==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-FEB-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER NUCLEIC ACID BINDING PROTEIN 24-FEB-12 4DWL . COMPND 2 MOLECULE: BBP7; . SOURCE 2 ORGANISM_SCIENTIFIC: BORDETELLA PHAGE BPP-1; . AUTHOR P.GHOSH,M.AL-AYYOUBI . 545 8 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25707.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 467 85.7 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 . 0 0.0 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 . 0 0.0 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 0.2 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 . 6 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 61 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 390 71.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.6 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 0 0 0 0 0 0 0 0 0 0 0 0 0 5 0 0 2 5 3 1 0 2 1 1 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 . 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 14 A X > 0 0 198 0, 0.0 4,-1.2 0, 0.0 43,-0.0 0.000 360.0 360.0 360.0 -0.1 19.9 49.0 52.1 2 15 A L H > + 0 0 89 2,-0.2 4,-2.7 3,-0.1 5,-0.2 0.883 360.0 48.1 -79.0 -46.2 19.7 46.8 55.2 3 16 A I H > S+ 0 0 8 1,-0.2 4,-1.9 2,-0.2 -1,-0.1 0.838 113.0 49.9 -58.7 -32.4 19.9 43.7 53.0 4 17 A V H > S+ 0 0 10 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.907 107.1 52.6 -75.6 -39.7 22.8 45.3 51.2 5 18 A E H X S+ 0 0 85 -4,-1.2 4,-0.8 1,-0.2 -2,-0.2 0.925 112.8 46.1 -58.5 -45.1 24.6 46.1 54.5 6 19 A R H >X S+ 0 0 62 -4,-2.7 4,-1.0 1,-0.2 3,-0.7 0.883 111.4 52.3 -60.9 -41.0 24.2 42.5 55.4 7 20 A Y H 3X S+ 0 0 0 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.823 97.2 65.0 -70.0 -29.0 25.4 41.4 52.0 8 21 A E H 3X S+ 0 0 32 -4,-2.4 4,-2.9 1,-0.2 -1,-0.2 0.847 96.7 59.2 -60.0 -29.0 28.5 43.6 52.3 9 22 A R H S+ 0 0 62 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.862 117.1 47.9 -61.1 -31.7 39.8 38.6 49.7 17 30 A I H < S+ 0 0 21 -4,-0.6 4,-0.5 2,-0.2 -2,-0.2 0.919 113.1 46.8 -70.8 -46.6 39.3 34.8 49.3 18 31 A A H >< S+ 0 0 0 -4,-3.0 3,-1.2 1,-0.2 -1,-0.2 0.899 111.5 51.7 -54.7 -47.1 38.0 35.1 45.7 19 32 A Q H 3< S+ 0 0 35 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.853 106.1 55.6 -62.8 -35.0 40.9 37.5 44.9 20 33 A S T 3< S+ 0 0 88 -4,-1.3 -1,-0.3 -5,-0.2 -2,-0.2 0.530 76.6 121.7 -76.4 -11.0 43.4 34.9 46.2 21 34 A I S < S- 0 0 5 -3,-1.2 59,-0.1 -4,-0.5 60,-0.1 -0.393 78.4 -99.3 -57.8 126.4 42.1 32.2 43.9 22 35 A P > - 0 0 45 0, 0.0 3,-1.7 0, 0.0 7,-0.2 -0.163 25.4-120.6 -49.8 142.2 45.1 31.1 41.8 23 36 A R G > S+ 0 0 214 1,-0.3 3,-2.1 2,-0.1 4,-0.2 0.657 104.8 79.8 -58.3 -20.8 45.2 32.6 38.3 24 37 A K G 3 S+ 0 0 144 1,-0.3 -1,-0.3 2,-0.1 