==== 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 OXYGEN TRANSPORT 18-OCT-90 1HMO . COMPND 2 MOLECULE: HEMERYTHRIN; . SOURCE 2 ORGANISM_SCIENTIFIC: THEMISTE DYSCRITUM; . AUTHOR M.A.HOLMES,I.LETRONG,S.TURLEY,L.C.SIEKER,R.E.STENKAMP . 452 4 2 0 2 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22206.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 348 77.0 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 . 16 3.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 51 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 265 58.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 3.5 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 4 1 3 0 0 4 0 0 0 1 3 0 0 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 G 0 0 106 0, 0.0 3,-0.0 0, 0.0 430,-0.0 0.000 360.0 360.0 360.0 98.1 7.2 37.7 19.9 2 2 A F - 0 0 70 94,-0.1 98,-0.1 1,-0.1 97,-0.1 -0.678 360.0 -96.5 -94.4 151.5 6.6 36.6 16.4 3 3 A P - 0 0 99 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.337 32.7-125.9 -60.6 144.6 4.4 38.7 14.1 4 4 A I - 0 0 59 -2,-0.0 92,-0.1 -3,-0.0 4,-0.0 -0.880 29.9-119.7 -95.3 115.8 0.8 37.5 13.8 5 5 A P - 0 0 20 0, 0.0 5,-0.0 0, 0.0 94,-0.0 -0.193 24.4-132.3 -59.0 145.9 -0.1 37.1 10.1 6 6 A D S S+ 0 0 141 1,-0.3 2,-0.2 2,-0.1 -2,-0.0 -0.918 101.8 36.5-145.3 113.3 -2.9 39.2 8.8 7 7 A P S S- 0 0 86 0, 0.0 2,-1.9 0, 0.0 -1,-0.3 0.594 112.8-116.5 -62.8 155.9 -4.9 37.7 7.3 8 8 A Y + 0 0 1 -2,-0.2 2,-0.3 21,-0.1 25,-0.3 -0.494 69.1 127.7 -72.9 82.2 -4.3 34.8 9.6 9 9 A a - 0 0 57 -2,-1.9 2,-0.1 23,-0.1 17,-0.1 -0.915 64.7 -92.5-136.6 153.5 -3.0 32.4 7.1 10 10 A W - 0 0 47 -2,-0.3 2,-0.3 16,-0.2 16,-0.0 -0.416 41.6-173.5 -64.4 144.8 0.1 30.2 6.9 11 11 A D > - 0 0 64 -2,-0.1 3,-2.3 -6,-0.0 4,-0.1 -0.882 41.6 -98.8-134.7 169.1 3.2 31.7 5.1 12 12 A I G > S+ 0 0 111 -2,-0.3 3,-1.5 1,-0.3 -2,-0.0 0.602 113.4 77.6 -67.3 -9.4 6.5 30.1 4.1 13 13 A S G 3 S+ 0 0 56 1,-0.3 -1,-0.3 3,-0.0 -3,-0.0 0.732 91.5 57.8 -68.1 -19.0 8.2 31.6 7.2 14 14 A F G < S+ 0 0 1 -3,-2.3 -1,-0.3 8,-0.0 -2,-0.2 0.397 78.6 137.0 -89.3 0.2 6.4 28.8 9.0 15 15 A R < + 0 0 97 -3,-1.5 4,-0.1 1,-0.2 -3,-0.0 -0.243 29.9 178.3 -54.3 134.5 8.1 26.1 7.0 16 16 A T - 0 