==== 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 OXIDOREDUCTASE 26-OCT-07 3B5P . COMPND 2 MOLECULE: CADD-LIKE PROTEIN OF UNKNOWN FUNCTION; . SOURCE 2 ORGANISM_SCIENTIFIC: NOSTOC PUNCTIFORME; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 230 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11022.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 179 77.8 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 . 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 . 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 . 5 2.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 23 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 144 62.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 2.2 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 0 0 0 1 2 0 2 1 0 0 1 0 1 0 0 0 0 0 0 1 0 0 1 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 0 A G > 0 0 57 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0-154.5 6.1 28.2 13.3 2 1 A X H > + 0 0 174 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.860 360.0 45.9 -64.1 -41.9 4.7 30.8 15.6 3 2 A E H > S+ 0 0 126 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.949 117.1 43.7 -68.1 -47.2 1.0 30.3 14.7 4 3 A F H > S+ 0 0 6 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.846 111.2 54.7 -66.1 -37.5 1.1 26.5 14.8 5 4 A N H X S+ 0 0 65 -4,-2.7 4,-2.2 2,-0.2 -1,-0.2 0.891 106.5 53.1 -60.1 -38.3 3.1 26.6 18.0 6 5 A H H X S+ 0 0 119 -4,-1.7 4,-1.8 -5,-0.2 -2,-0.2 0.906 111.3 45.4 -63.0 -40.1 0.3 28.7 19.5 7 6 A L H X S+ 0 0 22 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.942 112.5 49.2 -69.3 -47.5 -2.3 26.1 18.5 8 7 A T H X S+ 0 0 5 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.870 108.7 54.2 -65.5 -35.8 -0.3 23.1 19.7 9 8 A K H X S+ 0 0 84 -4,-2.2 4,-2.1 -5,-0.2 -1,-0.2 0.917 109.0 48.2 -60.0 -44.6 0.3 24.9 23.1 10 9 A Q H X S+ 0 0 97 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.912 110.7 51.7 -62.4 -43.6 -3.5 25.4 23.5 11 10 A L H X S+ 0 0 13 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.895 110.6 47.4 -61.2 -44.2 -4.2 21.7 22.6 12 11 A N H X S+ 0 0 52 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.877 111.0 52.2 -61.0 -42.0 -1.7 20.5 25.2 13 12 A Q H X S+ 0 0 95 