==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ELECTRON TRANSPORT 21-JUN-95 1PHN . COMPND 2 MOLECULE: PHYCOCYANIN; . SOURCE 2 ORGANISM_SCIENTIFIC: CYANIDIUM CALDARIUM; . AUTHOR B.STEC,R.F.TROXLER,M.M.TEETER . 334 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15869.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 265 79.3 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 . 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 . 3 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 215 64.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 2.4 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 1 1 2 0 0 1 2 1 1 2 0 1 1 1 0 0 0 0 2 0 1 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 . 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 1 A M 0 0 27 0, 0.0 2,-0.4 0, 0.0 168,-0.1 0.000 360.0 360.0 360.0 153.8 -5.3 -25.2 12.2 2 2 A K + 0 0 65 103,-0.1 103,-0.3 4,-0.1 107,-0.1 -0.673 360.0 148.9 -85.3 127.3 -6.6 -25.8 8.7 3 3 A T > - 0 0 0 -2,-0.4 4,-2.5 102,-0.1 5,-0.3 -0.931 60.9 -98.7-145.9 165.3 -9.4 -28.3 8.1 4 4 A P H > S+ 0 0 32 0, 0.0 4,-1.3 0, 0.0 5,-0.1 0.834 125.0 47.2 -58.1 -32.8 -12.2 -28.5 5.5 5 5 A I H > S+ 0 0 2 96,-0.3 4,-2.0 2,-0.2 5,-0.2 0.952 112.0 45.7 -76.5 -48.2 -14.6 -27.1 8.2 6 6 A T H > S+ 0 0 8 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.847 112.0 53.8 -66.0 -29.8 -12.4 -24.2 9.4 7 7 A E H X S+ 0 0 104 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.893 106.7 51.4 -68.4 -40.5 -11.6 -23.3 5.7 8 8 A A H X S+ 0 0 8 -4,-1.3 4,-2.0 -5,-0.3 -2,-0.2 0.906 112.9 46.2 -59.9 -42.2 -15.3 -23.1 5.0 9 9 A I H X S+ 0 0 0 -4,-2.0 4,-3.0 2,-0.2 5,-0.3 0.935 110.5 52.5 -65.8 -45.3 -15.8 -20.8 8.0 10 10 A A H X S+ 0 0 49 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.888 108.0 52.3 -57.4 -41.8 -12.8 -18.8 6.9 11 11 A A H X S+ 0 0 33 -4,-2.4 4,-1.1 2,-0.2 -1,-0.2 0.948 113.8 41.9 -61.4 -48.4 -14.2 -18.3 3.5 12 12 A A H ><>S+ 0 0 0 -4,-2.0 5,-2.3 1,-0.2 3,-0.8 0.956 115.9 49.0 -62.8 -52.2 -17.6 -17.1 4.8 13 13 A D H ><5S+ 0 0 31 -4,-3.0 3,-1.1 1,-0.3 -1,-0.2 0.802 105.6 57.8 -57.9 -35.4 -16.0 -14.9 7.5 14 14 A N H 3<5S+ 0 0 142 -4,-2.3 -1,-0.3 -5,-0.3 -2,-0.2 0.818 111.5 42.9 -67.3 -29.6 -13.6 -13.3 5.0 15 15 A Q T <<5S- 0 0 122 -4,-1.1 -1,-0.3 -3,-0.8 -2,-0.2 0.307 113.7-120.2 -97.7 8.1 -16.6 -12.2 3.0 16 16 A G T < 5S+ 0 0 41 -3,-1.1 2,-0.2 1,-0.2 -3,-0.2 0.725 72.8 115.9 59.7 30.0 -18.5 -11.1 6.1 17 17 A R < - 0 0 62 -5,-2.3 -1,-0.2 -6,-0.2 -2,-0.1 -0.731 69.6 -96.1-127.5 169.6 -21.4 -13.5 5.4 18 18 A F - 0 0 28 -2,-0.2 -1,-0.1 1,-0.1 2,-0.1 -0.314 60.4 -79.8 -72.6 165.9 -23.2 -16.5 6.8 19 19 A L - 0 0 4 235,-0.1 2,-0.2 185,-0.1 -1,-0.1 -0.401 51.9-148.8 -65.2 143.6 -22.2 -19.9 5.5 20 20 A S >> - 0 0 