0 1 2,-0.3 -1,-0.2 3,-0.0 3,-0.1 0.600 44.5-121.7-105.6 -18.3 9.3 23.1 8.8 17 17 A F S S+ 0 0 101 1,-0.2 2,-0.8 93,-0.1 208,-0.1 0.301 85.5 108.4 85.3 3.3 10.6 21.2 5.7 18 18 A Y > - 0 0 29 1,-0.2 4,-2.7 114,-0.1 -2,-0.3 -0.930 59.4-159.1-106.1 103.4 8.3 18.3 6.5 19 19 A T H > S+ 0 0 63 -2,-0.8 4,-2.7 1,-0.2 5,-0.2 0.897 89.0 51.3 -57.2 -41.1 5.7 18.6 3.8 20 20 A I H > S+ 0 0 88 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.915 112.6 46.7 -64.8 -42.9 3.1 16.6 5.6 21 21 A I H > S+ 0 0 1 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.943 112.0 50.1 -62.3 -48.8 3.6 18.7 8.8 22 22 A D H X S+ 0 0 9 -4,-2.7 4,-1.8 2,-0.2 -2,-0.2 0.888 109.2 51.4 -57.9 -47.7 3.4 22.0 6.8 23 23 A D H X S+ 0 0 87 -4,-2.7 4,-1.0 1,-0.2 -1,-0.2 0.896 111.4 48.6 -59.1 -39.9 0.1 20.9 5.0 24 24 A E H >X S+ 0 0 13 -4,-2.0 4,-1.1 -5,-0.2 3,-0.8 0.924 106.6 55.6 -65.8 -41.7 -1.4 20.1 8.4 25 25 A H H >X S+ 0 0 1 -4,-2.7 4,-2.2 1,-0.3 3,-0.8 0.897 100.2 60.1 -56.5 -41.4 -0.3 23.4 9.9 26 26 A K H 3X S+ 0 0 82 -4,-1.8 4,-2.0 1,-0.3 -1,-0.3 0.861 101.8 54.2 -53.7 -35.4 -2.1 25.2 7.0 27 27 A T H X S+ 0 0 29 -4,-2.9 4,-1.9 -25,-0.3 3,-0.6 0.940 106.9 50.6 -57.7 -49.9 -9.3 32.2 10.8 34 34 A L H 3X S+ 0 0 36 -4,-2.8 4,-1.9 1,-0.3 -1,-0.2 0.913 109.0 51.2 -54.9 -43.8 -12.8 30.7 10.5 35 35 A L H 3< S+ 0 0 4 -4,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.779 106.5 54.6 -63.0 -32.1 -13.4 31.2 14.3 36 36 A S H << S+ 0 0 52 -4,-1.6 -1,-0.2 -3,-0.6 -2,-0.2 0.822 111.1 46.3 -70.8 -28.8 -12.2 34.8 13.9 37 37 A Q H < S- 0 0 128 -4,-1.9 2,-0.2 1,-0.3 -2,-0.2 0.846 137.7 -3.7 -77.4 -35.5 -14.9 35.2 11.2 38 38 A A < - 0 0 37 -4,-1.9 2,-2.0 -5,-0.2 -1,-0.3 -0.790 61.9-144.2-164.2 111.2 -17.6 33.5 13.3 39 39 A D + 0 0 87 -2,-0.2 2,-0.2 -3,-0.2 -4,-0.1 -0.538 55.1 130.3 -80.7 79.8 -17.2 31.8 16.7 40 40 A N S > S- 0 0 67 -2,-2.0 4,-2.1 1,-0.0 5,-0.2 -0.727 71.1 -95.8-125.4-178.2 -19.6 28.9 16.2 41 41 A A H > S+ 0 0 69 1,-0.2 4,-2.4 -2,-0.2 5,-0.2 0.859 117.2 53.1 -66.5 -44.3 -19.8 25.1 16.6 42 42 A D H > S+ 0 0 120 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.839 111.9 45.7 -58.6 -49.0 -19.0 24.3 13.0 43 43 A H H > S+ 0 0 38 2,-0.2 4,-2.0 1,-0.2 -8,-0.2 