.8 -41.5 14.6 28.3 -1.3 16 19 A A H 3< S+ 0 0 19 -4,-2.1 -2,-0.2 100,-0.3 -1,-0.2 0.768 107.0 51.6 -60.4 -30.7 11.2 26.8 -1.2 17 20 A A T 3< S+ 0 0 89 -4,-2.1 2,-0.4 -5,-0.2 -1,-0.3 0.549 93.7 95.7 -80.8 -10.5 10.2 28.5 -4.5 18 21 A S < + 0 0 19 -3,-1.4 3,-0.1 -4,-0.3 -3,-0.0 -0.696 37.2 165.6 -91.8 132.1 13.4 27.2 -6.2 19 22 A D > + 0 0 49 -2,-0.4 3,-1.8 1,-0.1 5,-0.1 -0.544 8.4 162.4-137.0 68.5 13.3 24.0 -8.4 20 23 A P T 3 S+ 0 0 35 0, 0.0 -1,-0.1 0, 0.0 43,-0.1 0.702 78.4 46.9 -69.4 -20.2 16.6 24.2 -10.3 21 24 A L T 3 S- 0 0 28 42,-0.1 -3,-0.0 -3,-0.1 42,-0.0 0.327 106.3-126.1 -99.7 5.3 16.6 20.5 -11.3 22 25 A Q < + 0 0 171 -3,-1.8 4,-0.1 1,-0.1 3,-0.1 0.931 64.4 141.5 49.6 52.0 12.9 20.7 -12.3 23 26 A A >> + 0 0 0 1,-0.1 4,-2.9 2,-0.1 3,-0.6 0.453 23.2 105.2-106.3 -2.5 12.3 17.8 -10.0 24 27 A R H 3> S+ 0 0 103 1,-0.3 4,-1.6 2,-0.2 -1,-0.1 0.889 86.1 41.3 -49.3 -55.8 8.9 18.6 -8.4 25 28 A A H 34 S+ 0 0 58 1,-0.2 -1,-0.3 2,-0.2 4,-0.2 0.766 117.3 52.0 -66.9 -24.2 6.8 16.1 -10.3 26 29 A L H X4 S+ 0 0 27 -3,-0.6 3,-1.6 2,-0.2 4,-0.2 0.935 106.5 48.7 -77.3 -48.4 9.6 13.5 -9.9 27 30 A V H >< S+ 0 0 1 -4,-2.9 3,-1.9 1,-0.3 100,-0.3 0.813 99.7 68.6 -65.4 -28.7 10.0 13.7 -6.1 28 31 A L T 3< S+ 0 0 68 -4,-1.6 4,-0.3 -5,-0.3 -1,-0.3 0.715 93.9 59.6 -58.6 -21.3 6.2 13.5 -5.6 29 32 A Q T <> S+ 0 0 100 -3,-1.6 4,-1.4 -4,-0.2 -1,-0.3 0.532 83.0 85.4 -84.6 -10.0 6.6 9.8 -6.8 30 33 A L H <> S+ 0 0 0 -3,-1.9 4,-2.5 -4,-0.2 5,-0.2 0.926 80.3 57.4 -60.8 -49.1 9.0 9.0 -4.0 31 34 A P H > S+ 0 0 17 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.889 106.9 49.2 -49.5 -45.9 6.3 8.1 -1.3 32 35 A G H > S+ 0 0 20 -4,-0.3 4,-1.8 1,-0.2 -2,-0.2 0.890 111.6 49.5 -60.7 -40.2 4.7 5.4 -3.5 33 36 A L H <>S+ 0 0 32 -4,-1.4 5,-2.6 2,-0.2 4,-0.2 0.857 110.6 49.6 -69.1 -35.3 8.2 3.9 -4.2 34 37 A N H ><5S+ 0 0 9 -4,-2.5 3,-1.0 94,-0.2 -2,-0.2 0.897 108.4 52.8 -66.6 -40.9 9.0 3.9 -0.5 35 38 A R H 3<5S+ 0 0 176 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.868 113.6 44.5 -61.1 -37.5 5.7 2.2 0.3 36 39 A N T 3<5S- 0 0 118 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.484 105.6-132.6 -82.1 -4.7 6.6 -0.5 -2.2 37 40 A K T < 5 + 0 0 142 -3,-1.0 2,-1.4 -4,-0.2 -3,-0.2 0.869 44.7 166.9 51.2 40.6 10.2 -0.7 -0.9 38 41 A D >< + 0 0 64 -5,-2.6 4,-2.3 1,-0.2 -1,-0.2 -0.648 10.9 171.8 -92.1 83.5 11.3 -0.4 -4.5 39 