3,-0.2 0.756 97.5 45.4 -62.1 -23.9 45.1 29.1 36.7 25 38 A H G <> S+ 0 0 0 -3,-1.7 4,-3.6 1,-0.2 -1,-0.3 -0.194 80.5 139.4-104.3 37.3 41.4 29.3 37.4 26 39 A G H <> + 0 0 27 -3,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.830 67.0 47.1 -53.9 -43.0 41.4 32.9 36.0 27 40 A V H > S+ 0 0 16 -3,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.965 117.1 41.5 -67.3 -52.2 38.1 32.6 34.1 28 41 A A H > S+ 0 0 0 1,-0.2 4,-3.1 2,-0.2 -2,-0.2 0.912 112.2 56.6 -59.4 -46.2 36.2 31.0 37.0 29 42 A R H X S+ 0 0 44 -4,-3.6 4,-2.3 1,-0.2 -1,-0.2 0.872 109.6 46.4 -52.3 -39.6 37.8 33.4 39.4 30 43 A E H X S+ 0 0 54 -4,-1.8 4,-2.4 -5,-0.2 -1,-0.2 0.881 111.3 49.4 -72.9 -39.4 36.5 36.3 37.4 31 44 A X H X S+ 0 0 35 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.934 111.5 50.6 -66.8 -42.7 33.0 34.9 37.0 32 45 A F H X S+ 0 0 0 -4,-3.1 4,-2.8 1,-0.2 -2,-0.2 0.968 111.3 48.0 -52.5 -59.8 32.9 34.3 40.8 33 46 A L H X S+ 0 0 1 -4,-2.3 4,-1.9 1,-0.2 5,-0.3 0.856 112.1 49.8 -51.2 -40.1 34.1 37.9 41.4 34 47 A K H X S+ 0 0 68 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.897 112.5 46.5 -72.7 -34.4 31.5 39.3 39.0 35 48 A C H X S+ 0 0 23 -4,-2.6 4,-1.2 -3,-0.2 -2,-0.2 0.928 111.7 51.5 -67.7 -46.2 28.7 37.3 40.6 36 49 A L H < S+ 0 0 0 -4,-2.8 4,-0.2 -5,-0.2 -2,-0.2 0.897 122.7 29.1 -56.5 -47.9 29.7 38.3 44.2 37 50 A L H >X S+ 0 0 0 -4,-1.9 3,-1.7 -5,-0.2 4,-0.6 0.846 113.9 60.1 -85.5 -40.1 29.8 42.0 43.4 38 51 A G H >X S+ 0 0 16 -4,-2.5 4,-1.1 -5,-0.3 3,-0.9 0.785 90.0 76.7 -58.7 -24.0 27.2 42.2 40.7 39 52 A Q H 3X S+ 0 0 1 -4,-1.2 4,-1.5 1,-0.3 -1,-0.3 0.802 82.2 63.8 -63.7 -30.5 24.8 40.9 43.2 40 53 A V H <> S+ 0 0 0 -3,-1.7 4,-2.6 1,-0.2 3,-0.4 0.928 100.5 52.8 -59.1 -41.3 24.6 44.2 44.9 41 54 A E H < S+ 0 0 3 -4,-1.6 3,-1.1 8,-0.3 -1,-0.2 0.900 114.5 51.0 -56.7 -42.9 14.9 45.3 43.2 47 60 A G H 3< S+ 0 0 45 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.920 106.4 50.4 -64.4 -47.1 15.2 48.1 45.7 48 61 A K T 3< S+ 0 0 91 -4,-3.3 2,-0.3 -5,-0.1 -1,-0.3 0.151 116.8 56.0 -76.0 19.3 14.6 51.0 43.1 49 62 A S < - 0 0 33 -3,-1.1 -3,-0.0 -5,-0.2 -4,-0.0 -0.919 67.8-140.0-150.2 171.6 11.6 49.0 42.0 50 63 A N + 0 0 126 -2,-0.3 -1,-0.1 4,-0.0 5,-0.1 0.865 63.5 108.0 -98.4 -46.4 8.3 47.4 42.9 51 64 A Q >> - 0 0 95 1,-0.1 3,-1.1 3,-0.1 4,-0.7 -0.000 55.7-151.0 -54.3 126.5 8.2 44.1 40.9 52 65 A V H 3> S+ 0 0 41 1,-0.2 4,-2.1 2,-0.2 3,-0.4 0.763 94.2 73.2 -62.1 -27.1 8.6 40.9 42.8 53 66 A S H 3> S+ 0 0 59 1,-0.3 4,-1.4 2,-0.2 -1,-0.2 0.838 96.3 50.9 -57.5 -30.6 10.2 39.4 39.6 54 67 A K H <> S+ 0 0 64 -3,-1.1 4,-1.0 2,-0.2 -8,-0.3 0.770 106.6 52.2 -77.6 -33.8 13.2 41.5 40.4 55 68 A L H X S+ 0 0 3 -4,-0.7 4,-1.0 -3,-0.4 -2,-0.2 0.798 107.9 54.1 -70.0 -30.6 13.4 40.2 44.0 56 69 A Y H X