45 -3,-0.1 4,-2.1 -2,-0.1 3,-0.6 -0.624 31.5 -95.0-110.3 175.9 -23.8 -20.7 2.2 21 21 A N H 3> S+ 0 0 99 1,-0.3 4,-2.4 2,-0.2 5,-0.2 0.786 123.4 63.9 -62.0 -26.5 -25.0 -23.9 0.6 22 22 A T H 3> S+ 0 0 98 1,-0.2 4,-1.5 2,-0.2 -1,-0.3 0.931 107.7 41.3 -62.8 -43.0 -21.6 -24.1 -1.1 23 23 A E H <> S+ 0 0 17 -3,-0.6 4,-1.8 2,-0.2 -2,-0.2 0.857 112.9 52.9 -73.5 -35.2 -19.9 -24.4 2.3 24 24 A L H X S+ 0 0 15 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.893 109.1 50.3 -67.8 -36.6 -22.5 -26.7 3.7 25 25 A Q H X S+ 0 0 118 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.889 107.9 53.8 -67.3 -35.5 -22.1 -29.0 0.7 26 26 A A H X S+ 0 0 54 -4,-1.5 4,-1.3 2,-0.2 -1,-0.2 0.893 110.6 45.8 -65.0 -37.9 -18.3 -28.9 1.3 27 27 A V H X S+ 0 0 0 -4,-1.8 4,-2.5 2,-0.2 -2,-0.2 0.897 109.8 54.1 -71.7 -41.1 -18.8 -30.0 4.9 28 28 A N H X S+ 0 0 53 -4,-2.4 4,-2.4 1,-0.2 5,-0.2 0.917 105.3 56.1 -57.0 -39.4 -21.2 -32.7 3.8 29 29 A G H X S+ 0 0 37 -4,-2.3 4,-1.4 1,-0.2 -1,-0.2 0.865 107.1 47.4 -60.8 -39.8 -18.5 -33.9 1.5 30 30 A R H X S+ 0 0 20 -4,-1.3 4,-1.8 -3,-0.2 -1,-0.2 0.930 110.7 52.4 -67.7 -43.5 -16.0 -34.3 4.4 31 31 A Y H < S+ 0 0 17 -4,-2.5 4,-0.5 1,-0.2 -2,-0.2 0.891 109.2 49.4 -59.9 -40.9 -18.7 -36.2 6.5 32 32 A Q H < S+ 0 0 140 -4,-2.4 3,-0.4 1,-0.2 4,-0.3 0.839 114.0 45.3 -67.7 -34.4 -19.3 -38.7 3.6 33 33 A R H >X S+ 0 0 76 -4,-1.4 4,-1.7 -5,-0.2 3,-1.0 0.753 91.9 84.9 -80.9 -20.6 -15.7 -39.4 3.1 34 34 A A H 3X S+ 0 0 1 -4,-1.8 4,-2.8 1,-0.3 5,-0.3 0.736 78.0 64.6 -55.4 -31.4 -14.9 -39.7 6.9 35 35 A A H 3> S+ 0 0 77 -4,-0.5 4,-1.7 -3,-0.4 -1,-0.3 0.934 108.5 40.6 -59.4 -44.4 -15.9 -43.4 7.1 36 36 A A H <> S+ 0 0 14 -3,-1.0 4,-2.1 -4,-0.3 -2,-0.2 0.892 114.8 52.9 -72.0 -37.5 -13.0 -44.3 4.7 37 37 A S H X S+ 0 0 0 -4,-1.7 4,-2.5 1,-0.2 -2,-0.2 0.907 111.3 44.8 -63.3 -45.7 -10.6 -41.9 6.5 38 38 A L H X S+ 0 0 11 -4,-2.8 4,-2.5 2,-0.2 -1,-0.2 0.828 109.1 55.5 -72.4 -30.5 -11.3 -43.3 9.9 39 39 A E H X S+ 0 0 115 -4,-1.7 4,-2.3 -5,-0.3 -2,-0.2 0.950 112.4 44.9 -64.6 -45.1 -11.0 -46.9 8.8 40 40 A A H X S+ 0 0 0 -4,-2.1 4,-2.8 1,-0.2 5,-0.3 0.930 112.6 50.3 -63.5 -45.1 -7.6 -46.0 7.4 41 41 A A H X S+ 0 0 1 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.909 111.5 48.3 -60.8 -41.2 -6.6 -44.1 10.6 42 42 A R H X S+ 0 0 70 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.933 114.2 46.3 -64.8 -46.9 -7.7 -47.0 12.8 43 43 A S H X S+ 0 0 29 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.934 113.0 47.9 -61.5 -49.4 -5.7 -49.6 10.7 44 44 A L H < S+ 0 0 0 -4,-2.8 -1,-0.2 2,-0.2 7,-0.2 0.875 112.8 50.2 -60.5 -39.8 -2.5 -47.5 10.4 45 45 A T H >< S+ 0 0 32 -4,-2.0 3,-1.7 -5,-0.3 4,-0.3 0.961 109.9 47.3 -65.9 -49.6 -2.6 -46.8 14.2 46 46 A S H 3< S+ 0 0 89 