==== 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 CHAPERONE 15-MAY-07 2PY8 . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN RBCX; . SOURCE 2 ORGANISM_SCIENTIFIC: SYNECHOCYSTIS SP. PCC 6803; . AUTHOR S.TANAKA,M.R.SAWAYA,C.A.KERFELD,T.O.YEATES . 460 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 30866.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 396 86.1 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 . 4 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 355 77.2 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+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 2 2 0 0 0 4 0 0 1 0 4 0 0 0 0 0 0 0 0 0 1 1 5 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 2 A Q > 0 0 180 0, 0.0 4,-1.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-163.6 28.7 51.6 39.0 2 3 A T H > + 0 0 90 2,-0.2 4,-2.0 1,-0.2 3,-0.2 0.928 360.0 49.1 -59.5 -51.6 28.7 48.2 40.9 3 4 A K H > S+ 0 0 147 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.886 108.2 54.5 -63.0 -39.3 30.2 46.1 38.1 4 5 A H H > S+ 0 0 94 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.853 106.9 51.0 -62.3 -36.9 33.0 48.6 37.4 5 6 A I H X S+ 0 0 100 -4,-1.3 4,-2.4 -3,-0.2 -1,-0.2 0.923 110.1 50.0 -64.9 -44.3 34.0 48.4 41.1 6 7 A A H X S+ 0 0 43 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.911 111.0 49.2 -59.3 -45.0 34.1 44.6 40.9 7 8 A Q H X S+ 0 0 97 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.950 111.2 48.9 -59.6 -50.0 36.2 44.8 37.7 8 9 A A H X S+ 0 0 23 -4,-2.5 4,-1.7 1,-0.2 -1,-0.2 0.900 111.5 50.9 -56.2 -42.5 38.7 47.1 39.4 9 10 A T H X S+ 0 0 77 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.858 105.5 55.5 -65.2 -37.6 38.8 44.8 42.4 10 11 A V H X S+ 0 0 82 -4,-2.2 4,-3.4 2,-0.2 5,-0.2 0.940 106.1 50.8 -63.3 -45.0 39.5 41.8 40.3 11 12 A K H X S+ 0 0 135 -4,-2.0 4,-2.6 2,-0.2 41,-0.3 0.897 111.6 47.9 -57.4 -44.2 42.6 43.4 38.7 12 13 A V H X S+ 0 0 104 -4,-1.7 4,-2.5 2,-0.2 -1,-0.2 0.937 113.3 48.2 -62.5 -46.5 44.0 44.3 42.1 13 14 A L H X S+ 0 0 58 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.953 112.6 48.4 -56.8 -52.3 43.3 40.8 43.3 14 15 A Q H X S+ 0 0 76 -4,-3.4 4,-1.9 1,-0.2 -1,-0.2 0.875 111.4 49.8 -59.0 -41.2 45.0 39.3 40.2 15 16 A S H X S+ 0 0 16 -4,-2.6 4,-2.1 -5,-0.2 -1,-0.2 0.924 109.6 51.2 -64.7 -42.4 48.0 41.6 40.6 16 17 A Y H X S+ 0 0 137 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.908 109.8 49.7 -62.2 -41.4 48.3 40.7 44.3 17 18 A L H X S+ 0 0 18 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.842 107.8 54.8 -64.5 -34.2 48.2 36.9 43.4 18 19 A T H X S+ 0 0 0 -4,-1.9 4,-2.1 -5,-0.2 -2,-0.2 0.924 108.6 48.1 -63.3 -44.4 50.9 37.6 40.7 19 20 A Y H X S+ 0 0 85 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.936 111.5 50.4 -59.3 -47.0 53.1 39.1 43.4 20 21 A Q H X S+ 0 0 64 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.918 108.8 51.0 -59.6 -45.8 52.5 36.2 45.7 21 22 A A H X S+ 0 0 0 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.886 108.1 53.0 -60.8 -40.0 53.4 33.7 43.0 22 23 A V H X S+ 0 0 0 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.905 107.8 51.3 -62.0 -41.8 56.6 35.5 42.3 23 24 A L H X S+ 0 0 50 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.934 108.3 51.0 -62.3 -44.9 57.5 35.3 46.0 24 25 A R H X S+ 0 0 125 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.917 112.0 46.9 -57.5 -45.2 56.9 31.5 46.1 25 26 A I H X S+ 0 0 0 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.816 108.3 56.7 -65.7 -31.4 59.2 31.1 43.0 26 27 A Q H X S+ 0 0 34 -4,-1.9 4,-1.2 2,-0.2 -2,-0.2 0.914 109.0 46.3 -65.8 -45.3 61.8 33.3 44.7 27 28 A S H < S+ 0 0 88 -4,-2.3 -2,-0.2 2,-0.2 -1,-0.2 0.905 111.9 50.0 -59.3 -47.5 61.9 31.0 47.7 28 29 A E H >X S+ 0 0 81 -4,-2.0 4,-2.2 1,-0.2 3,-1.6 0.902 110.8 48.1 -65.3 -42.4 62.1 27.8 45.6 29 30 A L H 3X S+ 0 0 6 -4,-2.2 4,-2.4 1,-0.3 8,-0.3 0.815 98.1 73.6 -63.0 -30.6 64.9 29.2 43.5 30 31 A G H 3< S+ 0 0 46 -4,-1.2 -1,-0.3 -5,-0.2 -2,-0.2 0.544 110.3 28.7 -59.6 -10.2 66.4 30.1 46.9 31 32 A E H <4 S+ 0 0 172 -3,-1.6 -2,-0.2 -4,-0.1 -1,-0.2 0.689 129.2 35.2-111.2 -49.4 67.1 26.4 47.3 32 33 A T H < S+ 0 0 105 -4,-2.2 -3,-0.2 1,-0.2 -2,-0.2 0.799 132.8 11.1 -82.0 -30.8 67.6 25.0 43.8 33 34 A N >X + 0 0 66 -4,-2.4 4,-1.8 -5,-0.2 3,-1.3 -0.494 58.1 179.6-154.8 71.8 69.3 27.9 42.0 34 35 A P H 3> S+ 0 0 78 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.781 83.3 59.7 -53.2 -38.0 70.7 30.8 44.2 35 36 A P H 3> S+ 0 0 87 0, 0.0 4,-1.9 0, 0.0 5,-0.1 0.901 109.3 44.0 -54.0 -42.3 72.1 32.7 41.2 36 37 A Q H <> S+ 0 0 55 -3,-1.3 4,-2.7 2,-0.2 5,-0.2 0.897 109.3 57.0 -69.6 -41.1 68.5 32.9 39.7 37 38 A A H X S+ 0 0 12 -4,-1.8 4,-1.9 -8,-0.3 -1,-0.2 0.886 110.7 43.5 -54.4 -43.5 67.0 33.8 43.1 38 39 A I H X S+ 0 0 89 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.892 112.5 53.2 -71.4 -39.1 69.3 36.8 43.3 39 40 A W H X S+ 0 0 81 -4,-1.9 4,-2.0 -5,-0.2 -2,-0.2 0.871 110.2 47.4 -61.6 -39.2 68.7 37.8 39.6 40 41 A L H X S+ 0 0 0 -4,-2.7 4,-2.7 2,-0.2 -1,-0.2 0.904 109.0 54.6 -69.8 -42.6 64.9 37.7 40.2 41 42 A N H X S+ 0 0 79 -4,-1.9 4,-1.6 -5,-0.2 -2,-0.2 0.926 111.6 44.3 -51.8 -51.0 65.3 39.8 43.4 42 43 A Q H X S+ 0 0 116 -4,-2.3 4,-1.2 1,-0.2 -1,-0.2 0.858 111.3 53.5 -65.5 -36.5 67.2 42.4 41.4 43 44 A Y H X S+ 0 0 11 -4,-2.0 4,-0.7 1,-0.2 3,-0.3 