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.856 107.8 51.2 -61.8 -42.4 -3.2 22.9 27.8 14 13 A L H X S+ 0 0 29 -4,-2.1 4,-2.4 2,-0.2 5,-0.2 0.915 111.5 48.6 -57.3 -45.6 -6.7 21.5 27.1 15 14 A L H X S+ 0 0 9 -4,-2.0 4,-1.0 1,-0.2 7,-0.2 0.927 114.4 45.5 -59.3 -46.2 -5.3 17.9 27.6 16 15 A A H < S+ 0 0 88 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.783 122.1 34.5 -72.8 -31.0 -3.6 18.9 30.8 17 16 A Q H < S+ 0 0 141 -4,-2.0 -2,-0.2 -5,-0.1 -1,-0.2 0.753 124.2 33.4 -94.8 -29.0 -6.6 20.9 32.3 18 17 A D H < S+ 0 0 102 -4,-2.4 2,-0.6 -5,-0.2 -3,-0.2 0.486 96.1 79.4-114.4 -4.1 -9.7 19.0 31.1 19 18 A Y >< - 0 0 17 -4,-1.0 3,-1.1 -5,-0.2 4,-0.2 -0.896 44.6-173.4-124.1 105.8 -9.0 15.3 30.9 20 19 A V G > S+ 0 0 52 -2,-0.6 3,-1.3 1,-0.2 6,-0.2 0.748 79.3 72.4 -65.5 -24.9 -9.0 13.0 34.0 21 20 A A G 3 S+ 0 0 0 1,-0.3 -1,-0.2 6,-0.2 8,-0.1 0.773 100.3 43.8 -65.2 -28.5 -7.7 10.0 32.1 22 21 A F G < S+ 0 0 17 -3,-1.1 2,-0.3 -7,-0.2 -1,-0.3 0.400 90.0 104.9-101.0 2.0 -4.2 11.4 31.7 23 22 A S <> - 0 0 30 -3,-1.3 4,-1.1 -4,-0.2 -7,-0.0 -0.665 69.5-138.9 -83.5 136.8 -3.9 12.7 35.3 24 23 A I T 4 S+ 0 0 70 -2,-0.3 -1,-0.1 1,-0.2 -4,-0.0 0.698 103.3 30.4 -71.1 -21.5 -1.7 10.6 37.5 25 24 A T T 4 S+ 0 0 94 -5,-0.0 -1,-0.2 6,-0.0 -5,-0.1 0.730 122.0 44.9-104.4 -34.1 -4.2 11.0 40.4 26 25 A E T 4 S+ 0 0 97 -6,-0.2 -2,-0.2 -7,-0.1 -6,-0.1 0.359 74.7 125.6 -99.9 2.0 -7.7 11.3 38.7 27 26 A N X - 0 0 1 -4,-1.1 4,-2.3 1,-0.1 5,-0.2 -0.403 66.1-128.3 -57.9 135.5 -7.3 8.5 36.1 28 27 A P H > S+ 0 0 19 0, 0.0 4,-0.6 0, 0.0 -1,-0.1 0.810 107.5 47.3 -67.1 -30.4 -10.3 6.1 36.6 29 28 A V H >4 S+ 0 0 0 2,-0.2 3,-0.9 1,-0.1 4,-0.3 0.926 113.5 49.3 -66.0 -45.8 -8.2 2.9 36.9 30 29 A V H >4 S+ 0 0 18 1,-0.3 3,-1.4 2,-0.2 4,-0.3 0.888 105.9 56.2 -62.4 -40.3 -5.9 4.7 39.4 31 30 A Q H 3< S+ 0 0 106 -4,-2.3 -1,-0.3 1,-0.3 3,-0.2 0.722 111.4 44.9 -62.8 -26.1 -8.8 5.9 41.5 32 31 A X T X< S+ 0 0 89 -3,-0.9 3,-1.7 -4,-0.6 4,-0.3 0.284 78.8 106.1-103.2 9.7 -10.0 2.3 41.9 33 32 A L G X S+ 0 0 11 -3,-1.4 3,-1.1 1,-0.3 -1,-0.1 0.817 74.9 59.9 -58.7 -35.4 -6.6 0.7 42.7 34 33 A S G 3 S+ 0 0 100 -4,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.700 108.3 46.1 -62.6 -22.9 -7.6 0.3 46.4 35 34 A Q G < S+ 0 0 135 -3,-1.7 2,-0.3 2,-0.1 -1,-0.2 0.336 99.3 94.8-101.3 