0.860 113.6 48.4 -62.6 -44.6 -15.8 26.3 13.0 44 44 A L H X S+ 0 0 34 -4,-2.1 4,-2.8 2,-0.2 -2,-0.2 0.889 110.1 52.4 -64.7 -40.8 -14.7 25.0 16.4 45 45 A N H X S+ 0 0 104 -4,-2.4 4,-2.8 2,-0.2 5,-0.2 0.888 109.5 50.2 -56.1 -48.6 -15.4 21.4 15.3 46 46 A E H X S+ 0 0 80 -4,-1.8 4,-2.5 1,-0.2 5,-0.2 0.939 114.9 41.8 -56.7 -51.1 -13.2 21.9 12.2 47 47 A L H X S+ 0 0 1 -4,-2.0 4,-2.3 -16,-0.2 -2,-0.2 0.907 115.0 51.2 -62.8 -47.0 -10.4 23.4 14.2 48 48 A R H X S+ 0 0 76 -4,-2.8 4,-2.1 2,-0.2 -2,-0.2 0.853 111.6 47.4 -60.5 -44.0 -10.7 20.8 16.9 49 49 A R H X S+ 0 0 134 -4,-2.8 4,-2.4 2,-0.2 5,-0.3 0.951 114.6 45.7 -62.4 -55.1 -10.7 17.9 14.4 50 50 A C H X S+ 0 0 6 -4,-2.5 4,-2.5 -5,-0.2 -2,-0.2 0.861 114.4 48.8 -57.3 -39.4 -7.6 19.2 12.5 51 51 A T H X S+ 0 0 0 -4,-2.3 4,-3.0 2,-0.2 5,-0.3 0.916 110.4 48.4 -64.1 -51.2 -5.8 20.0 15.7 52 52 A G H X S+ 0 0 24 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.918 116.4 45.4 -58.4 -45.7 -6.3 16.6 17.4 53 53 A K H X S+ 0 0 84 -4,-2.4 4,-2.7 2,-0.2 5,-0.2 0.915 114.0 46.6 -63.1 -50.3 -5.3 14.9 14.1 54 54 A H H X S+ 0 0 0 -4,-2.5 4,-2.9 -5,-0.3 5,-0.3 0.941 111.6 51.7 -60.3 -49.0 -2.2 17.1 13.6 55 55 A F H X S+ 0 0 5 -4,-3.0 4,-2.0 1,-0.2 -1,-0.2 0.919 112.7 45.6 -55.9 -42.4 -1.0 16.7 17.2 56 56 A L H X S+ 0 0 94 -4,-2.0 4,-2.2 -5,-0.3 -1,-0.2 0.929 113.7 48.2 -69.5 -44.1 -1.3 12.9 17.0 57 57 A N H X S+ 0 0 52 -4,-2.7 4,-2.0 2,-0.2 -1,-0.2 0.878 113.1 47.3 -60.3 -43.6 0.5 12.7 13.6 58 58 A E H X S+ 0 0 0 -4,-2.9 4,-2.2 -5,-0.2 -1,-0.2 0.900 110.4 53.4 -67.7 -35.8 3.3 14.9 14.7 59 59 A Q H X S+ 0 0 11 -4,-2.0 4,-2.4 -5,-0.3 -2,-0.2 0.890 108.0 50.8 -59.8 -43.8 3.6 12.9 17.9 60 60 A Q H X S+ 0 0 102 -4,-2.2 4,-1.5 1,-0.2 -1,-0.2 0.888 107.7 52.0 -64.5 -42.9 3.9 9.8 15.9 61 61 A L H X S+ 0 0 48 -4,-2.0 4,-0.6 2,-0.2 -2,-0.2 0.881 110.1 49.7 -58.3 -40.7 6.6 11.3 13.7 62 62 A M H ><>S+ 0 0 0 -4,-2.2 5,-2.7 1,-0.2 3,-0.9 0.907 110.2 50.9 -63.0 -45.1 8.5 12.3 16.9 63 63 A Q H ><5S+ 0 0 107 -4,-2.4 3,-1.5 1,-0.2 -1,-0.2 0.797 96.7 68.8 -63.6 -31.8 8.2 8.7 18.3 64 64 A S H 3<5S+ 0 0 104 -4,-1.5 -1,-0.2 1,-0.3 -2,-0.2 0.766 111.8 31.3 -65.9 -20.4 9.5 7.1 15.1 65 65 A S T <<5S- 0 0 68 -3,-0.9 -1,-0.3 -4,-0.6 -2,-0.2 0.120 112.9-115.0-116.3 12.2 12.9 8.5 15.8 66 66 A Q T < 5 - 0 0 180 -3,-1.5 -3,-0.2 1,-0.2 -2,-0.1 0.869 40.5-152.2 52.0 45.8 12.6 8.3 19.6 67 67 A Y > < - 0 0 32 -5,-2.7 3,-1.4 1,-0.2 4,-0.2 -0.172 10.6-140.7 -51.7 127.5 12.8 12.1 19.7 68 68 A A T 3 S+ 0 0 107 1,-0.3 3,-0.3 -3,-0.2 -1,-0.2 0.740 98.0 55.3 -66.6 -24.5 14.2 13.3 23.0 69 69 A G T 3> S+ 0 0 21 1,-0.2 4,-2.1 2,-0.1 -1,-0.3 0.349 75.8 108.3 -92.5 10.8 11.8 16.3 23.3 70 70 A Y H <> S+ 0 0 55 -3,-1.4 4,-3.4 1,-0.2 5,-0.3 0.911 72.3 50.9 -54.8 -53.4 8.7 14.2 22.9 71 71 A A H > S+ 0 0 62 -3,-0.3 4,-2.2 1,-0.3 -1,-0.2 0.926 113.7 43.7 -55.4 -47.8 7.3 14.4 26.4 72 72 A E H > S+ 0 0 104 1,-0.2 4,-1.5 2,-0.2 -1,-0.3 0.867 115.1 50.2 -67.3 -36.4 7.5 18.1 26.7 73 73 A H H X S+ 0 0 3 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.904 109.0 50.9 -70.8 -39.7 6.1 18.6 23.2 74 74 A K H X S+ 0 0 67 -4,-3.4 4,-2.8 -5,-0.3 5,-0.2 0.934 107.1 54.8 -62.7 -42.3 3.2 16.3 23.9 75 75 A K H X S+ 0 0 117 -4,-2.2 4,-1.8 -5,-0.3 -1,-0.2 0.907 106.5 51.0 -58.9 -40.3 2.4 18.2 27.1 76 76 A A H X S+ 0 0 24 -4,-1.5 4,-1.7 2,-0.2 -1,-0.2 0.903 111.3 48.0 -62.6 -45.3 2.2 21.5 25.1 77 77 A H H X S+ 0 0 0 -4,-2.0 4,-2.3 1,-0.2 5,-0.2 0.952 110.6 51.3 -58.2 -50.6 -0.2 19.9 22.6 78 78 A D H X S+ 0 0 69 -4,-2.8 4,-1.7 1,-0.2 -1,-0.2 0.826 105.5 55.5 -58.7 -40.1 -2.4 18.5 25.3 79 79 A D H X S+ 0 0 60 -4,-1.8 4,-1.5 -5,-0.2 -1,-0.2 0.878 109.1 48.2 -62.7 -37.9 -2.6 21.9 27.0 80 80 A F H X S+ 0 0 2 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.871 107.8 53.1 -70.4 -42.2 -3.9 23.4 23.8 81 81 A I H X S+ 0 0 24 -4,-2.3 4,-3.0 2,-0.2 -1,-0.2 0.900 106.6 55.1 -52.4 -45.9 -6.5 20.6 23.2 82 82 A H H X S+ 0 0 104 -4,-1.7 4,-0.7 1,-0.2 -1,-0.2 0.898 106.7 50.2 -53.5 -43.2 -7.7 21.3 26.7 83 83 A K H >< S+ 0 0 67 -4,-1.5 3,-0.6 1,-0.2 -1,-0.2 0.870 111.2 48.2 -64.6 -41.5 -8.2 25.0 25.7 84 84 A L H >< S+ 0 0 5 -4,-2.2 3,-1.2 1,-0.2 -2,-0.2 0.905 110.8 51.6 -66.8 -36.5 -10.1 23.9 22.6 85 85 A D H 3< S+ 0 0 94 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.514 117.6 37.7 -75.4 -14.8 -12.3 21.6 24.7 86 86 A T T << S- 0 0 79 -4,-0.7 -1,-0.3 -3,-0.6 -2,-0.2 -0.243 91.8-177.3-123.7 34.7 -13.1 