0.916 109.4 49.4 -63.1 -40.2 64.7 42.2 38.6 44 45 A L H < S+ 0 0 33 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.809 107.6 53.3 -70.9 -31.1 61.9 42.9 41.1 45 46 A A H < S+ 0 0 61 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.771 115.9 41.1 -70.1 -27.4 63.7 45.9 42.6 46 47 A S H < S+ 0 0 29 -4,-1.2 2,-0.4 -3,-0.3 -2,-0.2 0.452 114.7 53.4 -99.8 -6.9 64.0 47.4 39.1 47 48 A H S < S- 0 0 43 -4,-0.7 -1,-0.2 -3,-0.2 2,-0.1 -0.967 82.1-122.8-139.0 120.3 60.5 46.5 37.8 48 49 A S - 0 0 83 -2,-0.4 3,-0.2 1,-0.1 -3,-0.1 -0.344 15.8-169.5 -60.4 132.2 57.2 47.4 39.4 49 50 A I + 0 0 17 -5,-0.2 -30,-0.2 1,-0.1 -1,-0.1 0.170 61.3 105.3-102.8 15.2 54.9 44.4 40.2 50 51 A Q S S+ 0 0 129 1,-0.3 2,-0.6 2,-0.1 -1,-0.1 0.833 85.9 41.1 -67.7 -34.2 52.0 46.7 41.1 51 52 A N S > S- 0 0 73 -3,-0.2 4,-1.9 1,-0.1 -1,-0.3 -0.945 79.1-165.7-109.0 106.5 50.3 45.8 37.8 52 53 A G H > S+ 0 0 0 -2,-0.6 4,-2.9 -41,-0.3 5,-0.2 0.842 82.0 56.3 -59.8 -35.5 51.0 42.0 37.4 53 54 A E H > S+ 0 0 74 2,-0.2 4,-3.2 1,-0.2 -1,-0.2 0.933 110.0 41.7 -68.0 -46.8 50.1 41.9 33.7 54 55 A T H > S+ 0 0 69 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.863 114.2 54.8 -68.4 -33.3 52.6 44.5 32.5 55 56 A F H X S+ 0 0 4 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.976 113.3 41.0 -60.2 -52.0 55.1 43.0 34.9 56 57 A L H X S+ 0 0 7 -4,-2.9 4,-2.5 2,-0.2 -2,-0.2 0.925 113.7 53.4 -62.6 -46.3 54.6 39.6 33.3 57 58 A T H X S+ 0 0 90 -4,-3.2 4,-0.8 1,-0.2 -1,-0.2 0.946 111.9 44.4 -53.2 -52.4 54.4 41.1 29.7 58 59 A E H >< S+ 0 0 113 -4,-2.7 3,-0.6 1,-0.2 4,-0.2 0.876 114.6 49.3 -63.4 -37.0 57.7 42.9 30.1 59 60 A L H >X S+ 0 0 0 -4,-2.2 4,-2.8 -5,-0.2 3,-2.1 0.845 97.5 69.9 -68.3 -35.4 59.4 39.8 31.7 60 61 A L H 3< S+ 0 0 87 -4,-2.5 4,-0.2 1,-0.3 -1,-0.2 0.814 94.8 55.2 -55.0 -32.9 58.1 37.5 29.0 61 62 A D T << S+ 0 0 144 -4,-0.8 -1,-0.3 -3,-0.6 -2,-0.2 0.596 117.1 34.7 -77.2 -13.8 60.6 39.2 26.5 62 63 A E T <4 S+ 0 0 126 -3,-2.1 -2,-0.2 -4,-0.2 2,-0.2 0.728 136.1 8.1-109.7 -36.6 63.6 38.4 28.7 63 64 A N X + 0 0 33 -4,-2.8 4,-1.2 1,-0.1 3,-0.5 -0.631 59.9 173.4-149.3 89.1 62.9 35.0 30.4 64 65 A K H > S+ 0 0 116 1,-0.2 4,-2.3 -4,-0.2 5,-0.2 0.831 78.4 60.8 -68.0 -33.8 59.8 33.3 29.0 65 66 A E H > S+ 0 0 120 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.844 105.4 50.7 -62.5 -33.1 60.3 30.0 31.0 66 67 A L H > S+ 0 0 9 -3,-0.5 4,-2.5 2,-0.2 -1,-0.2 0.849 106.7 52.1 -75.5 -37.4 60.1 32.0 34.2 67 68 A V H X S+ 0 0 2 -4,-1.2 4,-3.3 2,-0.2 5,-0.2 0.951 108.9 51.5 -63.1 -46.0 56.8 33.7 33.2 68 69 A L H X S+ 0 0 112 -4,-2.3 4,-2.8 1,-0.2 -2,-0.2 0.922 110.2 49.0 -57.0 -42.2 55.3 30.3 32.5 69 70 A R H X S+ 0 0 88 -4,-1.7 4,-2.5 