3.4 -10.5 -1.9 45.2 36 35 A A < - 0 0 18 -3,-1.1 2,-0.2 -4,-0.3 194,-0.1 -0.692 60.1-142.0-105.3 148.7 -8.6 -4.1 42.7 37 36 A S > - 0 0 54 -2,-0.3 4,-1.7 1,-0.1 3,-0.3 -0.595 37.3-102.1 -89.9 164.7 -6.8 -7.5 42.8 38 37 A F H > S+ 0 0 101 1,-0.2 4,-2.4 -2,-0.2 5,-0.2 0.907 122.6 52.1 -47.1 -48.1 -3.6 -8.3 41.1 39 38 A A H > S+ 0 0 68 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.831 105.7 52.9 -65.6 -34.9 -5.6 -10.2 38.3 40 39 A Q H > S+ 0 0 63 -3,-0.3 4,-1.2 2,-0.2 -1,-0.2 0.873 113.5 42.7 -70.7 -37.5 -7.9 -7.2 37.6 41 40 A I H X S+ 0 0 0 -4,-1.7 4,-2.3 2,-0.2 -2,-0.2 0.836 110.0 57.1 -76.1 -33.2 -4.9 -4.8 37.1 42 41 A A H X S+ 0 0 9 -4,-2.4 4,-2.3 -5,-0.2 -2,-0.2 0.902 105.1 52.7 -58.5 -40.2 -3.1 -7.5 35.1 43 42 A Y H X S+ 0 0 73 -4,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.874 107.5 52.1 -62.0 -39.8 -6.2 -7.5 32.8 44 43 A V H X S+ 0 0 0 -4,-1.2 4,-2.7 2,-0.2 -2,-0.2 0.899 110.1 47.1 -60.4 -47.0 -5.8 -3.7 32.5 45 44 A X H X S+ 0 0 0 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.863 111.0 52.4 -62.4 -39.1 -2.1 -4.1 31.5 46 45 A Q H < S+ 0 0 53 -4,-2.3 4,-0.4 2,-0.2 -2,-0.2 0.902 112.9 43.1 -64.5 -47.2 -3.0 -6.8 29.0 47 46 A Q H >< S+ 0 0 8 -4,-2.1 3,-1.6 1,-0.2 4,-0.5 0.930 111.2 55.4 -66.5 -43.3 -5.7 -4.6 27.3 48 47 A Y H >< S+ 0 0 20 -4,-2.7 3,-2.0 1,-0.3 -2,-0.2 0.919 97.4 65.7 -51.8 -45.5 -3.4 -1.5 27.4 49 48 A S T 3X S+ 0 0 0 -4,-2.0 4,-1.7 1,-0.3 -1,-0.3 0.654 85.3 71.4 -56.0 -18.7 -0.8 -3.5 25.5 50 49 A I H <> S+ 0 0 5 -3,-1.6 4,-1.7 -4,-0.4 -1,-0.3 0.821 91.3 59.1 -70.5 -27.5 -2.9 -3.8 22.4 51 50 A F H <> S+ 0 0 19 -3,-2.0 4,-0.8 -4,-0.5 3,-0.4 0.975 107.5 42.7 -72.1 -52.3 -2.4 -0.0 21.7 52 51 A P H >> S+ 0 0 30 0, 0.0 3,-0.6 0, 0.0 4,-0.5 0.882 112.6 57.8 -51.4 -36.3 1.4 -0.2 21.4 53 52 A K H 3< S+ 0 0 89 -4,-1.7 4,-0.2 1,-0.2 -2,-0.2 0.881 114.9 35.0 -60.8 -38.1 0.9 -3.4 19.4 54 53 A E H 3X S+ 0 0 77 -4,-1.7 4,-1.7 -3,-0.4 -1,-0.2 0.413 93.1 93.7 -97.6 0.8 -1.2 -1.6 16.8 55 54 A L H S+ 0 0 42 -4,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.905 111.1 45.5 -60.2 -46.9 -0.0 0.3 11.8 58 57 A F H X S+ 0 0 13 -4,-1.7 4,-2.1 2,-0.2 -1,-0.2 0.889 111.4 52.2 -62.8 -40.6 -1.8 3.5 12.6 59 58 A T H X S+ 0 0 10 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.853 