42 A V H > S+ 0 0 25 -2,-1.4 4,-2.4 2,-0.2 5,-0.2 0.920 77.4 48.9 -64.1 -49.6 15.0 0.3 -4.2 40 43 A P H > S+ 0 0 105 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.905 113.3 50.6 -54.3 -40.1 15.9 -0.0 -7.9 41 44 A G H > S+ 0 0 21 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.879 107.6 52.2 -63.2 -41.7 13.0 2.3 -8.7 42 45 A I H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.928 112.3 45.5 -59.4 -47.8 14.2 4.9 -6.1 43 46 A V H X S+ 0 0 23 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.936 113.3 50.8 -59.9 -46.5 17.6 4.9 -7.7 44 47 A G H X S+ 0 0 36 -4,-2.5 4,-0.8 1,-0.2 -2,-0.2 0.871 109.5 50.1 -61.0 -40.1 16.1 5.1 -11.2 45 48 A L H >< S+ 0 0 5 -4,-2.6 3,-0.7 2,-0.2 4,-0.4 0.923 110.7 49.4 -64.9 -45.2 13.9 8.0 -10.2 46 49 A L H >X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 3,-2.0 0.919 105.6 57.3 -57.8 -46.1 16.9 9.9 -8.7 47 50 A R H 3< S+ 0 0 139 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.719 91.5 72.5 -62.2 -20.0 18.9 9.3 -11.9 48 51 A E T << S+ 0 0 130 -4,-0.8 -1,-0.3 -3,-0.7 -2,-0.2 0.748 119.6 12.6 -62.8 -25.0 16.1 11.1 -13.9 49 52 A F T <4 S+ 0 0 17 -3,-2.0 -2,-0.2 -4,-0.4 -1,-0.2 0.508 90.8 118.3-132.7 -9.0 17.3 14.4 -12.4 50 53 A L S < S- 0 0 14 -4,-2.1 2,-0.1 1,-0.1 42,-0.0 -0.475 70.6-115.4 -64.2 124.0 20.7 14.0 -10.7 51 54 A P - 0 0 20 0, 0.0 3,-0.1 0, 0.0 44,-0.1 -0.397 33.0-178.0 -58.2 131.4 23.2 16.2 -12.4 52 55 A V S S+ 0 0 121 2,-0.1 3,-0.1 1,-0.1 -2,-0.0 0.669 75.6 49.2-101.9 -21.2 25.9 14.0 -14.1 53 56 A R S S- 0 0 246 1,-0.4 -1,-0.1 0, 0.0 2,-0.0 -0.117 116.6 -87.2-115.5 35.2 28.1 16.8 -15.5 54 57 A G - 0 0 34 -3,-0.1 -1,-0.4 2,-0.1 -2,-0.1 -0.180 62.7 -48.2 86.2 176.2 28.6 19.0 -12.4 55 58 A L - 0 0 47 -3,-0.1 9,-0.0 1,-0.1 2,-0.0 -0.678 62.9 -99.8 -86.7 137.4 26.6 22.0 -11.1 56 59 A P > - 0 0 67 0, 0.0 3,-1.7 0, 0.0 -1,-0.1 -0.340 30.6-129.8 -53.2 131.9 25.4 24.8 -13.5 57 60 A S T 3 S+ 0 0 133 1,-0.3 -2,-0.0 -3,-0.0 -3,-0.0 0.687 101.7 64.9 -65.4 -20.1 27.8 27.7 -13.1 58 61 A G T 3 S+ 0 0 73 2,-0.0 -1,-0.3 5,-0.0 5,-0.1 0.611 78.2 113.0 -77.0 -13.4 25.0 30.2 -12.6 59 62 A W < - 0 0 49 -3,-1.7 2,-0.2 4,-0.1 -4,-0.0 -0.294 41.7-178.1 -64.6 139.8 23.8 28.6 -9.3 60 63 A G > - 0 0 36 -2,-0.0 4,-2.3 43,-0.0 5,-0.2 -0.427 53.0 -66.6-112.6-161.7 24.1 30.4 -6.0 61 64 A F H > S+ 0 0 80 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.902 