2,-0.2 5,-0.2 0.925 111.9 48.6 -63.4 -42.3 56.4 29.2 35.9 70 71 A I H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.919 111.8 49.7 -63.8 -42.8 54.9 32.3 37.5 71 72 A L H X S+ 0 0 59 -4,-3.3 4,-2.1 2,-0.2 -2,-0.2 0.937 111.6 48.3 -60.7 -45.9 51.6 31.7 35.6 72 73 A A H X S+ 0 0 55 -4,-2.8 4,-1.7 -5,-0.2 -2,-0.2 0.941 115.2 43.7 -60.9 -48.1 51.5 28.1 36.7 73 74 A V H X S+ 0 0 15 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.831 109.4 56.8 -69.4 -33.6 52.1 28.8 40.3 74 75 A R H X S+ 0 0 32 -4,-2.5 4,-3.0 -5,-0.2 -1,-0.2 0.916 105.9 52.0 -61.0 -42.2 49.7 31.8 40.3 75 76 A E H X S+ 0 0 116 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.914 108.2 50.3 -60.1 -44.7 47.0 29.4 39.1 76 77 A D H X S+ 0 0 103 -4,-1.7 4,-1.7 2,-0.2 -1,-0.2 0.893 113.6 46.3 -60.5 -40.6 47.7 27.0 42.0 77 78 A I H X S+ 0 0 12 -4,-2.1 4,-0.9 2,-0.2 5,-0.2 0.951 111.7 49.9 -69.9 -47.8 47.4 29.9 44.4 78 79 A A H >X S+ 0 0 11 -4,-3.0 4,-3.1 1,-0.2 3,-0.9 0.916 113.1 46.8 -53.7 -48.9 44.2 31.3 42.9 79 80 A E H 3< S+ 0 0 131 -4,-2.5 4,-0.3 1,-0.2 -1,-0.2 0.850 112.6 49.2 -65.6 -33.7 42.5 27.9 43.0 80 81 A S H 3< S+ 0 0 75 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.558 126.7 24.4 -82.6 -6.2 43.6 27.2 46.6 81 82 A V H XX S+ 0 0 52 -3,-0.9 3,-1.6 -4,-0.9 4,-0.8 0.705 95.7 81.2-126.7 -36.1 42.4 30.6 47.8 82 83 A L G >< S+ 0 0 70 -4,-3.1 3,-0.8 1,-0.3 -3,-0.1 0.825 92.0 52.3 -53.1 -41.7 39.6 32.3 45.7 83 84 A D G 34 S+ 0 0 135 -4,-0.3 4,-0.4 -5,-0.3 -1,-0.3 0.666 108.7 51.3 -75.9 -14.4 36.6 30.4 47.1 84 85 A F G <> S+ 0 0 138 -3,-1.6 4,-2.8 1,-0.1 -1,-0.2 0.632 90.7 81.2 -89.6 -15.9 37.5 31.2 50.7 85 86 A L H S+ 0 0 71 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.952 117.0 41.2 -57.5 -49.0 34.2 36.0 50.2 87 88 A G H > S+ 0 0 35 -4,-0.4 4,-1.9 2,-0.2 -2,-0.2 0.930 116.1 47.6 -64.2 -48.0 33.7 34.2 53.5 88 89 A M H X S+ 0 0 123 -4,-2.8 4,-2.0 1,-0.2 -1,-0.2 0.840 111.3 51.4 -65.5 -35.1 37.0 35.3 55.1 89 90 A T H X S+ 0 0 73 -4,-2.2 4,-3.0 -5,-0.2 -1,-0.2 0.890 106.8 53.6 -69.7 -41.0 36.5 39.0 54.1 90 91 A R H X S+ 0 0 174 -4,-1.8 4,-2.2 -5,-0.2 -2,-0.2 0.917 111.7 45.5 -58.9 -42.8 33.0 39.0 55.6 91 92 A N H X S+ 0 0 112 -4,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.865 112.8 50.6 -67.0 -36.2 34.5 37.8 58.9 92 93 A S H X S+ 0 0 69 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.893 110.3 49.5 -67.5 -40.6 37.3 40.3 58.6 93 94 A L H X S+ 0 0 103 -4,-3.0 4,-2.7 2,-0.2 -2,-0.2 0.893 109.0 53.0 -65.6 -41.1 34.8 43.1 58.0 94 95 A A H X S+ 0 0 47 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.901 109.6 48.2 -58.5 -41.7 32.8 41.9 61.0 95 96 A E H X S+ 0 0 135 -4,-2.0 4,-2.8 