107.9 53.3 -65.2 -34.0 1.4 5.6 12.1 60 59 A E H X S+ 0 0 38 -4,-2.0 4,-2.0 -5,-0.2 -1,-0.2 0.855 106.2 51.5 -69.7 -35.2 1.7 3.9 8.7 61 60 A L H X S+ 0 0 71 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.926 111.4 48.3 -65.8 -39.3 -1.9 5.0 7.8 62 61 A A H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.866 109.2 53.3 -64.1 -40.4 -0.9 8.6 8.8 63 62 A R H X S+ 0 0 53 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.883 108.5 49.6 -61.9 -41.2 2.3 8.3 6.7 64 63 A R H X S+ 0 0 161 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.895 110.3 50.1 -66.2 -38.5 0.2 7.3 3.7 65 64 A K H X S+ 0 0 66 -4,-2.2 4,-1.4 2,-0.2 -2,-0.2 0.920 111.2 50.0 -61.3 -43.8 -2.2 10.3 4.3 66 65 A A H ><>S+ 0 0 0 -4,-2.3 5,-2.7 2,-0.2 3,-0.6 0.955 111.6 47.0 -59.1 -52.5 0.9 12.6 4.5 67 66 A L H ><5S+ 0 0 76 -4,-2.5 3,-1.8 1,-0.2 -1,-0.2 0.921 109.0 56.2 -53.9 -47.5 2.4 11.3 1.3 68 67 A G H 3<5S+ 0 0 73 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.766 109.6 44.8 -58.7 -31.1 -1.0 11.6 -0.5 69 68 A A T <<5S- 0 0 48 -4,-1.4 -1,-0.3 -3,-0.6 -2,-0.2 0.404 117.4-110.8 -87.3 -2.6 -1.2 15.3 0.4 70 69 A G T < 5S+ 0 0 34 -3,-1.8 2,-1.7 -4,-0.5 3,-0.2 0.685 71.0 143.6 73.8 18.8 2.4 16.0 -0.6 71 70 A W >>< + 0 0 17 -5,-2.7 4,-1.9 -6,-0.2 3,-0.6 -0.543 18.0 163.0 -88.4 71.0 3.4 16.6 3.1 72 71 A N H 3> + 0 0 97 -2,-1.7 4,-2.0 1,-0.3 -1,-0.2 0.835 64.6 55.1 -70.5 -36.7 6.7 14.9 2.4 73 72 A G H 3> S+ 0 0 30 -3,-0.2 4,-1.6 1,-0.2 -1,-0.3 0.838 110.7 48.5 -62.9 -32.2 8.6 16.2 5.4 74 73 A V H <> S+ 0 0 0 -3,-0.6 4,-2.2 120,-0.3 -2,-0.2 0.877 107.4 53.3 -77.2 -39.8 5.9 14.7 7.6 75 74 A A H X S+ 0 0 3 -4,-1.9 4,-1.7 1,-0.2 -2,-0.2 0.852 111.4 49.2 -63.7 -34.4 5.9 11.3 5.8 76 75 A Q H X S+ 0 0 109 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.886 109.6 49.2 -69.3 -44.2 9.7 11.3 6.5 77 76 A E H X S+ 0 0 35 -4,-1.6 4,-1.7 2,-0.2 -2,-0.2 0.901 112.1 49.2 -60.3 -43.9 9.3 12.1 10.2 78 77 A L H X S+ 0 0 1 -4,-2.2 4,-3.2 2,-0.2 -2,-0.2 0.882 108.2 53.9 -63.5 -39.0 6.6 9.4 10.7 79 78 A Q H X S+ 0 0 50 -4,-1.7 4,-2.5 2,-0.2 -2,-0.2 0.903 106.8 50.8 -62.5 -45.1 8.9 6.9 8.9 80 79 A E H X S+ 0 0 84 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.897 112.3 48.6 -58.8 -38.7 11.7 7.6 11.4 81 80 A N H X S+ 0 0 6 -4,-1.7 4,-2.8 2,-0.2 -2,-0.2 0.953 110.3 49.4 -65.0 -49.7 9.2 7.1 14.2 82 81 A I H X S+ 0 0 11 -4,-3.2 4,-2.0 1,-0.2 -2,-0.2 0.890 110.2 53.3 -51.2 -44.1 8.0 3.8 12.6 83 82 A D H <>S+ 0 0 77 -4,-2.5 5,-1.8 2,-0.2 4,-0.5 0.905 109.9 45.9 -63.7 -45.0 11.7 2.8 12.4 84 83 A E H ><5S+ 0 0 56 -4,-2.0 3,-1.7 3,-0.2 5,-0.3 0.955 112.1 51.4 -57.1 -53.6 12.3 3.5 16.1 85 84 A E H 3<5S+ 0 0 31 -4,-2.8 10,-2.4 1,-0.3 11,-0.5 0.825 110.0 50.2 -54.2 -36.7 9.1 1.6 17.1 86 85 A X T 3<5S- 0 0 108 -4,-2.0 -1,-0.3 8,-0.2 8,-0.2 0.491 131.3 -88.9 -85.2 -5.7 10.2 -1.4 15.1 87 86 A G T < >S+ 0 0 2 -3,-1.7 5,-3.7 -4,-0.5 3,-0.5 0.732 76.4 138.8 113.3 30.6 13.7 -1.5 16.7 88 87 A S T - 0 0 22 -2,-0.5 4,-2.5 -8,-0.2 -8,-0.2 -0.222 14.9-119.5 -67.4 156.2 10.2 -3.6 18.6 95 94 A H H > S+ 0 0 30 -10,-2.4 4,-2.5 2,-0.2 5,-0.2 0.854 116.5 56.1 -57.2 -40.7 9.1 -1.5 21.5 96 95 A Y H > S+ 0 0 38 -11,-0.5 4,-3.1 -44,-0.2 5,-0.2 0.954 108.5 46.5 -58.8 -47.8 6.0 -3.8 21.8 97 96 A T H > S+ 0 0 47 2,-0.2 4,-2.4 1,-0.2 5,-0.3 0.919 111.2 51.7 -59.9 -44.8 8.2 -6.8 22.1 98 97 A L H X S+ 0 0 38 -4,-2.5 4,-1.5 1,-0.2 -1,-0.2 0.921 115.6 42.4 -58.6 -41.4 10.4 -5.0 24.7 99 98 A L H X S+ 0 0 3 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.933 114.5 49.2 -67.2 -49.9 7.2 -4.2 26.7 100 99 A A H X S+ 0 0 0 -4,-3.1 4,-2.3 1,-0.2 11,-0.2 0.909 115.5 43.0 -56.9 -50.1 5.5 -7.6 26.3 101 100 A D H X S+ 0 0 44 -4,-2.4 4,-2.7 2,-0.2 5,-0.5 0.832 112.0 54.8 -66.9 -37.7 8.6 -9.5 27.4 102 101 A G H X S+ 0 0 2 -4,-1.5 4,-1.5 -5,-0.3 5,-0.3 0.885 111.6 44.0 -62.1 -43.2 9.3 -7.1 30.2 103 102 A L H X>S+ 0 0 0 -4,-2.4 6,-2.0 3,-0.2 4,-1.7 0.878 117.6 44.8 -68.6 -42.5 5.8 -7.6 31.6 104 103 A E H X5S+ 0 0 86 -4,-2.3 4,-1.1 4,-0.2 -2,-0.2 0.963 123.7 31.7 -68.9 -50.2 5.8 -11.3 31.2 105 104 A E H <5S+ 0 0 152 -4,-2.7 -3,-0.2 -5,-0.2 -2,-0.2 0.874 128.0 41.0 -78.2 -36.7 9.3 -12.0 32.6 106 105 A G H <5S+ 0 0 24 -4,-1.5 -3,-0.2 -5,-0.5 -2,-0.2 0.872 133.7 14.9 -75.9 -40.7 9.3 -9.1 35.1 107 106 A L H <5S- 0 0 19 -4,-1.7 -3,-0.2 -5,-0.3 -2,-0.2 0.604 94.4-115.5-111.9 -19.0 5.7 -9.3 36.4 108 107 A G S < + 0 0 2 -2,-0.4 3,-1.8 -11,-0.2 -1,-0.1 0.536 47.8 92.8-123.6 -13.0 0.0 -10.2 27.0 112 111 A K T 3 S+ 0 0 88 1,-0.3 -1,-0.0 -12,-0.1 -11,-0.0 0.827 93.8 42.2 -61.2 -30.1 1.0 -11.6 23.6 113 112 A