129.8 56.0 -53.1 -48.4 23.2 29.3 -2.5 62 65 A V H > S+ 0 0 47 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.918 111.3 41.4 -56.0 -50.4 19.4 29.2 -3.2 63 66 A E H > S+ 0 0 63 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.924 115.2 50.4 -64.6 -46.4 19.7 26.8 -6.2 64 67 A A H X S+ 0 0 1 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.900 112.3 47.2 -60.2 -41.2 22.3 24.6 -4.5 65 68 A A H X S+ 0 0 0 -4,-2.8 4,-2.1 -5,-0.2 -1,-0.2 0.892 112.5 49.5 -66.0 -41.4 20.2 24.3 -1.3 66 69 A A H X S+ 0 0 0 -4,-2.0 4,-1.9 -5,-0.3 -2,-0.2 0.873 111.2 49.6 -64.2 -38.4 17.1 23.5 -3.3 67 70 A A H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 5,-0.3 0.908 109.6 51.5 -65.7 -42.1 19.0 20.8 -5.3 68 71 A M H X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.881 108.1 53.4 -62.6 -38.9 20.3 19.4 -2.0 69 72 A R H X S+ 0 0 0 -4,-2.1 4,-1.4 2,-0.2 -1,-0.2 0.943 111.5 43.5 -58.5 -50.8 16.7 19.2 -0.8 70 73 A D H < S+ 0 0 0 -4,-1.9 4,-0.4 1,-0.2 -2,-0.2 0.913 119.7 40.6 -70.7 -41.3 15.4 17.3 -3.8 71 74 A I H >X S+ 0 0 0 -4,-2.5 3,-1.5 1,-0.2 4,-0.9 0.897 108.2 68.2 -63.5 -40.7 18.3 14.8 -3.9 72 75 A G H >X S+ 0 0 0 -4,-2.5 4,-1.8 -5,-0.3 3,-0.5 0.803 88.3 59.3 -52.9 -42.4 18.2 14.6 -0.1 73 76 A F H 3X S+ 0 0 0 -4,-1.4 4,-1.3 1,-0.3 -1,-0.3 0.804 105.0 53.2 -60.1 -28.0 14.8 12.9 0.2 74 77 A F H <> S+ 0 0 0 -3,-1.5 4,-2.6 -4,-0.4 -1,-0.3 0.815 103.7 57.2 -73.3 -30.3 16.4 10.0 -1.8 75 78 A L H <>S+ 0 0 0 -4,-2.6 5,-2.2 1,-0.2 3,-0.5 0.932 113.9 47.7 -60.8 -44.8 17.8 4.6 0.4 79 82 A K H ><5S+ 0 0 55 -4,-2.1 3,-1.9 1,-0.2 -1,-0.2 0.868 104.4 61.7 -62.2 -36.4 19.3 4.4 3.9 80 83 A R H 3<5S+ 0 0 78 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.839 104.4 48.9 -59.6 -34.1 15.8 3.5 5.3 81 84 A H T <<5S- 0 0 38 -4,-1.3 -1,-0.3 -3,-0.5 -2,-0.2 0.313 131.3 -94.7 -90.0 8.1 15.8 0.4 3.1 82 85 A G T < 5S+ 0 0 59 -3,-1.9 2,-0.4 1,-0.2 -3,-0.2 0.635 84.8 121.6 96.8 16.8 19.3 -0.5 4.3 83 86 A H < - 0 0 74 -5,-2.2 -1,-0.2 -6,-0.2 -2,-0.2 -0.934 62.3-129.5-120.5 132.6 21.5 1.0 1.6 84 87 A E >> - 0 0 28 -2,-0.4 4,-1.5 1,-0.2 3,-1.2 -0.671 23.7-145.5 -70.9 116.0 24.3 3.6 1.7 85 88 A P H 3> S+ 0 0 1 0, 0.0 4,-1.6 0, 0.0 3,-0.2 0.874 97.1 55.5 -54.2 -39.8 23.2 6.0 -1.0 86 89 A A H 34 S+ 0 0 27 124,-0.3 7,-0.3 1,-0.2 6,-0.2 0.784 107.8 50.5 -62.7 -28.9 26.8 6.7 -2.1 87 90 A E H <4 S+ 0 0 