24.4 27.3 87 87 A W < + 0 0 47 -3,-1.2 -3,-0.1 1,-0.1 -4,-0.0 -0.200 18.9 178.0 -49.1 124.4 -13.3 27.0 24.5 88 88 A D - 0 0 129 -5,-0.2 -1,-0.1 2,-0.1 3,-0.1 0.228 53.6-104.2-108.7 -0.3 -14.0 30.5 25.9 89 89 A G + 0 0 23 1,-0.2 2,-2.0 2,-0.0 3,-0.2 0.521 68.6 148.7 82.7 10.0 -13.9 32.3 22.5 90 90 A D > + 0 0 67 1,-0.2 4,-1.4 2,-0.1 3,-0.2 -0.528 11.8 167.4 -79.2 84.9 -10.5 33.9 23.1 91 91 A V H > S+ 0 0 23 -2,-2.0 4,-2.6 1,-0.2 -1,-0.2 0.752 71.3 61.6 -66.4 -30.7 -9.4 33.9 19.4 92 92 A T H > S+ 0 0 97 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.926 102.1 50.3 -64.3 -43.7 -6.4 36.2 20.3 93 93 A Y H > S+ 0 0 94 1,-0.2 4,-2.8 -3,-0.2 -1,-0.2 0.901 111.4 48.9 -57.0 -51.9 -5.0 33.6 22.5 94 94 A A H X S+ 0 0 0 -4,-1.4 4,-2.5 2,-0.2 5,-0.2 0.924 108.6 52.2 -59.7 -44.3 -5.3 31.0 19.8 95 95 A K H X S+ 0 0 46 -4,-2.6 4,-1.6 1,-0.2 -2,-0.2 0.908 116.1 40.8 -59.3 -42.5 -3.7 33.1 17.1 96 96 A N H X S+ 0 0 80 -4,-2.2 4,-2.3 1,-0.2 5,-0.3 0.883 111.4 56.7 -68.7 -50.1 -0.7 33.8 19.3 97 97 A W H X S+ 0 0 40 -4,-2.8 4,-2.2 -5,-0.2 -2,-0.2 0.910 109.2 45.4 -49.3 -52.2 -0.5 30.2 20.6 98 98 A L H X S+ 0 0 1 -4,-2.5 4,-2.3 2,-0.2 5,-0.3 0.932 112.3 48.6 -64.4 -47.3 -0.2 28.7 17.2 99 99 A V H X S+ 0 0 2 -4,-1.6 4,-2.2 -5,-0.2 5,-0.2 0.931 116.3 44.5 -56.5 -48.2 2.4 31.1 15.8 100 100 A N H X>S+ 0 0 65 -4,-2.3 4,-2.2 1,-0.2 5,-0.6 0.868 110.9 54.1 -62.0 -43.4 4.6 30.7 18.9 101 101 A H H X>S+ 0 0 5 -4,-2.2 5,-2.6 -5,-0.3 4,-1.7 0.925 112.9 41.1 -60.5 -49.0 4.2 26.9 19.0 102 102 A I H <>S+ 0 0 0 -4,-2.3 5,-1.7 3,-0.2 -2,-0.2 0.967 117.4 46.7 -63.2 -54.1 5.3 26.3 15.5 103 103 A K H <5S+ 0 0 32 -4,-2.2 -2,-0.2 -5,-0.3 -1,-0.2 0.734 129.9 19.7 -68.6 -20.9 8.2 28.9 15.5 104 104 A T H <5S+ 0 0 4 -4,-2.2 4,-0.3 -5,-0.2 -3,-0.2 0.840 132.7 30.1-116.0 -35.8 9.6 27.8 18.9 105 105 A I T ><>4 S+ 0 0 0 -3,-2.0 3,-2.6 -4,-0.3 4,-0.6 0.582 77.3 121.8 -87.3 -11.3 12.5 19.0 16.1 110 110 A R T << S+ 0 0 95 -3,-0.9 -93,-0.1 -4,-0.5 -3,-0.0 -0.237 82.8 11.9 -55.3 127.5 13.8 20.0 12.6 111 111 A G T 34 S+ 0 0 59 20,-0.1 -1,-0.3 1,-0.0 -2,-0.1 0.216 118.1 76.4 86.7 -5.8 16.7 17.7 11.7 112 112 A K T <4 0 0 125 -3,-2.6 -2,-0.2 1,-0.1 -44,-0.1 0.437 360.0 360.0-112.9 -10.2 15.9 15.3 14.5 113 113 A I < 0 0 11 -4,-0.6 -3,-0.1 -46,-0.1 -1,-0.1 0.276 360.0 360.0-134.8 360.0 12.9 13.5 13.2 114 !