S+ 0 0 86 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.878 105.0 52.4 -68.3 -39.6 13.3 36.7 42.5 57 70 A A H X S+ 0 0 48 -4,-1.4 4,-1.6 1,-0.2 -1,-0.2 0.799 106.3 53.7 -69.0 -27.8 16.3 37.5 40.3 58 71 A A H X S+ 0 0 0 -4,-1.0 4,-1.4 -16,-0.2 -1,-0.2 0.806 108.3 51.5 -72.9 -27.9 18.1 38.6 43.4 59 72 A D H X S+ 0 0 41 -4,-1.0 4,-1.7 2,-0.2 -2,-0.2 0.825 107.5 50.7 -77.1 -32.9 17.3 35.3 44.9 60 73 A A H X S+ 0 0 2 -4,-1.9 4,-2.5 2,-0.2 5,-0.2 0.890 105.4 59.1 -66.7 -36.6 18.6 33.4 41.9 61 74 A G H X S+ 0 0 2 -4,-1.6 4,-1.9 1,-0.2 -2,-0.2 0.920 106.8 45.1 -58.2 -48.3 21.8 35.5 42.2 62 75 A L H X S+ 0 0 0 -4,-1.4 4,-2.4 2,-0.2 -1,-0.2 0.872 110.9 54.3 -60.9 -40.3 22.4 34.1 45.7 63 76 A A H X S+ 0 0 8 -4,-1.7 4,-1.1 1,-0.2 -2,-0.2 0.871 109.9 47.3 -64.4 -35.1 21.6 30.6 44.5 64 77 A X H X S+ 0 0 6 -4,-2.5 4,-1.8 2,-0.2 -1,-0.2 0.808 108.7 54.7 -73.4 -31.4 24.2 31.1 41.8 65 78 A L H X S+ 0 0 0 -4,-1.9 4,-1.7 1,-0.2 -2,-0.2 0.928 105.4 52.7 -67.7 -40.6 26.7 32.4 44.4 66 79 A R H X S+ 0 0 80 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.822 105.7 55.1 -64.5 -30.7 26.1 29.2 46.5 67 80 A F H X S+ 0 0 2 -4,-1.1 4,-2.6 2,-0.2 -1,-0.2 0.925 103.9 54.2 -65.1 -43.4 27.0 27.2 43.4 68 81 A W H X S+ 0 0 3 -4,-1.8 4,-3.1 2,-0.2 -2,-0.2 0.877 107.0 51.7 -58.7 -39.7 30.3 29.1 43.1 69 82 A L H X S+ 0 0 0 -4,-1.7 4,-2.6 2,-0.2 5,-0.3 0.977 111.8 44.9 -59.0 -57.8 31.2 28.1 46.6 70 83 A R H X S+ 0 0 103 -4,-2.0 4,-0.8 1,-0.2 -2,-0.2 0.839 116.0 48.5 -54.8 -38.8 30.4 24.4 46.1 71 84 A F H X S+ 0 0 19 -4,-2.6 4,-1.8 2,-0.2 3,-0.5 0.947 112.7 46.0 -70.2 -46.3 32.3 24.5 42.8 72 85 A L H < S+ 0 0 0 -4,-3.1 9,-1.1 1,-0.2 8,-0.7 0.834 110.4 51.9 -70.5 -31.7 35.4 26.3 44.2 73 86 A A H < S+ 0 0 25 -4,-2.6 -1,-0.2 7,-0.2 -2,-0.2 0.768 114.5 46.6 -70.2 -25.0 35.7 24.1 47.3 74 87 A G H < S+ 0 0 46 -4,-0.8 -2,-0.2 -3,-0.5 -1,-0.2 0.834 89.8 100.5 -85.1 -35.9 35.6 21.1 45.0 75 88 A I < - 0 0 16 -4,-1.8 5,-0.4 1,-0.1 2,-0.2 0.012 50.7-157.2 -70.7 168.3 38.0 22.0 42.2 76 89 A Q + 0 0 100 1,-0.2 3,-0.1 3,-0.2 -1,-0.1 -0.738 52.9 68.0-139.4 167.3 41.6 20.8 41.7 77 90 A K S S+ 0 0 181 -2,-0.2 -1,-0.2 0, 0.0 2,-0.1 0.892 130.4 12.7 45.0 60.5 45.0 21.4 40.2 78 91 A P S S- 0 0 46 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.552 98.4-127.8 -97.0-179.5 45.1 23.8 42.1 79 92 A H - 0 0 119 1,-0.1 -3,-0.2 -3,-0.1 -6,-0.1 -0.295 17.6-169.6 -77.5 173.6 42.6 24.1 44.9 80 93 A A + 0 0 16 -8,-0.7 2,-0.3 1,-0.5 -7,-0.2 0.620 60.0 7.0-137.8 -38.2 40.6 27.3 45.3 81 94 A X - 0 0 12 -9,-1.1 -1,-0.5 -6,-0.2 -63,-0.0 -0.972 66.6-119.0-149.4 158.1 38.6 27.3 48.6 82 95 A T > - 0 0 67 -2,-0.3 4,-1.9 1,-0.1 5,-0.2 -0.667 26.4-118.7 -95.3 154.8 38.3 25.1 51.7 83 96 A P H > S+ 0 0 101 0, 0.0 4,-1.8 0, 0.0 -1,-0.1 0.768 116.8 57.5 -58.0 -24.4 35.1 23.4 52.9 84 97 A H H > S+ 0 0 118 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.883 103.9 49.1 -75.7 -36.8 35.5 25.6 56.0 85 98 A Q H > S+ 0 0 49 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.916 111.4 51.1 -63.2 -41.3 35.5 28.8 54.1 86 99 A V H X S+ 0 0 20 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.903 110.0 49.7 -60.9 -43.4 32.4 27.6 52.2 87 100 A E H X S+ 0 0 124 -4,-1.8 4,-1.2 1,-0.2 -1,-0.2 0.902 110.7 49.1 -65.4 -38.8 30.7 26.8 55.5 88 101 A T H X S+ 0 0 40 -4,-2.3 4,-1.2 1,-0.2 3,-0.3 0.907 110.4 50.8 -67.1 -40.4 31.5 30.2 57.0 89 102 A A H >X S+ 0 0 0 -4,-2.4 4,-3.0 1,-0.2 3,-0.6 0.920 103.0 58.9 -66.1 -41.5 30.2 32.0 53.9 90 103 A Q H 3X S+ 0 0 57 -4,-2.1 4,-2.9 1,-0.3 -1,-0.2 0.828 101.0 56.8 -56.5 -34.7 26.9 30.1 53.9 91 104 A V H 3X S+ 0 0 102 -4,-1.2 4,-1.0 -3,-0.3 -1,-0.3 0.911 111.4 42.7 -62.6 -40.0 26.3 31.5 57.4 92 105 A L H X S+ 0 0 53 -4,-1.0 4,-2.0 -3,-0.3 3,-0.6 0.937 110.3 48.1 -68.4 -43.8 21.3 35.7 56.9 96 109 A V H 3X S+ 0 0 0 -4,-1.6 4,-2.2 1,-0.2 -2,-0.2 0.880 110.5 52.8 -59.2 -40.2 21.0 37.7 53.7 97 110 A G H 3X S+ 0 0 28 -4,-2.5 4,-0.6 2,-0.2 -1,-0.2 0.685 106.8 52.4 -70.7 -18.8 18.5 35.1 52.4 98 111 A R H 0 0 130 0, 0.0 4,-3.0 0, 0.0 5,-0.3 0.000 360.0 360.0 360.0 -61.5 23.0 68.9 31.6 112 16 B I H > + 0 0 15 1,-0.2 4,-2.9 2,-0.2 5,-0.1 0.910 360.0 49.6 -59.5 -38.8 22.8 65.8 33.7 113 17 B V H > S+ 0 0 25 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.833 109.8 51.0 -67.5 -33.2 25.7 64.5 31.5 114 18 B E H 4 S+ 0 0 92 2,-0.2 4,-0.5 1,-0.2 -2,-0.2 0.916 113.5 43.8 -70.0 -46.8 27.6 67.8 32.2 115 19 B R H >X S+ 0 0 69 -4,-3.0 3,-1.4 1,-0.2 4,-0.8 0.920 112.8 53.7 -61.2 -44.3 27.0 67.5 35.9 116 20 B Y H >X S+ 0 0 0 -4,-2.9 4,-2.0 -5,-0.3 3,-0.6 0.837 96.2 65.2 -65.5 -28.9 27.9 63.8 35.7 117 21 B E H 3X S+ 0 0 54 -4,-1.8 4,-2.3 1,-0.2 -1,-0.3 0.743 95.1 61.1 -63.1 -18.5 31.2 64.5 33.9 118 22 B R H <> S+ 0 0 94 -3,-1.4 4,-2.0 -4,-0.5 -1,-0.2 0.865 104.1 48.4 -70.8 -37.5 32.3 66.3 37.2 119 23 B V H S+ 0 0 75 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.822 112.0 53.0 -57.2 -31.3 42.0 59.3 38.6 126 30 B I H X S+ 0 0 15 -4,-0.5 4,-1.1 -3,-0.3 -2,-0.2 0.912 108.4 48.2 -70.5 -42.6 41.0 57.4 41.7 127 31 B A H >< S+ 0 0 0 -4,-2.5 3,-0.8 1,-0.2 -1,-0.2 0.943 109.2 54.8 -60.0 -48.3 40.0 54.3 39.6 128 32 B Q H 3< S+ 0 0 41 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.897 104.1 55.8 -43.9 -48.7 43.3 54.7 37.7 129 33 B S H 3< S+ 0 0 77 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.807 79.6 112.7 -60.7 -32.4 45.2 54.5 41.0 130 34 B I S << S- 0 0 5 -4,-1.1 58,-0.0 -3,-0.8 59,-0.0 -0.167 75.5-108.7 -52.9 127.3 43.7 51.2 42.1 131 35 B P > - 0 0 51 0, 0.0 