161 -3,-1.2 -1,-0.2 1,-0.2 -4,-0.0 0.817 116.5 37.6 -79.4 -32.0 27.4 3.0 -2.6 88 91 A V H < S+ 0 0 51 -4,-1.5 -2,-0.2 -3,-0.2 -1,-0.2 0.557 110.7 60.1 -99.8 -9.0 24.3 2.4 -4.8 89 92 A V S >< S- 0 0 0 -4,-1.6 3,-1.8 -5,-0.2 4,-0.4 -0.878 77.4-146.0-123.1 96.6 24.3 5.6 -6.9 90 93 A P T 3 S+ 0 0 83 0, 0.0 -3,-0.1 0, 0.0 -2,-0.0 -0.330 85.0 17.8 -62.3 142.3 27.4 6.2 -8.9 91 94 A G T 3> S+ 0 0 48 -5,-0.1 4,-0.9 1,-0.1 -5,-0.1 0.414 95.9 107.4 76.7 -2.4 28.4 9.8 -9.3 92 95 A L H <> + 0 0 0 -3,-1.8 4,-2.4 -6,-0.2 3,-0.3 0.932 69.2 57.5 -69.5 -47.8 26.2 10.8 -6.3 93 96 A E H > S+ 0 0 70 -4,-0.4 4,-2.6 -7,-0.3 5,-0.2 0.904 104.1 50.2 -55.3 -48.4 29.0 11.5 -3.8 94 97 A P H > S+ 0 0 75 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.884 111.3 50.7 -59.1 -37.2 30.9 14.2 -5.9 95 98 A V H X S+ 0 0 8 -4,-0.9 4,-2.4 -3,-0.3 -2,-0.2 0.933 110.1 49.4 -62.5 -47.7 27.5 16.0 -6.4 96 99 A L H X S+ 0 0 1 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.917 112.0 48.0 -57.3 -46.2 26.8 15.9 -2.7 97 100 A L H X S+ 0 0 75 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.883 111.1 51.3 -64.2 -37.8 30.3 17.3 -1.9 98 101 A D H X S+ 0 0 70 -4,-2.2 4,-1.8 -5,-0.2 -2,-0.2 0.893 111.2 47.2 -63.6 -41.6 29.9 20.1 -4.5 99 102 A L H X S+ 0 0 0 -4,-2.4 4,-1.5 2,-0.2 6,-0.2 0.867 109.2 54.0 -69.5 -37.5 26.5 21.1 -3.0 100 103 A A H X>S+ 0 0 15 -4,-2.2 4,-1.8 1,-0.2 5,-1.0 0.917 109.6 49.4 -57.6 -45.2 28.1 21.1 0.5 101 104 A R H <5S+ 0 0 216 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.886 111.4 48.7 -59.0 -42.5 30.8 23.4 -0.9 102 105 A A H <5S+ 0 0 48 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.714 122.9 31.1 -75.8 -24.2 28.1 25.8 -2.4 103 106 A T H <5S- 0 0 4 -4,-1.5 -1,-0.2 -3,-0.3 -2,-0.2 0.522 95.4-129.9-108.6 -10.5 26.0 26.0 0.7 104 107 A N T <5S+ 0 0 100 -4,-1.8 -3,-0.2 1,-0.3 -4,-0.1 0.866 75.1 112.5 53.4 38.3 28.7 25.7 3.5 105 108 A L S - 0 0 0 -2,-0.2 4,-1.6 109,-0.1 3,-0.3 -0.693 43.4 -85.5-118.6 176.3 19.2 18.7 7.0 111 114 A L H > S+ 0 0 3 109,-0.3 4,-1.5 -2,-0.2 5,-0.2 0.887 126.4 56.3 -44.6 -49.5 16.2 19.9 8.9 112 115 A L H 4>S+ 0 0 11 141,-0.3 5,-2.6 1,-0.2 3,-0.4 0.911 105.2 51.8 -54.2 -47.4 16.2 23.2 7.0 113 116 A H H 45S+ 0 0 0 -3,-0.3 -1,-0.2 1,-0.2 -2,-0.2 0.866 114.4 40.6 -56.1 -42.2 15.9 21.4 3.6 114 117 A V H <5S+ 0 0 1 -4,-1.6 -1,-0.2 -3,-0.2 -2,-0.2 0.600 127.8 24.6 -91.5 -11.1 12.9 19.3 4.6 115 118 A T T ><5S+ 0 0 0 -4,-1.5 3,-1.6 -3,-0.4 -3,-0.2 0.641 128.7 17.5-114.5 -86.2 10.9 21.9 6.5 116 119 A V T 3 5S+ 0 0 15 1,-0.3 -100,-0.3 -5,-0.2 -3,-0.2 0.767 128.9 47.6 -69.9 -26.0 11.3 25.7 5.8 117 120 A W T 3 > S- 0 0 45 1,-0.1 4,-3.2 2,-0.1 3,-1.7 -0.292 74.4-123.2 -67.0 148.8 1.5 23.2 -1.4 122 125 A A T 34 S+ 0 0 102 1,-0.3 -1,-0.1 2,-0.2 0, 0.0 0.840 112.2 52.0 -58.0 -36.3 0.1 19.7 -1.9 123 126 A D T 34 S+ 0 0 98 1,-0.1 -1,-0.3 0, 0.0 -95,-0.1 0.374 124.2 26.6 -83.7 8.4 1.3 19.6 -5.5 124 127 A A T <4 S+ 0 0 13 -3,-1.7 -2,-0.2 -5,-0.1 -1,-0.1 0.588 82.8 114.8-139.3 -31.9 4.9 20.6 -4.5 125 128 A Q < - 0 0 34 -4,-3.2 2,-0.2 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100.4 73.2 -62.2 -29.7 19.3 10.3 28.1 325 339 A M H 3> S+ 0 0 46 1,-0.2 4,-2.5 2,-0.2 -1,-0.3 0.764 88.7 63.8 -59.6 -26.5 20.5 13.7 27.0 326 340 A L H <> S+ 0 0 28 -3,-1.4 4,-2.3 2,-0.2 -1,-0.2 0.955 106.0 41.0 -62.2 -54.1 17.0 15.1 26.9 327 341 A G H > S+ 0 0 25 -4,-0.5 4,-2.1 -3,-0.3 -1,-0.2 0.841 115.1 53.8 -61.2 -36.9 16.4 14.6 30.6 328 342 A E H X S+ 0 0 73 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.889 108.9 47.7 -65.2 -41.4 19.9 15.9 31.3 329 343 A L H X S+ 0 0 12 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.899 109.8 52.8 -67.3 -41.8 19.3 19.1 29.3 330 344 A L H X S+ 0 0 20 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.931 108.2 51.5 -56.7 -47.3 16.0 19.6 31.1 331 345 A T H X S+ 0 0 97 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.911 109.3 49.9 -56.4 -45.6 17.8 19.3 34.4 332 346 A L H X S+ 0 0 36 -4,-2.0 4,-2.2 1,-0.2 -1,-0.2 0.855 109.7 51.7 -60.6 -37.8 20.4 21.9 33.3 333 347 A T H X S+ 0 0 0 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.901 108.1 50.4 -68.7 -42.7 17.6 24.3 32.2 334 348 A Y H X S+ 0 0 91 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.898 110.5 50.7 -59.0 -43.4 15.9 24.0 35.6 335 349 A A H X S+ 0 0 51 -4,-2.0 4,-1.7 2,-0.2 -2,-0.2 0.910 108.8 51.7 -60.9 -45.3 19.2 24.8 37.3 336 350 A A H >X S+ 0 0 5 -4,-2.2 4,-1.3 1,-0.2 3,-0.5 0.964 112.0 45.4 -55.4 -55.2 19.6 27.9 35.1 337 351 A R H 3X S+ 0 0 52 -4,-2.6 4,-2.6 1,-0.2 3,-0.4 0.896 108.2 58.6 -53.9 -44.1 16.2 29.2 36.0 338 352 A S H 3X S+ 0 0 60 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.835 101.0 55.8 -55.7 -38.9 16.8 28.4 39.7 339 353 A R H