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.828 119.6 41.7 -64.9 -26.1 -3.0 -50.4 15.3 47 47 A N T 3X S+ 0 0 43 -4,-1.8 4,-2.2 -5,-0.2 -1,-0.3 0.267 83.3 114.5-101.7 13.8 -0.2 -51.5 12.9 48 48 A A H <> S+ 0 0 9 -3,-1.7 4,-2.9 1,-0.2 5,-0.2 0.887 73.1 47.1 -52.3 -55.0 2.1 -48.5 13.6 49 49 A E H > S+ 0 0 126 -4,-0.3 4,-2.5 1,-0.2 5,-0.3 0.918 113.8 48.9 -57.8 -41.9 5.0 -50.3 15.2 50 50 A R H > S+ 0 0 123 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.899 114.4 44.9 -64.5 -44.5 5.1 -52.9 12.5 51 51 A L H X S+ 0 0 0 -4,-2.2 4,-2.0 -7,-0.2 -1,-0.2 0.873 114.2 49.3 -68.0 -39.0 5.0 -50.3 9.7 52 52 A I H X S+ 0 0 10 -4,-2.9 4,-2.3 -5,-0.2 -2,-0.2 0.944 114.5 43.4 -66.4 -48.4 7.6 -48.1 11.4 53 53 A N H X S+ 0 0 91 -4,-2.5 4,-2.2 -5,-0.2 -2,-0.2 0.919 116.6 47.1 -64.5 -42.9 10.1 -50.9 12.0 54 54 A G H X S+ 0 0 17 -4,-2.1 4,-2.0 -5,-0.3 -1,-0.2 0.864 112.1 51.1 -67.2 -35.6 9.6 -52.4 8.6 55 55 A A H X S+ 0 0 0 -4,-2.0 4,-1.6 2,-0.2 -2,-0.2 0.887 108.8 50.1 -68.7 -40.1 9.9 -48.9 7.0 56 56 A A H X S+ 0 0 6 -4,-2.3 4,-2.2 1,-0.2 3,-0.4 0.956 111.3 49.5 -64.1 -43.7 13.2 -48.2 8.8 57 57 A Q H X S+ 0 0 108 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.873 106.2 56.0 -62.7 -36.9 14.6 -51.6 7.6 58 58 A A H X S+ 0 0 19 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.865 108.4 48.7 -63.2 -33.9 13.5 -50.9 4.0 59 59 A V H X S+ 0 0 4 -4,-1.6 4,-3.1 -3,-0.4 -2,-0.2 0.948 110.8 48.9 -70.6 -46.6 15.6 -47.6 4.1 60 60 A Y H < S+ 0 0 30 -4,-2.2 7,-0.2 1,-0.2 -2,-0.2 0.826 113.9 47.8 -62.3 -34.6 18.6 -49.4 5.5 61 61 A S H < S+ 0 0 79 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.864 115.3 43.0 -74.1 -39.2 18.4 -52.1 2.9 62 62 A K H < S+ 0 0 122 -4,-1.9 -2,-0.2 1,-0.3 -3,-0.2 0.877 126.7 32.3 -72.9 -39.8 17.9 -49.7 -0.0 63 63 A F >< + 0 0 40 -4,-3.1 3,-1.9 -5,-0.2 4,-0.3 -0.670 69.1 174.3-119.6 77.2 20.6 -47.3 1.2 64 64 A P T >> S+ 0 0 68 0, 0.0 3,-2.2 0, 0.0 4,-0.6 0.839 72.8 68.6 -53.1 -37.5 23.3 -49.5 3.0 65 65 A Y H >> S+ 0 0 85 1,-0.3 4,-2.4 2,-0.2 3,-0.8 0.758 85.4 71.9 -55.7 -24.4 25.7 -46.6 3.5 66 66 A T H <4 S+ 0 0 5 -3,-1.9 9,-1.6 1,-0.2 -1,-0.3 0.727 102.7 40.3 -66.7 -20.8 23.2 -45.1 6.0 67 67 A S H <4 S+ 0 0 58 -3,-2.2 -1,-0.2 -4,-0.3 -2,-0.2 0.504 122.2 41.4-104.4 -2.1 24.0 -47.8 8.6 68 68 A Q H << S+ 0 0 145 -3,-0.8 -2,-0.2 -4,-0.6 -3,-0.1 0.801 88.3 87.1-109.6 -45.2 27.8 -47.9 7.9 69 69 A M S < S- 0 0 83 -4,-2.4 7,-0.3 1,-0.1 2,-0.1 -0.404 75.3-124.1 -65.2 130.9 29.1 -44.3 7.5 70 70 A P + 0 0 115 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.476 61.8 96.2 -74.3 145.3 30.2 -42.5 10.7 71 71 A G S > S- 0 0 29 -2,-0.1 3,-1.2 3,-0.1 5,-0.4 -0.526 78.6 -99.9 146.6 147.9 28.5 -39.2 11.4 72 72 A P T 3 S+ 0 0 127 0, 0.0 -1,-0.1 0, 0.0 5,-0.1 0.774 115.7 61.6 -64.3 -24.7 