N T 3 S+ 0 0 164 2,-0.1 -1,-0.3 0, 0.0 -2,-0.1 0.382 84.4 135.4 -95.6 5.1 -2.2 -13.7 23.3 114 113 A T < - 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0 0 18 0, 0.0 4,-2.0 0, 0.0 3,-0.4 -0.259 34.0-104.8 -58.7 156.2 12.0 -5.0 37.1 170 169 A K H > S+ 0 0 184 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.856 114.9 45.7 -56.7 -50.1 15.3 -4.5 35.2 171 170 A D H > S+ 0 0 97 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.825 112.9 48.8 -65.9 -35.6 14.0 -4.7 31.6 172 171 A L H > S+ 0 0 0 -3,-0.4 4,-2.5 -70,-0.3 5,-0.2 0.820 108.5 56.3 -71.4 -32.4 10.9 -2.5 32.1 173 172 A Q H X S+ 0 0 86 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.931 106.4 49.2 -64.4 -43.4 13.2 0.1 33.8 174 173 A Y H X S+ 0 0 118 -4,-2.0 4,-2.3 1,-0.2 5,-0.2 0.972 112.7 48.8 -52.5 -55.9 15.3 0.1 30.6 175 174 A F H X S+ 0 0 28 -4,-2.0 4,-1.4 1,-0.2 -2,-0.2 0.856 114.1 43.6 -54.3 -47.2 12.1 0.6 28.5 176 175 A F H X S+ 0 0 18 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.896 113.0 53.4 -69.5 -38.6 10.8 3.5 30.7 177 176 A S H < S+ 0 0 47 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.873 107.3 49.3 -63.5 -39.2 14.2 5.1 30.9 178 177 A K H < S+ 0 0 113 -4,-2.3 4,-0.5 -5,-0.2 -1,-0.2 0.858 119.5 38.0 -73.7 -32.8 14.7 5.3 27.2 179 178 A H H < S+ 0 0 75 -4,-1.4 2,-2.0 -5,-0.2 -2,-0.2 0.960 111.5 53.1 -76.9 -60.9 11.3 6.8 26.6 180 179 A L S < S+ 0 0 66 -4,-2.5 -1,-0.2 -5,-0.2 3,-0.0 -0.547 99.8 77.7 -79.5 78.2 10.8 9.2 29.5 181 180 A D S S- 0 0 117 -2,-2.0 2,-0.4 -3,-0.2 -1,-0.2 0.338 114.6 -19.0-153.6-100.3 14.1 10.8 28.6 182 181 A E 0 0 114 -4,-0.5 -2,-0.0 -3,-0.2 0, 0.0 -0.948 360.0 360.0-121.5 127.2 14.1 13.1 25.7 183 182 A W 0 0 28 -2,-0.4 -4,-0.1 3,-0.1 -33,-0.0 -0.893 360.0 360.0 129.1 360.0 10.9 12.2 23.8 184 ! 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 0.0 185 184 A I > 0 0 114 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -65.5 10.5 16.5 23.5 186 185 A E H > + 0 0 64 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.894 360.0 44.3 -65.1 -41.6 12.8 15.5 20.5 187 186 A H H > S+ 0 0 25 2,-0.2 4,-1.8 1,-0.1 -1,-0.2 0.883 115.6 46.4 -64.9 -46.2 9.9 13.4 19.2 188 187 A E H > S+ 0 0 39 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.934 114.0 47.8 -67.2 -44.2 7.2 16.0 19.9 189 