* 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 0.0 115 1 B G 0 0 109 0, 0.0 99,-0.0 0, 0.0 98,-0.0 0.000 360.0 360.0 360.0 103.5 31.2 21.0 -10.6 116 2 B F - 0 0 74 94,-0.1 98,-0.1 1,-0.1 97,-0.1 -0.681 360.0 -97.8-109.2 152.4 31.4 19.8 -7.0 117 3 B P - 0 0 98 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.158 31.4-124.3 -60.4 149.2 34.1 18.5 -4.9 118 4 B I - 0 0 60 95,-0.0 92,-0.1 4,-0.0 4,-0.0 -0.915 29.8-125.0 -97.7 112.7 34.5 14.8 -4.4 119 5 B P - 0 0 20 0, 0.0 5,-0.0 0, 0.0 94,-0.0 -0.264 23.9-127.4 -58.2 144.7 34.4 14.0 -0.7 120 6 B D S S+ 0 0 143 1,-0.2 2,-0.2 2,-0.1 -2,-0.0 -0.937 101.3 36.8-137.9 116.0 37.5 12.1 0.6 121 7 B P S S- 0 0 94 0, 0.0 2,-1.8 0, 0.0 -1,-0.2 0.650 110.9-116.1 -67.5 157.6 36.8 9.6 2.1 122 8 B Y + 0 0 1 -2,-0.2 2,-0.3 21,-0.1 25,-0.3 -0.488 68.8 125.1 -73.4 82.4 33.9 9.0 -0.2 123 9 B a - 0 0 55 -2,-1.8 17,-0.1 23,-0.1 -3,-0.0 -0.950 65.9 -89.0-140.9 153.4 31.0 9.3 2.3 124 10 B W - 0 0 46 -2,-0.3 2,-0.3 16,-0.2 16,-0.0 -0.290 42.1-172.5 -59.2 143.1 27.9 11.3 2.6 125 11 B D > - 0 0 60 1,-0.0 3,-2.2 -6,-0.0 4,-0.1 -0.924 40.1-101.1-134.2 169.6 28.2 14.7 4.3 126 12 B I G > S+ 0 0 111 -2,-0.3 3,-1.6 1,-0.3 -2,-0.0 0.660 112.0 77.5 -70.8 -7.0 25.5 17.2 5.3 127 13 B S G 3 S+ 0 0 57 1,-0.3 -1,-0.3 3,-0.0 -3,-0.0 0.687 92.6 56.8 -70.2 -15.3 26.2 19.4 2.3 128 14 B F G < S+ 0 0 2 -3,-2.2 -1,-0.3 8,-0.0 -2,-0.2 0.457 77.2 133.9 -92.5 -5.1 24.2 16.8 0.4 129 15 B R < - 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0 0 2 2,-0.3 -1,-0.2 -2,-0.1 3,-0.1 0.519 45.0-123.0-101.9 -17.8 32.5 20.9 40.0 359 17 D F S S+ 0 0 149 1,-0.2 2,-0.7 93,-0.1 3,-0.1 0.445 84.0 111.5 77.7 8.3 34.5 21.2 43.2 360 18 D Y > - 0 0 47 1,-0.2 4,-2.9 2,-0.0 -2,-0.3 -0.960 58.8-158.5-104.0 105.1 35.4 24.8 42.4 361 19 D T H > S+ 0 0 75 -2,-0.7 4,-2.4 1,-0.3 5,-0.2 0.853 88.6 51.4 -57.8 -38.0 33.3 26.6 45.1 362 20 D I H > S+ 0 0 86 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.869 113.2 46.0 -66.3 -42.0 33.1 29.9 43.4 363 21 D I H > S+ 0 0 1 -3,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.917 