3,-1.0 0, 0.0 7,-0.2 -0.027 16.1-120.2 -49.4 155.9 46.3 48.4 42.1 132 36 B R G > S+ 0 0 216 1,-0.2 3,-2.4 2,-0.2 4,-0.2 0.705 110.3 77.2 -70.9 -23.0 46.3 45.6 39.5 133 37 B K G 3 S+ 0 0 104 1,-0.3 -1,-0.2 2,-0.1 3,-0.2 0.815 101.7 39.7 -52.3 -29.8 45.9 43.2 42.5 134 38 B H G <> S+ 0 0 4 -3,-1.0 4,-2.9 1,-0.2 3,-0.4 0.024 78.9 137.0-111.4 26.6 42.3 44.5 42.3 135 39 B G H <> S+ 0 0 27 -3,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.759 70.3 46.9 -38.4 -44.0 42.1 44.4 38.5 136 40 B V H > S+ 0 0 17 2,-0.2 4,-2.1 -3,-0.2 -1,-0.2 0.903 114.8 43.4 -75.4 -43.3 38.6 42.9 38.3 137 41 B A H > S+ 0 0 0 -3,-0.4 4,-2.3 2,-0.2 -2,-0.2 0.917 115.6 51.8 -64.2 -43.5 36.9 45.1 40.9 138 42 B R H X S+ 0 0 41 -4,-2.9 4,-2.7 2,-0.2 -2,-0.2 0.952 108.9 48.1 -61.4 -51.8 38.6 48.0 39.3 139 43 B E H X S+ 0 0 49 -4,-2.6 4,-2.9 1,-0.2 5,-0.2 0.921 112.4 50.0 -53.1 -44.3 37.5 47.2 35.8 140 44 B X H X S+ 0 0 35 -4,-2.1 4,-1.7 2,-0.2 -1,-0.2 0.871 110.8 50.2 -64.9 -35.4 33.9 46.7 37.1 141 45 B F H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 3,-0.3 0.977 111.5 47.1 -62.0 -56.5 34.1 50.1 38.9 142 46 B L H X>S+ 0 0 2 -4,-2.7 4,-3.0 1,-0.3 5,-0.5 0.922 111.3 50.8 -53.9 -50.4 35.4 51.9 35.7 143 47 B K H X5S+ 0 0 80 -4,-2.9 4,-1.8 1,-0.2 -1,-0.3 0.869 112.3 48.1 -55.6 -37.2 32.7 50.3 33.6 144 48 B C H X5S+ 0 0 24 -4,-1.7 4,-1.0 -3,-0.3 -1,-0.2 0.895 114.5 46.6 -68.6 -40.4 30.1 51.4 36.2 145 49 B L H <5S+ 0 0 0 -4,-2.6 4,-0.2 2,-0.2 -2,-0.2 0.900 122.7 30.6 -72.7 -46.6 31.5 54.9 36.2 146 50 B L H >X5S+ 0 0 0 -4,-3.0 3,-1.6 1,-0.2 4,-0.6 0.869 114.5 61.4 -81.9 -37.8 31.9 55.6 32.5 147 51 B G H >X S+ 0 0 0 -3,-1.6 4,-2.9 -4,-0.2 3,-0.4 0.943 101.7 53.0 -62.2 -41.8 26.8 58.3 30.8 150 54 B E H < S+ 0 0 6 -4,-1.7 3,-0.7 -5,-0.2 -1,-0.2 0.862 112.2 52.4 -60.6 -35.1 17.1 57.6 28.7 156 60 B G H 3< S+ 0 0 44 -4,-2.3 2,-1.1 1,-0.3 -2,-0.2 0.955 107.8 49.1 -63.6 -51.8 17.5 60.9 26.9 157 61 B K T 3< S+ 0 0 62 -4,-2.7 2,-0.3 -5,-0.1 -1,-0.3 -0.317 113.2 52.4 -83.8 49.2 17.1 59.5 23.4 158 62 B S S < S- 0 0 36 -2,-1.1 227,-0.0 -3,-0.7 -3,-0.0 -0.958 73.8-128.6-166.1 174.9 13.9 57.5 24.3 159 63 B N + 0 0 150 -2,-0.3 2,-0.5 4,-0.0 -4,-0.1 0.103 67.5 109.4-128.4 27.1 10.5 57.9 25.9 160 64 B Q >> - 0 0 90 -5,-0.1 3,-1.0 1,-0.1 4,-0.5 -0.895 54.2-154.2-105.7 126.7 10.5 55.2 28.6 161 65 B V H >> S+ 0 0 45 -2,-0.5 4,-2.4 1,-0.2 3,-0.8 0.766 92.6 73.8 -61.9 -26.9 10.7 55.9 32.3 162 66 B S H 3> S+ 0 0 63 1,-0.3 4,-1.7 2,-0.2 -1,-0.2 0.844 91.2 56.9 -58.2 -34.0 12.2 52.5 32.8 163 67 B K H <> S+ 0 0 64 -3,-1.0 4,-2.0 2,-0.2 -1,-0.3 0.819 107.4 46.0 -66.2 -34.8 15.4 53.8 31.3 164 68 B L H S+ 0 0 0 -4,-2.0 5,-2.9 2,-0.2 4,-2.3 0.938 113.3 43.1 -68.5 -51.4 33.9 49.1 48.5 181 85 B L H <5S+ 0 0 0 -4,-2.8 8,-2.7 1,-0.2 