25.5 -37.8 13.3 73 73 A Q T 3 S+ 0 0 46 -3,-0.1 2,-0.2 2,-0.1 -2,-0.0 0.635 96.5 77.4 -78.3 -10.6 23.3 -37.6 10.3 74 74 A Y S < S- 0 0 34 -3,-1.2 3,-0.4 -5,-0.1 -7,-0.1 -0.562 80.9-125.9-101.8 165.7 23.5 -41.4 9.7 75 75 A A S S+ 0 0 7 -9,-1.6 6,-0.1 1,-0.2 -9,-0.1 -0.180 80.1 108.6 -96.9 38.4 21.8 -44.4 11.3 76 76 A S S S+ 0 0 41 -5,-0.4 2,-0.3 -7,-0.3 -1,-0.2 0.410 73.2 55.1 -93.3 -2.4 25.3 -46.0 12.0 77 77 A S S > S- 0 0 43 -3,-0.4 4,-2.2 -6,-0.1 5,-0.2 -0.787 93.0-109.2-123.7 167.8 25.0 -45.4 15.8 78 78 A A H > S+ 0 0 80 -2,-0.3 4,-2.2 2,-0.2 5,-0.2 0.915 122.2 48.6 -64.1 -42.4 22.3 -46.4 18.3 79 79 A V H > S+ 0 0 89 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.882 110.7 53.0 -63.9 -36.6 21.2 -42.8 18.7 80 80 A G H > S+ 0 0 8 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.909 109.7 45.8 -64.8 -47.9 21.1 -42.6 14.9 81 81 A K H X S+ 0 0 107 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.856 112.6 51.8 -63.5 -37.8 18.9 -45.7 14.5 82 82 A A H X S+ 0 0 65 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.910 111.4 46.8 -66.6 -40.2 16.6 -44.4 17.3 83 83 A K H X S+ 0 0 110 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.819 110.1 53.7 -70.9 -32.4 16.1 -41.0 15.6 84 84 A C H X S+ 0 0 23 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.936 111.2 43.4 -66.7 -49.5 15.5 -42.5 12.2 85 85 A A H X S+ 0 0 26 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.862 113.4 54.6 -62.9 -36.6 12.7 -44.8 13.5 86 86 A R H X S+ 0 0 105 -4,-1.9 4,-1.9 -5,-0.2 -2,-0.2 0.952 108.1 48.2 -60.5 -49.4 11.4 -41.8 15.5 87 87 A D H X S+ 0 0 22 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.885 111.1 49.9 -57.2 -47.9 11.3 -39.6 12.3 88 88 A I H X S+ 0 0 4 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.887 109.0 53.0 -59.9 -38.6 9.4 -42.3 10.4 89 89 A G H X S+ 0 0 9 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.853 104.7 55.7 -64.9 -37.5 7.0 -42.6 13.2 90 90 A Y H X S+ 0 0 98 -4,-1.9 4,-2.5 2,-0.2 -1,-0.2 0.925 107.7 48.6 -60.8 -44.1 6.4 -38.8 13.0 91 91 A Y H X S+ 0 0 15 -4,-1.9 4,-1.7 1,-0.2 -2,-0.2 0.924 112.5 47.5 -62.4 -42.7 5.4 -39.1 9.4 92 92 A L H X S+ 0 0 2 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.913 111.5 50.9 -65.4 -41.5 3.0 -42.0 10.0 93 93 A R H X S+ 0 0 16 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.914 108.5 51.4 -62.4 -42.9 1.5 -40.1 12.9 94 94 A M H X S+ 0 0 7 -4,-2.5 4,-2.1 1,-0.2 13,-0.3 0.844 106.0 56.0 -62.1 -37.0 0.9 -37.0 10.8 95 95 A V H X S+ 0 0 2 -4,-1.7 4,-2.0 2,-0.2 -1,-0.2 0.925 107.2 48.3 -59.6 -48.2 -0.8 -39.2 8.1 96 96 A T H X S+ 0 0 3 -4,-1.8 4,-2.0 1,-0.2 -2,-0.2 0.871 109.6 53.6 -62.1 -34.9 -3.3 -40.4 10.7 97 97 A Y H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 5,-0.2 0.894 