2,-0.2 -2,-0.2 0.898 109.9 53.9 -64.9 -40.8 36.0 42.2 63.1 96 97 A S H X S+ 0 0 45 -4,-2.2 4,-2.7 2,-0.2 5,-0.2 0.923 107.3 48.5 -56.6 -52.2 36.6 45.6 61.7 97 98 A N H X S+ 0 0 123 -4,-2.7 4,-2.8 1,-0.2 -1,-0.2 0.881 113.2 49.4 -56.2 -42.2 33.1 46.9 62.7 98 99 A I H X S+ 0 0 96 -4,-1.9 4,-2.9 2,-0.2 -2,-0.2 0.945 111.3 48.0 -62.2 -46.6 33.7 45.5 66.2 99 100 A A H X S+ 0 0 55 -4,-2.8 4,-1.5 2,-0.2 -2,-0.2 0.914 116.3 43.7 -65.6 -39.6 37.2 47.1 66.5 100 101 A H H X S+ 0 0 118 -4,-2.7 4,-2.3 2,-0.2 -1,-0.2 0.905 112.9 50.0 -74.3 -42.5 35.8 50.5 65.3 101 102 A R H X S+ 0 0 154 -4,-2.8 4,-2.0 -5,-0.2 -2,-0.2 0.910 109.4 53.8 -56.9 -42.4 32.7 50.3 67.4 102 103 A R H X S+ 0 0 176 -4,-2.9 4,-1.8 2,-0.2 -2,-0.2 0.869 106.3 52.1 -59.3 -37.6 35.1 49.4 70.4 103 104 A H H X S+ 0 0 132 -4,-1.5 4,-1.7 1,-0.2 -1,-0.2 0.919 108.0 52.4 -63.3 -44.0 37.0 52.6 69.6 104 105 A L H X S+ 0 0 112 -4,-2.3 4,-2.9 1,-0.2 -2,-0.2 0.864 106.6 52.1 -57.7 -41.3 33.7 54.5 69.7 105 106 A L H X S+ 0 0 77 -4,-2.0 4,-2.5 1,-0.2 -1,-0.2 0.854 104.0 57.2 -66.2 -34.7 33.0 53.0 73.1 106 107 A E H X S+ 0 0 124 -4,-1.8 4,-1.3 2,-0.2 -1,-0.2 0.921 112.4 42.0 -60.3 -39.6 36.4 54.2 74.2 107 108 A R H >X S+ 0 0 167 -4,-1.7 4,-2.3 2,-0.2 3,-0.8 0.985 112.9 51.1 -68.9 -58.1 35.3 57.8 73.2 108 109 A L H 3X S+ 0 0 90 -4,-2.9 4,-2.2 1,-0.3 -2,-0.2 0.846 107.8 55.7 -44.1 -44.5 31.8 57.5 74.7 109 110 A T H 3X S+ 0 0 85 -4,-2.5 4,-1.5 1,-0.2 -1,-0.3 0.876 107.8 46.7 -62.2 -40.6 33.3 56.3 77.9 110 111 A R H < S+ 0 0 104 -4,-2.6 3,-1.0 1,-0.2 -2,-0.2 0.929 116.4 50.8 -70.2 -43.7 29.5 64.8 81.7 116 117 A D H 3< S+ 0 0 128 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.747 124.7 27.1 -65.7 -29.6 29.4 63.1 85.1 117 118 A N T 3< S- 0 0 104 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.028 105.9-138.5-121.1 25.8 32.3 65.2 86.5 118 119 A F S 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107.5 56.3 -61.3 -36.2 44.0 92.0 59.0 139 19 B T H X S+ 0 0 0 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.945 109.2 45.6 -57.4 -49.2 46.6 92.8 61.7 140 20 B Y H X S+ 0 0 93 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.895 110.8 52.8 -60.9 -42.0 45.1 90.2 64.0 141 21 B Q H X S+ 0 0 20 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.918 110.0 49.0 -61.8 -40.4 44.8 87.7 61.2 142 22 B A H X S+ 0 0 0 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.888 108.1 53.8 -65.3 -40.3 48.5 88.3 60.6 143 23 B V H X S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.915 107.0 51.8 -62.9 -42.6 49.3 87.8 64.3 144 24 B L H X S+ 0 0 56 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.937 107.3 51.7 -57.2 -50.1 47.5 84.4 64.3 