9,-0.9 0.814 121.1 43.5 -66.0 -30.2 37.0 51.1 47.7 182 86 B A H <5S+ 0 0 31 -4,-2.2 -2,-0.2 -5,-0.3 -1,-0.2 0.895 132.8 10.3 -79.2 -40.7 36.7 52.9 51.1 183 87 B G H <5S+ 0 0 51 -4,-2.1 -3,-0.2 -5,-0.2 -2,-0.2 0.343 127.1 37.4-134.8 4.7 36.0 50.0 53.3 184 88 B I T <5S+ 0 0 17 -4,-2.3 2,-0.2 -5,-0.1 -3,-0.2 0.603 91.5 84.2-122.2 -44.0 36.3 46.5 51.8 185 89 B Q S > - 0 0 56 -2,-0.3 4,-2.9 -3,-0.1 3,-0.6 -0.680 35.7-102.9-100.8 160.7 39.3 58.2 52.3 192 96 B P H 3> S+ 0 0 114 0, 0.0 4,-2.6 0, 0.0 -1,-0.1 0.826 125.5 46.5 -46.5 -40.1 36.1 59.2 54.2 193 97 B H H 3> S+ 0 0 116 2,-0.2 4,-2.5 1,-0.2 5,-0.1 0.743 109.0 52.3 -76.1 -33.1 36.4 62.7 52.8 194 98 B Q H <> S+ 0 0 55 -3,-0.6 4,-2.4 2,-0.2 5,-0.2 0.914 112.4 47.5 -68.3 -40.4 37.1 61.5 49.2 195 99 B V H X S+ 0 0 18 -4,-2.9 4,-3.2 2,-0.2 3,-0.3 0.996 112.8 48.6 -58.3 -62.9 33.9 59.3 49.5 196 100 B E H X S+ 0 0 114 -4,-2.6 4,-1.8 1,-0.2 -2,-0.2 0.846 110.6 50.5 -39.6 -49.6 32.0 62.3 50.9 197 101 B T H X S+ 0 0 38 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.932 114.3 44.7 -61.1 -45.1 33.3 64.6 48.1 198 102 B A H X S+ 0 0 0 -4,-2.4 4,-2.6 -3,-0.3 -2,-0.2 0.901 108.7 56.7 -66.0 -39.9 32.2 62.0 45.5 199 103 B Q H X S+ 0 0 75 -4,-3.2 4,-2.5 1,-0.2 -1,-0.2 0.849 107.0 51.0 -59.7 -33.3 28.8 61.5 47.3 200 104 B V H X S+ 0 0 90 -4,-1.8 4,-1.5 -5,-0.3 -1,-0.2 0.948 109.6 47.4 -69.3 -52.6 28.2 65.2 47.0 201 105 B L H X S+ 0 0 34 -4,-1.9 4,-1.3 1,-0.2 -2,-0.2 0.900 115.9 47.0 -51.4 -45.1 28.9 65.2 43.2 202 106 B I H X S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.2 -2,-0.2 0.917 105.9 56.1 -69.6 -42.8 26.7 62.2 42.8 203 107 B A H X S+ 0 0 39 -4,-2.5 4,-1.2 1,-0.2 -1,-0.2 0.805 104.1 55.9 -62.2 -28.0 23.7 63.5 44.8 204 108 B E H X S+ 0 0 45 -4,-1.5 4,-1.8 2,-0.2 3,-0.5 0.946 109.5 44.8 -65.4 -46.8 23.5 66.5 42.7 205 109 B V H X S+ 0 0 0 -4,-1.3 4,-2.4 1,-0.2 -2,-0.2 0.924 112.5 53.7 -63.2 -40.7 23.2 64.4 39.6 206 110 B G H X S+ 0 0 24 -4,-2.8 4,-1.6 1,-0.2 -1,-0.2 0.724 105.2 53.1 -67.8 -22.2 20.7 62.3 41.5 207 111 B R H X S+ 0 0 159 -4,-1.2 4,-1.4 -3,-0.5 -1,-0.2 0.872 109.4 48.0 -80.7 -37.6 18.6 65.3 42.4 208 112 B I H X S+ 0 0 35 -4,-1.8 4,-2.6 2,-0.2 -2,-0.2 0.909 112.6 49.9 -59.1 -48.7 18.4 66.3 38.7 209 113 B L H X S+ 0 0 0 -4,-2.4 4,-2.9 1,-0.2 5,-0.2 0.887 106.2 55.8 -57.4 -44.1 17.4 62.8 37.8 210 114 B G H X S+ 0 0 39 -4,-1.6 4,-1.5 1,-0.2 -1,-0.2 0.859 110.8 44.3 -60.7 -36.6 14.8 62.7 40.5 211 115 B S H X S+ 0 0 72 -4,-1.4 4,-3.4 2,-0.2 5,-0.2 0.917 110.3 54.1 -72.3 -46.8 13.1 65.8 39.0 212 116 B W H X S+ 0 0 46 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.943 111.0 46.9 -50.1 -51.4 13.4 64.5 35.5 213 117 B I H X S+ 0 0 17 -4,-2.9 4,-2.6 1,-0.2 -1,-0.2 0.865 113.6 48.4 -59.9 -38.4 11.6 61.3 