107.8 49.7 -65.3 -42.3 -3.9 -36.8 11.9 98 98 A C H X>S+ 0 0 0 -4,-2.1 4,-1.7 1,-0.2 5,-1.3 0.898 110.0 51.6 -62.1 -43.0 -4.7 -35.7 8.3 99 99 A L H <5S+ 0 0 0 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.906 110.0 50.5 -60.1 -42.3 -7.1 -38.7 7.9 100 100 A V H <5S+ 0 0 2 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.917 118.9 33.7 -63.1 -46.7 -8.9 -37.6 11.2 101 101 A V H <5S- 0 0 2 -4,-2.2 -96,-0.3 2,-0.2 -1,-0.2 0.613 106.9-123.2 -87.1 -14.1 -9.4 -34.0 10.3 102 102 A G T <5S+ 0 0 12 -4,-1.7 2,-0.3 -5,-0.2 -3,-0.2 0.762 77.2 64.9 80.1 28.1 -9.9 -34.6 6.6 103 103 A G S S+ 0 0 29 -2,-0.3 4,-2.9 1,-0.2 3,-0.4 0.509 83.9 108.6 -87.0 -0.8 -3.4 -31.7 5.1 105 105 A G H > S+ 0 0 0 -103,-0.3 4,-2.7 1,-0.2 5,-0.3 0.805 76.0 48.2 -44.5 -51.9 -3.4 -29.1 7.9 106 106 A P H > S+ 0 0 0 0, 0.0 4,-2.7 0, 0.0 5,-0.4 0.944 116.6 44.5 -60.7 -42.3 -1.7 -31.2 10.6 107 107 A M H >>S+ 0 0 0 -3,-0.4 5,-2.7 -13,-0.3 4,-2.0 0.940 112.9 51.0 -68.8 -42.6 1.0 -32.2 8.1 108 108 A D H <>S+ 0 0 30 -4,-2.9 5,-1.8 3,-0.2 -1,-0.2 0.929 119.0 36.4 -59.2 -43.5 1.4 -28.7 6.7 109 109 A E H <5S+ 0 0 98 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.887 124.9 34.4 -79.8 -41.9 1.8 -27.2 10.2 110 110 A Y H <5S+ 0 0 78 -4,-2.7 -3,-0.2 -5,-0.3 -2,-0.2 0.679 135.3 8.5 -91.0 -17.4 3.8 -29.8 12.1 111 111 A L T <5S+ 0 0 24 -4,-2.0 -3,-0.2 -5,-0.4 4,-0.2 0.710 119.7 50.8-130.6 -47.5 6.0 -31.2 9.5 112 112 A I T > S+ 0 0 44 -2,-0.4 4,-2.2 3,-0.0 -1,-0.3 0.341 92.8 124.1 91.5 -6.7 10.5 -25.8 7.7 115 115 A L H <> S+ 0 0 23 -3,-2.0 4,-2.6 1,-0.2 5,-0.2 0.889 71.3 50.0 -53.1 -49.8 11.1 -29.2 6.2 116 116 A E H > S+ 0 0 152 -4,-0.4 4,-2.2 1,-0.2 5,-0.2 0.931 111.9 47.8 -59.0 -45.6 13.6 -28.0 3.5 117 117 A E H > S+ 0 0 96 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.893 112.7 48.7 -63.1 -42.6 15.7 -26.0 6.1 118 118 A I H X S+ 0 0 79 -4,-2.2 4,-2.6 2,-0.2 6,-0.2 0.949 111.5 48.4 -65.3 -45.9 15.8 -28.9 8.5 119 119 A N H X>S+ 0 0 13 -4,-2.6 5,-2.4 1,-0.2 4,-0.6 0.918 116.6 43.0 -62.1 -41.0 16.8 -31.5 5.9 120 120 A R H ><5S+ 0 0 161 -4,-2.2 3,-0.6 -5,-0.2 -1,-0.2 0.934 114.8 49.7 -71.1 -43.5 19.6 -29.2 4.5 121 121 A T H 3<5S+ 0 0 75 -4,-2.8 -2,-0.2 1,-0.2 -1,-0.2 0.910 119.7 34.5 -62.5 -46.2 20.8 -28.2 7.9 122 122 A F H 3<5S- 0 0 132 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.381 109.7-116.9 -92.5 4.3 21.1 -31.7 9.4 123 123 A D T <<5 + 0 0 88 -4,-0.6 2,-0.5 -3,-0.6 -3,-0.2 0.908 56.7 158.5 61.2 47.1 22.2 -33.4 6.1 124 124 A L < - 0 0 30 -5,-2.4 -1,-0.2 -6,-0.2 -2,-0.1 -0.861 38.5-129.3-102.5 127.9 19.1 -35.6 5.9 125 125 A S >> - 0 0 34 -2,-0.5 3,-1.7 1,-0.2 4,-0.8 -0.691 2.0-146.2 -83.8 126.5 18.4 -36.9 2.4 126 126 A P H >> S+ 0 0 52 0, 0.0 4,-1.8 0, 0.0 3,-0.8 0.891 98.3 63.5 -53.2 -40.0 