145 25 B R H X S+ 0 0 71 -4,-2.1 4,-2.6 1,-0.2 -1,-0.2 0.923 112.4 47.1 -51.5 -45.5 49.5 83.2 61.3 146 26 B I H X S+ 0 0 1 -4,-2.0 4,-2.5 2,-0.2 5,-0.3 0.839 104.8 58.2 -71.5 -32.8 52.7 84.2 63.1 147 27 B Q H X S+ 0 0 47 -4,-2.4 4,-1.5 2,-0.2 -1,-0.2 0.945 110.8 46.0 -57.7 -43.4 51.5 82.5 66.3 148 28 B S H >< S+ 0 0 82 -4,-2.3 3,-0.6 2,-0.2 4,-0.2 0.976 111.8 48.6 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4,-1.8 2,-0.2 3,-0.2 0.882 360.0 58.4 -67.9 -44.5 72.2 52.4 42.5 363 4 D K H > S+ 0 0 139 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.883 105.7 48.8 -54.9 -45.8 71.1 53.8 39.2 364 5 D H H > S+ 0 0 99 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.816 111.8 47.0 -70.7 -33.1 68.3 51.3 38.8 365 6 D I H X S+ 0 0 94 -4,-1.0 4,-1.8 2,-0.2 -1,-0.2 0.758 113.2 51.1 -78.9 -24.9 66.8 51.8 42.3 366 7 D A H X S+ 0 0 45 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.917 111.8 45.6 -72.8 -46.8 67.1 55.6 41.7 367 8 D Q H X S+ 0 0 95 -4,-2.6 4,-1.6 1,-0.2 -2,-0.2 0.835 114.7 50.0 -61.0 -36.1 65.2 55.2 38.3 368 9 D A H X S+ 0 0 22 -4,-1.6 4,-1.6 2,-0.2 -2,-0.2 0.877 110.1 49.1 -70.6 -40.6 62.7 53.0 40.1 369 10 D T H X S+ 0 0 78 -4,-1.8 4,-2.5 2,-0.2 -2,-0.2 0.891 108.2 54.4 -64.4 -42.9 62.2 55.5 42.9 370 11 D V H X S+ 0 0 84 -4,-2.3 4,-3.2 2,-0.2 5,-0.2 0.920 106.0 51.9 -57.3 -49.0 61.6 58.4 40.5 371 12 D K H X S+ 0 0 128 -4,-1.6 4,-2.1 1,-0.2 41,-0.3 0.913 112.9 45.3 -52.6 -48.3 58.9 56.5 38.7 372 13 D V H X S+ 0 0 104 -4,-1.6 4,-1.8 2,-0.2 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111.5 51.4 -61.4 -48.4 44.3 64.8 40.4 383 24 D L H X S+ 0 0 60 -4,-2.9 4,-1.5 1,-0.2 -2,-0.2 0.882 113.8 44.4 -56.7 -43.0 43.3 65.2 44.1 384 25 D R H X S+ 0 0 105 -4,-2.9 4,-1.5 2,-0.2 -1,-0.2 0.884 109.0 56.6 -67.5 -40.5 43.9 69.0 43.9 385 26 D I H X S+ 0 0 0 -4,-2.4 4,-1.0 -5,-0.3 -2,-0.2 0.834 107.4 49.8 -62.8 -32.1 42.1 69.2 40.6 386 27 D Q H X S+ 0 0 31 -4,-2.0 4,-1.8 2,-0.2 -1,-0.2 0.882 105.4 56.9 -68.8 -41.1 39.0 67.6 42.2 387 28 D S H < S+ 0 0 89 -4,-1.5 4,-0.2 1,-0.2 -2,-0.2 0.812 115.7 36.1 -59.8 -34.1 39.2 70.2 45.2 388 29 D E H X S+ 0 0 75 -4,-1.5 4,-1.3 2,-0.2 -1,-0.2 0.567 114.3 55.4 -99.2 -12.7 39.0 73.1 42.7 389 30 D L H X S+ 0 0 12 -4,-1.0 4,-1.3 -5,-0.2 8,-0.4 0.679 96.6 69.0 -80.8 -23.7 36.6 71.3 40.3 390 31 D G H < S+ 0 0 40 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.1 0.782 109.9 32.8 -62.5 -29.0 34.3 70.9 43.4 391 32 D E H 4 S+ 0 0 130 -4,-0.2 -2,-0.2 2,-0.1 -1,-0.2 0.862 126.6 37.0 -91.5 -47.3 33.7 74.6 43.4 392 33 D T H < S+ 0 0 107 -4,-1.3 -3,-0.2 1,-0.2 -2,-0.1 0.948 134.4 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36.7 413 54 