188 A A H X S+ 0 0 31 -4,-2.7 4,-2.7 1,-0.2 5,-0.3 0.833 108.5 55.1 -65.1 -36.2 9.3 18.8 18.3 190 189 A G H X S+ 0 0 14 -4,-1.5 4,-1.7 -5,-0.2 -1,-0.2 0.928 113.1 40.2 -67.0 -45.9 10.1 16.8 15.2 191 190 A L H X S+ 0 0 1 -4,-1.8 4,-2.3 2,-0.2 5,-0.2 0.915 116.2 50.9 -69.3 -46.5 6.4 16.1 14.4 192 191 A R H X S+ 0 0 45 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.953 114.7 41.9 -52.3 -54.9 5.3 19.6 15.3 193 192 A T H X S+ 0 0 85 -4,-2.7 4,-0.8 1,-0.2 -1,-0.2 0.832 112.3 54.2 -71.1 -30.2 7.9 21.3 13.1 194 193 A S H >< S+ 0 0 13 -4,-1.7 3,-0.6 -5,-0.3 -120,-0.3 0.941 112.4 43.6 -66.8 -42.5 7.5 18.9 10.2 195 194 A V H >X S+ 0 0 3 -4,-2.3 4,-2.5 1,-0.2 3,-2.3 0.900 105.4 62.8 -69.6 -37.9 3.7 19.6 10.1 196 195 A A H 3< S+ 0 0 24 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.771 92.5 67.5 -60.6 -21.8 4.2 23.4 10.5 197 196 A A T << S+ 0 0 73 -4,-0.8 -1,-0.3 -3,-0.6 -2,-0.2 0.674 118.2 17.1 -68.9 -20.1 6.0 23.3 7.2 198 197 A Y T <4 S+ 0 0 72 -3,-2.3 -2,-0.2 -4,-0.2 -1,-0.1 0.650 96.2 100.9-123.2 -32.8 2.8 22.4 5.3 199 198 A I < - 0 0 13 -4,-2.5 -195,-0.1 1,-0.0 5,-0.0 -0.394 55.4-149.1 -69.5 138.8 -0.3 23.2 7.4 200 199 A Q > - 0 0 93 -2,-0.1 3,-2.5 1,-0.1 4,-0.3 -0.761 25.3-113.1-103.2 151.8 -2.3 26.5 6.7 201 200 A P G > S+ 0 0 62 0, 0.0 3,-1.7 0, 0.0 4,-0.4 0.850 116.0 61.4 -56.9 -34.8 -4.2 28.6 9.3 202 201 A E G 3 S+ 0 0 152 1,-0.3 4,-0.2 2,-0.1 3,-0.1 0.558 102.5 53.9 -66.6 -7.5 -7.5 27.7 7.6 203 202 A E G <> S+ 0 0 54 -3,-2.5 4,-2.1 2,-0.1 -1,-0.3 0.372 80.7 91.9-103.7 2.4 -6.8 24.0 8.4 204 203 A F H <> S+ 0 0 36 -3,-1.7 4,-2.8 -4,-0.3 5,-0.2 0.856 80.5 59.2 -66.9 -33.5 -6.2 24.5 12.2 205 204 A G H > S+ 0 0 54 -4,-0.4 4,-2.0 2,-0.2 -1,-0.2 0.918 107.7 44.0 -59.0 -49.2 -9.8 23.8 12.9 206 205 A E H > S+ 0 0 76 2,-0.2 4,-2.5 -4,-0.2 -2,-0.2 0.897 112.2 53.0 -64.1 -39.9 -9.6 20.3 11.4 207 206 A F H X S+ 0 0 1 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.945 111.2 46.4 -59.3 -48.8 -6.3 19.6 13.1 208 207 A A H X S+ 0 0 27 -4,-2.8 4,-2.7 2,-0.2 -1,-0.2 0.861 111.0 52.5 -60.9 -41.1 -7.8 20.6 16.5 209 208 A A H X S+ 0 0 41 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.895 109.1 49.9 -60.2 -42.8 -10.9 18.5 15.8 210 209 A G H X S+ 0 0 0 -4,-2.5 4,-1.6 2,-0.2 -2,-0.2 0.901 112.1 48.1 -55.7 -47.7 -8.7 15.5 15.0 211 210 A F H X S+ 0 0 0 -4,-2.0 4,-2.2 2,-0.2 5,-0.2 0.943 112.6 47.6 -58.4 -54.9 -6.8 16.0 18.3 212 211 A R H X S+ 0 0 109 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.903 109.6 54.0 -52.4 -48.7 -10.0 16.3 20.4 213 212 A A H X S+ 0 0 20 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.856 110.1 47.5 -57.7 -37.8 -11.5 13.2 18.8 214 213 A X H X S+ 0 0 0 -4,-1.6 4,-2.4 2,-0.2 -1,-0.2 0.910 113.3 44.5 -72.6 -46.7 -8.4 11.1 19.7 215 214 A I H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.851 113.2 53.4 -71.9 -30.6 -8.2 12.2 23.4 216 215 A D H X S+ 0 0 71 -4,-2.5 4,-2.5 -5,-0.2 -2,-0.2 0.942 111.4 45.2 -59.5 -52.9 -12.0 11.8 23.7 217 216 A A H X S+ 0 0 12 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.895 114.7 48.9 -58.4 -43.6 -11.7 8.2 22.4 218 217 A X H X S+ 0 0 7 -4,-2.4 4,-1.8 2,-0.2 -1,-0.2 0.921 111.6 47.2 -65.7 -46.4 -8.7 7.5 24.6 219 218 A Q H X S+ 0 0 30 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.908 110.1 53.3 -60.7 -44.7 -10.3 8.9 27.8 220 219 A V H X S+ 0 0 47 -4,-2.5 4,-2.6 1,-0.2 5,-0.2 0.908 106.8 55.2 -55.3 -41.0 -13.6 7.0 27.1 221 220 A W H X S+ 0 0 14 -4,-1.9 4,-3.0 1,-0.2 5,-0.2 0.943 106.8 46.8 -60.8 -50.6 -11.4 3.8 26.8 222 221 A W H X S+ 0 0 4 -4,-1.8 4,-1.8 1,-0.2 -1,-0.2 0.866 114.1 50.4 -57.2 -39.3 -9.7 4.2 30.3 223 222 A Q H X S+ 0 0 82 -4,-2.0 4,-1.5 2,-0.2 -2,-0.2 0.918 114.2 42.7 -64.6 -46.6 -13.2 4.9 31.8 224 223 A E H X S+ 0 0 57 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.881 112.1 53.7 -71.0 -41.1 -14.8 1.8 30.2 225 224 A L H X S+ 0 0 0 -4,-3.0 4,-2.6 -5,-0.2 5,-0.2 0.867 106.1 53.4 -56.9 -39.9 -11.8 -0.4 31.0 226 225 A A H X>S+ 0 0 10 -4,-1.8 4,-2.4 -5,-0.2 5,-0.9 0.922 111.2 47.2 -63.5 -39.0 -12.0 0.7 34.7 227 226 A Q H <5S+ 0 0 133 -4,-1.5 4,-0.3 1,-0.2 -2,-0.2 0.862 114.1 46.1 -71.2 -41.2 -15.7 -0.4 34.7 228 227 A E H <5S+ 0 0 68 -4,-2.3 -2,-0.2 1,-0.1 -1,-0.2 0.912 121.2 37.8 -58.3 -47.8 -14.9 -3.8 32.9 229 228 A A H <5S+ 0 0 10 -4,-2.6 -2,-0.2 2,-0.2 -3,-0.2 0.826 128.5 22.1 -82.6 -39.1 -12.0 -4.6 35.2 230 229 A I T <5 0 0 18 -4,-2.4 -3,-0.2 -5,-0.2 -2,-0.1 0.803 360.0 360.0-113.4 -38.1 -12.9 -3.4 38.7 231 230 A S < 0 0 113 -5,-0.9 -1,-0.2 -4,-0.3 -2,-0.2 -0.638 360.0 360.0-138.7 360.0 -16.7 -3.3 38.7