36.6 214 118 B A H X S+ 0 0 57 -4,-1.5 4,-1.1 -5,-0.2 -2,-0.2 0.902 109.8 51.3 -71.3 -39.3 9.0 63.4 38.4 215 119 B R H X S+ 0 0 129 -4,-3.4 4,-1.2 2,-0.2 -2,-0.2 0.920 114.2 44.8 -60.9 -43.6 8.5 65.6 35.3 216 120 B V H >< S+ 0 0 42 -4,-2.4 3,-0.5 -5,-0.2 -2,-0.2 0.939 111.5 50.1 -69.9 -47.6 8.0 62.6 33.1 217 121 B N H >< S+ 0 0 80 -4,-2.6 3,-0.6 1,-0.2 -1,-0.2 0.694 106.4 58.8 -64.0 -17.5 5.7 60.7 35.5 218 122 B R H 3< S+ 0 0 230 -4,-1.1 2,-0.5 1,-0.2 -1,-0.2 0.837 97.3 59.7 -76.6 -36.0 3.6 64.0 35.7 219 123 B K T << 0 0 153 -4,-1.2 -1,-0.2 -3,-0.5 -2,-0.1 -0.112 360.0 360.0 -80.0 36.7 3.1 63.8 32.0 220 124 B G < 0 0 106 -3,-0.6 -1,-0.2 -2,-0.5 -2,-0.1 0.969 360.0 360.0 -52.0 360.0 1.4 60.4 32.6 221 !* 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 0.0 222 14 E X > 0 0 130 0, 0.0 4,-0.8 0, 0.0 43,-0.0 0.000 360.0 360.0 360.0 12.7 17.2 20.3 41.2 223 15 E L H > + 0 0 96 2,-0.2 4,-2.3 1,-0.1 5,-0.1 0.515 360.0 70.7 -79.3 -11.3 18.7 16.9 40.6 224 16 E I H > S+ 0 0 3 2,-0.2 4,-1.8 1,-0.2 -1,-0.1 0.900 96.3 45.1 -69.5 -43.5 19.2 18.7 37.3 225 17 E V H > S+ 0 0 11 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.899 114.4 49.7 -64.4 -43.0 21.9 20.9 38.7 226 18 E E H X S+ 0 0 110 -4,-0.8 4,-0.8 1,-0.2 -2,-0.2 0.880 112.1 48.4 -64.2 -37.7 23.4 17.9 40.4 227 19 E R H X S+ 0 0 84 -4,-2.3 4,-0.6 1,-0.2 -1,-0.2 0.817 112.3 49.2 -69.4 -31.9 23.3 16.1 37.1 228 20 E Y H >X S+ 0 0 0 -4,-1.8 4,-2.2 1,-0.2 3,-1.0 0.883 98.6 66.1 -75.8 -36.5 24.9 19.1 35.4 229 21 E E H 3X S+ 0 0 51 -4,-2.8 4,-2.8 1,-0.3 -1,-0.2 0.811 96.7 57.4 -52.7 -30.1 27.7 19.3 38.0 230 22 E R H 3X S+ 0 0 98 -4,-0.8 4,-2.4 2,-0.2 -1,-0.3 0.867 104.4 51.2 -66.3 -37.0 28.9 16.0 36.7 231 23 E V H S+ 0 0 67 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.891 114.3 50.0 -58.8 -35.6 39.7 20.1 33.6 238 30 E I H < S+ 0 0 15 -4,-0.6 -2,-0.2 2,-0.2 3,-0.2 0.919 109.4 49.2 -68.7 -46.6 39.5 19.5 29.9 239 31 E A H >< S+ 0 0 0 -4,-3.1 3,-1.4 1,-0.2 -1,-0.2 0.901 109.4 55.5 -53.0 -45.0 38.6 23.1 29.2 240 32 E Q H 3< S+ 0 0 42 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.844 101.0 55.9 -59.9 -38.6 41.5 24.1 31.4 241 33 E S T 3< S+ 0 0 93 -4,-1.5 -1,-0.3 -3,-0.2 -2,-0.2 0.072 77.8 115.4 -87.7 23.9 44.1 22.1 29.4 242 34 E I S < S- 0 0 5 -3,-1.4 58,-0.1 1,-0.1 59,-0.0 -0.849 76.5-109.6 -87.1 128.0 43.2 23.9 26.2 243 35 E P > - 0 0 72 0, 0.0 3,-2.2 0, 0.0 7,-0.2 -0.157 17.3-115.8 -63.5 153.5 46.3 25.9 25.1 244 36 E R G > S+ 0 0 238 1,-0.3 3,-2.2 2,-0.2 4,-0.2 0.647 107.6 84.3 -64.1 -14.7 46.3 29.7 25.3 245 37 E K G 3 S+ 0 0 109 1,-0.3 -1,-0.3 2,-0.1 3,-0.2 0.844 99.8 36.7 -50.1 -38.1 46.6 29.5 21.5 246 38 E H G <> S+ 0 0 9 -3,-2.2 4,-2.9 1,-0.2 3,-0.4 -0.198 82.8 141.2-107.4 39.1 42.8 29.2 21.6 247 39 E