D E H > S+ 0 0 89 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.905 111.1 48.8 -77.4 -46.1 51.9 57.6 32.9 414 55 D T H > S+ 0 0 73 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.812 109.8 54.6 -63.5 -33.7 49.4 54.8 32.0 415 56 D F H X S+ 0 0 2 -4,-1.8 4,-1.8 2,-0.2 -1,-0.2 0.946 113.1 40.8 -62.5 -51.2 46.6 56.7 33.8 416 57 D L H X S+ 0 0 12 -4,-1.3 4,-1.5 2,-0.2 -2,-0.2 0.813 111.8 56.7 -69.6 -33.8 47.2 59.9 31.8 417 58 D T H < S+ 0 0 90 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.903 113.5 39.7 -64.5 -41.5 47.8 57.9 28.5 418 59 D E H >< S+ 0 0 111 -4,-1.7 3,-1.0 1,-0.2 4,-0.4 0.798 109.8 60.6 -78.0 -30.2 44.3 56.3 28.9 419 60 D L H >X S+ 0 0 0 -4,-1.8 4,-2.5 1,-0.2 3,-1.7 0.882 88.7 70.7 -65.1 -39.4 42.6 59.4 30.2 420 61 D L T 3< S+ 0 0 73 -4,-1.5 -1,-0.2 1,-0.3 4,-0.2 0.283 90.3 63.2 -69.2 13.3 43.3 61.5 27.0 421 62 D D T <4 S+ 0 0 134 -3,-1.0 -1,-0.3 2,-0.2 -2,-0.2 0.699 116.7 25.3 -97.0 -32.9 40.8 59.3 25.0 422 63 D E T <4 S+ 0 0 126 -3,-1.7 2,-0.4 -4,-0.4 -2,-0.2 0.855 139.3 14.4 -97.1 -46.0 37.8 60.4 27.1 423 64 D N X + 0 0 18 -4,-2.5 4,-0.8 1,-0.1 -1,-0.3 -0.931 57.0 176.7-138.2 111.0 39.0 63.9 28.4 424 65 D K H > S+ 0 0 146 -2,-0.4 4,-0.8 2,-0.2 -4,-0.1 0.637 79.1 56.3 -90.8 -16.5 42.0 65.6 26.9 425 66 D E H > S+ 0 0 138 2,-0.2 4,-1.7 1,-0.1 -1,-0.2 0.714 103.0 53.9 -90.0 -23.0 41.9 68.9 28.9 426 67 D L H > S+ 0 0 10 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.888 107.0 53.3 -69.6 -42.3 42.1 67.2 32.3 427 68 D V H X S+ 0 0 12 -4,-0.8 4,-1.5 1,-0.2 -2,-0.2 0.867 110.0 48.2 -56.1 -39.3 45.2 65.5 31.0 428 69 D L H X S+ 0 0 122 -4,-0.8 4,-1.9 2,-0.2 -1,-0.2 0.867 113.3 46.6 -70.7 -39.7 46.6 68.9 30.1 429 70 D R H X S+ 0 0 94 -4,-1.7 4,-3.1 2,-0.2 5,-0.3 0.883 107.7 56.0 -68.7 -42.3 45.7 70.4 33.6 430 71 D I H X S+ 0 0 1 -4,-3.0 4,-2.8 2,-0.2 5,-0.2 0.914 109.5 47.4 -55.2 -46.3 47.1 67.4 35.5 431 72 D L H X S+ 0 0 67 -4,-1.5 4,-1.8 2,-0.2 -2,-0.2 0.958 115.7 44.0 -59.1 -51.9 50.4 68.0 33.8 432 73 D A H X S+ 0 0 65 -4,-1.9 4,-1.0 1,-0.2 -2,-0.2 0.813 118.1 44.9 -64.6 -33.7 50.3 71.7 34.5 433 74 D V H X S+ 0 0 17 -4,-3.1 4,-2.0 2,-0.2 -1,-0.2 0.826 109.0 55.5 -79.9 -34.8 49.2 71.1 38.1 434 75 D R H X S+ 0 0 28 -4,-2.8 4,-3.2 -5,-0.3 -2,-0.2 0.863 104.8 54.0 -65.2 -38.5 51.7 68.3 38.8 435 76 D E H X S+ 0 0 106 -4,-1.8 4,-3.2 2,-0.2 5,-0.3 0.920 107.7 50.4 -58.5 -46.1 54.6 70.7 37.8 436 77 D D H X S+ 0 0 103 -4,-1.0 4,-1.2 1,-0.2 -2,-0.2 0.902 114.7 43.3 -61.2 -43.8 53.4 73.2 40.3 437 78 D I H X S+ 0 0 17 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.930 117.4 47.3 -65.3 -46.1 53.2 70.6 43.0 438 79 D A H X S+ 0 0 7 -4,-3.2 4,-3.2 2,-0.2 