14.8 -36.5 1.2 127 127 A S H 3> S+ 0 0 52 1,-0.3 4,-1.8 2,-0.2 5,-0.2 0.737 92.4 63.0 -62.5 -20.4 15.0 -39.7 -0.7 128 128 A W H <> S+ 0 0 26 -3,-1.7 4,-1.5 1,-0.2 -1,-0.3 0.914 107.7 42.5 -68.7 -41.9 15.5 -41.7 2.6 129 129 A Y H > + 0 0 94 -2,-0.1 4,-1.4 4,-0.0 3,-1.0 -0.829 43.6 4.1-137.4 170.8 -8.2 -51.8 0.4 144 146 A G H 3> S- 0 0 50 -2,-0.3 4,-1.7 1,-0.2 3,-0.4 -0.087 121.9 -15.9 58.3-146.2 -10.9 -49.7 -1.4 145 147 A Q H 3> S+ 0 0 98 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.707 134.3 61.2 -66.0 -23.5 -11.5 -46.1 -0.4 146 148 A A H <> S+ 0 0 1 -3,-1.0 4,-2.2 2,-0.2 -1,-0.2 0.899 106.1 46.7 -70.3 -37.9 -9.6 -46.5 2.9 147 149 A A H X S+ 0 0 15 -4,-1.4 4,-2.8 -3,-0.4 -2,-0.2 0.910 110.9 54.5 -66.6 -37.3 -6.5 -47.4 0.9 148 150 A N H X S+ 0 0 72 -4,-1.7 4,-2.0 1,-0.2 -2,-0.2 0.915 108.8 47.1 -60.3 -49.2 -7.2 -44.4 -1.3 149 161 A E H X S+ 0 0 17 -4,-2.3 4,-1.4 2,-0.2 -1,-0.2 0.916 113.9 46.6 -60.5 -45.8 -7.4 -42.0 1.7 150 162 A A H X S+ 0 0 0 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.936 114.2 47.4 -62.8 -47.4 -4.2 -43.3 3.2 151 163 A N H X S+ 0 0 38 -4,-2.8 4,-3.0 1,-0.2 5,-0.2 0.814 103.6 61.2 -65.6 -32.4 -2.3 -43.2 -0.0 152 164 A T H X S+ 0 0 67 -4,-2.0 4,-1.6 -5,-0.2 -1,-0.2 0.927 111.2 40.0 -62.2 -40.0 -3.5 -39.7 -0.9 153 165 A Y H X S+ 0 0 22 -4,-1.4 4,-1.7 2,-0.2 -1,-0.2 0.843 114.0 52.2 -78.3 -32.8 -1.8 -38.3 2.2 154 166 A I H X S+ 0 0 1 -4,-1.9 4,-2.3 2,-0.2 3,-0.3 0.954 112.5 46.9 -65.8 -46.7 1.3 -40.5 1.9 155 167 A D H X S+ 0 0 51 -4,-3.0 4,-2.7 1,-0.2 -2,-0.2 0.838 105.2 59.4 -63.9 -33.4 1.7 -39.2 -1.7 156 168 A Y H X S+ 0 0 84 -4,-1.6 4,-1.5 -5,-0.2 -1,-0.2 0.910 108.7 45.4 -61.6 -39.3 1.1 -35.6 -0.5 157 169 A A H X S+ 0 0 2 -4,-1.7 4,-1.2 -3,-0.3 -2,-0.2 0.928 110.4 53.6 -69.2 -43.6 4.2 -36.1 1.7 158 170 A I H >X S+ 0 0 22 -4,-2.3 3,-0.8 1,-0.2 4,-0.6 0.935 107.7 51.2 -56.8 -42.6 6.2 -37.7 -1.1 159 171 A N H >< S+ 0 0 118 -4,-2.7 3,-0.9 1,-0.3 -1,-0.2 0.871 105.4 55.5 -65.3 -33.1 5.4 -34.7 -3.3 160 172 A A H 3< S+ 0 0 38 -4,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.772 110.5 46.7 -69.5 -23.3 6.7 -32.3 -0.7 161 173 A L H << 0 0 19 -4,-1.2 -1,-0.2 -3,-0.8 -2,-0.2 0.464 360.0 360.0 -96.2 -2.4 10.0 -34.2 -0.6 162 174 A S << 0 0 130 -3,-0.9 -3,-0.0 -4,-0.6 0, 0.0 -0.515 360.0 360.0-121.2 360.0 10.4 -34.4 -4.4 163 !* 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 0.0 164 1 B M 0 0 56 0, 0.0 2,-0.3 0, 0.0 -158,-0.1 0.000 360.0 360.0 360.0 179.5 -9.4 -21.6 15.1 165 2 B L - 0 0 39 99,-0.1 102,-0.4 -160,-0.0 2,-0.2 -0.928 360.0-145.8-138.1 159.0 -10.2 -25.3 15.5 166 3 B D > - 0 0 1 -2,-0.3 4,-2.0 100,-0.1 97,-0.2 -0.648 48.7 -88.7-110.9 177.4 -13.2 -27.6 14.9 167 4 B A H > S+ 0 0 17 95,-2.5 4,-1.0 -2,-0.2 96,-0.1 0.782 