G H <> + 0 0 28 -3,-2.2 4,-1.6 1,-0.2 -1,-0.2 0.819 68.1 47.4 -52.4 -43.7 42.5 31.6 24.5 248 40 E V H > S+ 0 0 17 -3,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.871 115.5 45.3 -69.4 -35.2 39.3 33.4 23.3 249 41 E A H > S+ 0 0 0 -3,-0.4 4,-2.3 2,-0.2 -2,-0.2 0.897 107.8 58.4 -75.9 -40.8 37.5 30.2 22.5 250 42 E R H X S+ 0 0 49 -4,-2.9 4,-2.3 1,-0.2 -1,-0.2 0.900 109.0 45.5 -47.7 -48.8 38.6 28.6 25.8 251 43 E E H X S+ 0 0 59 -4,-1.6 4,-2.9 2,-0.2 -1,-0.2 0.876 109.5 51.6 -70.8 -40.5 36.9 31.4 27.7 252 44 E X H X S+ 0 0 34 -4,-1.7 4,-2.5 2,-0.2 -1,-0.2 0.911 111.8 50.4 -63.0 -36.4 33.7 31.4 25.7 253 45 E F H X S+ 0 0 0 -4,-2.3 4,-2.9 2,-0.2 -2,-0.2 0.924 111.3 46.7 -64.2 -47.7 33.6 27.6 26.4 254 46 E L H X>S+ 0 0 1 -4,-2.3 4,-2.5 2,-0.2 5,-0.6 0.880 112.4 51.4 -60.4 -37.8 34.1 28.1 30.1 255 47 E K H X5S+ 0 0 77 -4,-2.9 4,-1.6 1,-0.2 -2,-0.2 0.909 113.1 43.6 -70.1 -39.1 31.5 30.9 30.1 256 48 E C H X5S+ 0 0 24 -4,-2.5 4,-1.4 -5,-0.2 -2,-0.2 0.952 116.6 49.3 -67.0 -46.1 29.0 28.7 28.4 257 49 E L H <5S+ 0 0 0 -4,-2.9 3,-0.4 2,-0.2 4,-0.3 0.958 122.8 27.5 -58.2 -61.1 29.9 25.7 30.6 258 50 E L H ><5S+ 0 0 0 -4,-2.5 3,-1.7 1,-0.2 4,-0.4 0.903 116.5 63.6 -70.8 -36.0 29.8 27.2 34.1 259 51 E G H >X S+ 0 0 0 -3,-1.7 4,-3.2 -4,-0.3 -1,-0.3 0.914 98.2 52.0 -59.4 -41.5 24.1 26.6 36.0 262 54 E E H <> S+ 0 0 83 -3,-0.9 4,-3.6 -4,-0.4 5,-0.3 0.914 104.1 57.7 -62.4 -40.3 22.5 30.1 36.2 263 55 E L H X S+ 0 0 57 -4,-1.1 4,-2.1 2,-0.2 16,-0.2 0.930 112.9 39.4 -52.8 -49.7 20.2 29.2 33.3 264 56 E F H X S+ 0 0 0 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.958 116.5 50.7 -64.1 -51.2 18.9 26.2 35.3 265 57 E I H X S+ 0 0 11 -4,-3.2 4,-1.5 1,-0.2 -2,-0.2 0.882 112.9 46.2 -53.2 -42.6 18.9 28.2 38.6 266 58 E V H X S+ 0 0 40 -4,-3.6 4,-0.8 -5,-0.2 -1,-0.2 0.872 107.9 57.2 -71.2 -38.4 17.0 31.1 36.9 267 59 E A H >< S+ 0 0 1 -4,-2.1 3,-1.8 -5,-0.3 -2,-0.2 0.984 106.3 50.3 -51.9 -59.8 14.5 28.6 35.3 268 60 E G H 3< S+ 0 0 42 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.842 107.8 50.3 -48.8 -47.7 13.6 27.2 38.7 269 61 E K H 3< S+ 0 0 78 -4,-1.5 2,-0.4 1,-0.1 -1,-0.3 0.672 111.4 59.7 -65.1 -17.8 12.9 30.6 40.4 270 62 E S << - 0 0 28 -3,-1.8 -1,-0.1 -4,-0.8 5,-0.1 -0.946 66.2-150.9-127.1 132.1 10.6 31.6 37.5 271 63 E N + 0 0 148 -2,-0.4 -1,-0.1 4,-0.1 5,-0.1 0.736 62.4 113.5 -69.2 -24.8 7.5 30.1 36.0 272 64 E Q >> - 0 0 93 1,-0.2 3,-1.0 2,-0.1 4,-0.7 -0.257 59.4-149.5 -58.7 126.0 8.1 31.3 32.4 273 65 E V H 3> S+ 0 0 52 1,-0.2 4,-1.7 2,-0.2 3,-0.4 0.764 93.3 74.3 -61.8 -26.9 8.7 28.5 29.9 274 66 E S H 3> S+ 0 0 60 1,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.846 93.3 53.1 -57.7 -34.6 10.9 31.0 28.0 275 67 E K H 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