3,-0.4 0.967 108.9 49.9 -62.8 -58.6 56.6 69.1 41.9 439 80 D E H < S+ 0 0 142 -4,-3.2 4,-0.5 1,-0.3 -1,-0.2 0.850 115.6 47.4 -49.4 -39.1 58.7 72.3 41.7 440 81 D S H < S+ 0 0 78 -4,-1.2 -1,-0.3 -5,-0.3 -2,-0.2 0.875 123.7 29.0 -67.5 -41.6 57.4 73.2 45.1 441 82 D V H >X S+ 0 0 49 -4,-1.9 3,-1.4 -3,-0.4 4,-1.1 0.860 101.8 72.6 -93.1 -40.9 58.1 69.9 46.8 442 83 D L T 3< S+ 0 0 66 -4,-3.2 3,-0.4 1,-0.3 -3,-0.1 0.795 93.5 53.8 -55.2 -41.9 61.1 68.2 45.0 443 84 D D T 34 S+ 0 0 142 -4,-0.5 4,-0.3 -5,-0.3 -1,-0.3 0.772 111.9 46.8 -64.7 -26.6 63.9 70.5 46.4 444 85 D F T <> S+ 0 0 132 -3,-1.4 4,-2.2 -4,-0.2 3,-0.3 0.686 89.5 85.2 -87.3 -20.5 62.8 69.8 50.0 445 86 D L H X S+ 0 0 48 -4,-1.1 4,-2.0 -3,-0.4 5,-0.2 0.814 86.7 52.2 -54.7 -42.5 62.4 66.0 49.7 446 87 D P H > S+ 0 0 69 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.921 114.1 42.1 -59.3 -46.4 66.1 65.1 50.4 447 88 D G H > S+ 0 0 38 -4,-0.3 4,-1.4 -3,-0.3 -2,-0.2 0.836 116.2 47.8 -71.4 -36.5 66.3 67.2 53.6 448 89 D M H X S+ 0 0 111 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.868 111.2 50.1 -71.7 -39.4 62.9 66.0 54.9 449 90 D T H X S+ 0 0 78 -4,-2.0 4,-2.8 -5,-0.2 -2,-0.2 0.840 108.6 52.7 -70.2 -35.5 63.5 62.3 54.2 450 91 D R H X S+ 0 0 174 -4,-1.5 4,-2.2 2,-0.2 -1,-0.2 0.906 113.1 43.7 -63.0 -45.3 66.9 62.4 56.0 451 92 D N H X S+ 0 0 122 -4,-1.4 4,-1.4 2,-0.2 -2,-0.2 0.813 115.0 49.3 -69.9 -33.3 65.3 64.0 59.1 452 93 D S H X S+ 0 0 82 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.912 111.2 50.5 -68.3 -44.4 62.4 61.5 58.9 453 94 D L H X S+ 0 0 99 -4,-2.8 4,-3.1 1,-0.2 -2,-0.2 0.910 110.9 47.5 -58.3 -47.6 64.9 58.6 58.5 454 95 D A H X S+ 0 0 48 -4,-2.2 4,-1.7 2,-0.2 -1,-0.2 0.840 111.5 51.1 -64.6 -34.5 66.9 59.7 61.6 455 96 D E H X S+ 0 0 134 -4,-1.4 4,-1.0 2,-0.2 -1,-0.2 0.829 112.9 46.7 -70.8 -33.0 63.6 60.1 63.5 456 97 D S H X S+ 0 0 44 -4,-2.0 4,-2.2 2,-0.2 5,-0.2 0.924 109.7 53.6 -69.1 -48.8 62.7 56.5 62.4 457 98 D N H X S+ 0 0 82 -4,-3.1 4,-1.3 1,-0.2 -2,-0.2 0.837 111.6 44.6 -55.7 -39.5 66.2 55.2 63.4 458 99 D I H < S+ 0 0 95 -4,-1.7 -1,-0.2 2,-0.2 4,-0.2 0.789 111.6 55.0 -76.7 -29.4 65.9 56.6 66.9 459 100 D A H >< S+ 0 0 47 -4,-1.0 3,-0.6 -5,-0.2 -2,-0.2 0.904 111.7 40.6 -69.8 -44.2 62.4 55.3 67.3 460 101 D H H 3< S+ 0 0 148 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.1 0.859 106.3 60.6 -75.7 -38.2 63.1 51.6 66.4 461 102 D R T 3< S+ 0 0 181 -4,-1.3 2,-0.2 -5,-0.2 -1,-0.2 0.403 86.8 95.7 -77.8 4.3 66.4 51.1 68.3 462 103 D R < 0 0 165 -3,-0.6 -3,-0.0 -4,-0.2 -4,-0.0 -0.610 360.0 360.0 -90.4 155.8 64.8 51.9 71.7 463 104 D H 0 0 242 -2,-0.2 -1,-0.2 0, 0.0 0, 0.0 0.913 360.0 360.0 -74.0 360.0 63.6 49.2 74.1