126.9 51.5 -59.9 -30.0 -13.8 -30.6 17.2 168 5 B F H > S+ 0 0 7 94,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.923 111.2 45.9 -72.8 -42.9 -11.6 -32.9 15.1 169 6 B A H > S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.796 105.5 61.0 -69.2 -33.9 -8.6 -30.6 15.1 170 7 B K H X S+ 0 0 75 -4,-2.0 4,-1.5 2,-0.2 -1,-0.2 0.917 106.1 46.5 -60.9 -41.7 -8.9 -29.9 18.8 171 8 B V H X S+ 0 0 31 -4,-1.0 4,-1.9 1,-0.2 -2,-0.2 0.899 112.3 50.7 -67.6 -39.9 -8.4 -33.6 19.5 172 9 B V H X S+ 0 0 0 -4,-1.6 4,-2.7 2,-0.2 -2,-0.2 0.902 107.9 51.1 -63.9 -46.6 -5.4 -33.8 17.1 173 10 B A H X S+ 0 0 30 -4,-2.5 4,-1.6 1,-0.2 -1,-0.2 0.867 110.7 50.4 -60.1 -38.6 -3.6 -30.8 18.7 174 11 B Q H X S+ 0 0 101 -4,-1.5 4,-0.5 -5,-0.2 -1,-0.2 0.896 111.9 46.5 -66.2 -44.4 -4.0 -32.3 22.1 175 12 B A H >X>S+ 0 0 0 -4,-1.9 5,-2.6 1,-0.2 3,-1.0 0.891 108.8 55.1 -65.4 -40.8 -2.6 -35.7 21.0 176 13 B D H ><5S+ 0 0 42 -4,-2.7 3,-1.1 1,-0.3 -1,-0.2 0.890 99.9 59.8 -61.8 -40.0 0.4 -34.1 19.1 177 14 B A H 3<5S+ 0 0 87 -4,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.723 113.7 38.4 -59.7 -24.6 1.5 -32.2 22.3 178 15 B R H <<5S- 0 0 145 -3,-1.0 -1,-0.3 -4,-0.5 -2,-0.2 0.418 113.6-121.0-102.1 -4.8 1.9 -35.6 23.9 179 16 B G T <<5 + 0 0 39 -3,-1.1 2,-0.3 -4,-0.6 -3,-0.2 0.800 63.8 144.6 68.5 34.0 3.2 -37.2 20.8 180 17 B E < - 0 0 91 -5,-2.6 -1,-0.2 -6,-0.1 2,-0.2 -0.727 53.7-128.9-110.4 153.3 0.4 -39.8 20.7 181 18 B F - 0 0 52 -2,-0.3 2,-0.1 1,-0.1 -88,-0.1 -0.572 51.4 -92.7 -83.0 156.6 -1.7 -41.5 18.0 182 19 B L - 0 0 6 -2,-0.2 -1,-0.1 1,-0.1 2,-0.1 -0.467 42.7-119.6 -73.4 148.6 -5.4 -41.2 18.8 183 20 B S > - 0 0 51 -2,-0.1 4,-2.2 1,-0.1 3,-0.2 -0.366 24.3-106.5 -80.9 165.2 -6.8 -44.0 20.9 184 21 B N H > S+ 0 0 90 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.892 121.0 52.7 -60.3 -38.1 -9.7 -46.2 19.6 185 22 B T H > S+ 0 0 106 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.855 107.8 51.4 -67.4 -31.9 -12.2 -44.5 22.0 186 23 B Q H > S+ 0 0 50 2,-0.2 4,-1.8 -3,-0.2 -1,-0.2 0.925 111.2 48.1 -69.2 -39.8 -11.1 -41.2 20.6 187 24 B L H X S+ 0 0 2 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.912 110.4 51.4 -65.7 -41.0 -11.7 -42.5 17.1 188 25 B D H X S+ 0 0 84 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.916 107.8 52.8 -60.3 -44.1 -15.1 -43.9 18.2 189 26 B A H X S+ 0 0 62 -4,-2.3 4,-1.4 1,-0.2 -1,-0.2 0.863 109.4 48.8 -60.6 -37.4 -16.0 -40.5 19.6 190 27 B L H X S+ 0 0 9 -4,-1.8 4,-1.8 2,-0.2 -1,-0.2 0.876 107.6 54.8 -71.9 -34.3 -15.1 -38.8 16.3 191 28 B S H X S+ 0 0 39 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.910 106.1 52.5 -62.9 -42.6 -17.2 -41.4 14.3 192 29 B K H X S+ 0 0 157 -4,-2.2 4,-1.6 1,-0.2 -1,-0.2 0.892 106.0 53.4 -62.8 -35.9 -20.2 -40.6 16.4 193 30 B M H < S+ 0 0 32 -4,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.890 107.1 51.7 -67.3 -34.5 -19.8 -36.9 15.7 194 31 B V H >< S+ 0 0 28 -4,-1.8 3,-1.4 1,-0.2 4,-0.3 0.872 105.6 56.1 -66.0 -36.8 -19.8 -37.7 12.0 195 32 B S H >< S+ 0 0 97 -4,-1.9 3,-0.5 1,-0.3 4,-0.2 0.845 104.7 51.6 -61.6 -38.6 -23.0 -39.7 12.5 196 33 B E T 3X S+ 0 0 53 -4,-1.6 4,-2.1 1,-0.2 -1,-0.3 0.389 84.5 105.7 -78.3 2.5 -24.7 -36.6 14.0 197 34 B G H <> S+ 0 0 1 -3,-1.4 4,-2.1 1,-0.2 -1,-0.2 0.838 72.3 49.7 -52.3 -47.9 -23.5 -34.7 10.9 198 35 B N H <> S+ 0 0 108 -3,-0.5 4,-1.9 -4,-0.3 -1,-0.2 0.898 111.3 51.1 -62.6 -38.7 -26.8 -34.4 9.0 199 36 B K H > S+ 0 0 59 -4,-0.2 4,-2.0 -3,-0.2 -2,-0.2 0.931 108.5 51.6 -63.6 -44.6 -28.5 -33.1 12.1 200 37 B R H X S+ 0 0 10 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.898 109.1 50.6 -59.9 -40.5 -25.8 -30.5 12.6 201 38 B L H X S+ 0 0 16 -4,-2.1 4,-2.6 1,-0.2 -1,-0.2 0.859 106.7 54.7 -67.0 -37.2 -26.2 -29.3 9.0 202 39 B D H X S+ 0 0 66 -4,-1.9 4,-2.7 2,-0.2 -1,-0.2 0.904 108.2 49.8 -62.1 -43.0 -30.0 -28.9 9.4 203 40 B V H X S+ 0 0 2 -4,-2.0 4,-2.7 2,-0.2 5,-0.2 0.959 113.2 44.2 -60.4 -53.3 -29.4 -26.7 12.4 204 41 B V H X S+ 0 0 0 -4,-2.1 4,-2.8 1,-0.2 5,-0.2 0.925 115.7 48.7 -57.9 -46.6 -27.0 -24.4 10.7 205 42 B N H X S+ 0 0 65 -4,-2.6 4,-2.7 2,-0.2 -1,-0.2 0.918 112.3 48.9 -59.7 -47.5 -29.2 -24.3 7.5 206 43 B R H X S+ 0 0 38 -4,-2.7 4,-0.7 -5,-0.2 -2,-0.2 0.932 114.2 44.5 -61.0 -45.4 -32.3 -23.5 9.6 207 44 B I H >< S+ 0 0 1 -4,-2.7 3,-1.0 -5,-0.2 7,-0.2 0.959 116.2 46.4 -63.7 -50.7 -30.6 -20.7 11.5 208 45 B T H >< S+ 0 0 34 -4,-2.8 3,-1.8 1,-0.2 4,-0.3 0.926 108.7 55.2 -55.7 -49.6 -29.0 -19.2 8.4 209 46 B S H 3< S+ 0 0 79 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.638 116.9 36.9 -60.4 -18.2 -32.2 -19.3 6.3 210 47 B N T S+ 0 0 7 -3,-1.8 4,-2.5 1,-0.2 5,-0.3 0.906 74.0 48.3 -56.9 -48.6 -31.2 -15.0 10.0 212 49 B S H > S+ 0 0 90 -4,-0.3 4,-2.9 1,-0.2 5,-0.2 0.928 114.2 47.9 -61.0 -40.2 -32.9 -11.7 9.1 213 50 B A H > S+ 0 0 43 2,-0.2 4,-2.6 1,-0.2 5,-0.3 0.921 110.6 50.9 -65.9 -44.1 -36.0 -12.7 10.9 214 51 B I H X S+ 0 0 2 -4,-2.6 4,-1.7 -7,-0.2 -2,-0.2 0.951 116.5 40.7 -60.3 -45.9 -34.1 -13.8 14.0 215 52 B V H X S+ 0 0 10 -4,-2.5 4,-2.5 -5,-0.2 -2,-0.2 0.947 115.8 48.5 -68.7 -50.0 -32.2 -10.5 14.2 216 53 B T H X S+ 0 0 55 -4,-2.9 4,-2.6 -5,-0.3 -2,-0.2 0.907 113.1 45.9 -60.2 -44.5 -35.1 -8.2 13.3 217 54 B N H X S+ 0 0 88 -4,-2.6 4,-2.4 -5,-0.2 -1,-0.2 0.897 113.1 49.8 -69.2 -36.0 -37.6 -9.7 15.8 218 55 B A H X S+ 0 0 3 -4,-1.7 4,-2.3 -5,-0.3 -1,-0.2 0.907 112.0 49.0 -67.1 -41.1 -35.0 -9.7 18.6 219 56 B A H X S+ 0 0 4 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.941 110.8 49.6 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