111.5 51.2 -62.1 -50.9 31.9 28.1 40.2 364 22 D D H X S+ 0 0 4 -4,-2.9 4,-1.6 1,-0.2 -2,-0.2 0.879 109.8 51.1 -54.0 -43.0 29.3 26.0 42.1 365 23 D D H X S+ 0 0 10 -4,-2.4 4,-1.0 1,-0.2 -1,-0.2 0.858 109.6 48.5 -66.1 -40.3 28.0 29.2 43.8 366 24 D E H X S+ 0 0 15 -4,-1.6 4,-0.9 1,-0.2 3,-0.4 0.876 108.3 56.4 -65.0 -37.6 27.5 31.0 40.6 367 25 D H H >X S+ 0 0 1 -4,-2.4 4,-1.9 1,-0.2 3,-0.7 0.861 98.3 59.6 -61.6 -38.9 25.8 27.9 39.1 368 26 D K H 3X S+ 0 0 7 -4,-1.6 4,-2.0 1,-0.3 -1,-0.2 0.861 103.3 54.0 -57.1 -32.3 23.2 28.0 41.9 369 27 D T H 3X S+ 0 0 2 -4,-1.0 4,-1.5 -3,-0.4 -1,-0.3 0.771 104.5 53.2 -71.8 -33.9 22.3 31.4 40.7 370 28 D L H X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 3,-0.5 0.936 109.5 50.0 -57.3 -46.5 12.0 32.3 38.3 377 35 D L H 3< S+ 0 0 4 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.816 106.6 56.8 -59.3 -36.5 11.3 32.4 34.6 378 36 D S H 3< S+ 0 0 51 -4,-2.2 -1,-0.3 1,-0.2 -2,-0.2 0.803 110.4 44.2 -62.8 -35.0 9.4 29.1 35.1 379 37 D Q H << S- 0 0 101 -4,-1.6 2,-0.4 -3,-0.5 -2,-0.2 0.916 136.6 -2.5 -78.9 -41.8 7.2 30.8 37.7 380 38 D A < - 0 0 39 -4,-2.6 2,-1.5 -5,-0.2 -1,-0.3 -0.915 62.0-142.1-156.9 120.1 6.6 34.0 35.6 381 39 D D + 0 0 89 -2,-0.4 2,-0.2 -3,-0.2 -4,-0.1 -0.683 53.9 130.2 -83.7 89.5 8.1 34.9 32.3 382 40 D N S > S- 0 0 66 -2,-1.5 4,-1.7 1,-0.0 5,-0.1 -0.751 70.1 -97.7-133.1 179.4 8.7 38.7 32.8 383 41 D A H > S+ 0 0 66 -2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.887 116.4 54.9 -68.8 -42.1 11.5 41.3 32.3 384 42 D D H > S+ 0 0 73 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.848 111.5 44.4 -56.9 -50.8 12.7 41.3 36.0 385 43 D H H > S+ 0 0 16 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.856 114.6 49.1 -61.9 -44.6 13.2 37.5 36.0 386 44 D L H X S+ 0 0 35 -4,-1.7 4,-2.8 2,-0.2 -2,-0.2 0.916 111.2 49.7 -62.0 -45.4 14.9 37.6 32.6 387 45 D N H X S+ 0 0 96 -4,-2.9 4,-2.3 2,-0.2 5,-0.2 0.820 109.4 52.2 -58.7 -46.4 17.2 40.5 33.7 388 46 D E H X S+ 0 0 9 -4,-1.6 4,-2.1 -5,-0.2 -2,-0.2 0.961 114.8 41.3 -59.3 -45.6 18.1 38.5 36.8 389 47 D L H X S+ 0 0 1 -4,-2.3 4,-2.3 -16,-0.2 -2,-0.2 0.868 113.8 52.8 -66.9 -46.7 19.0 35.5 34.8 390 48 D R H X S+ 0 0 78 -4,-2.8 4,-2.7 2,-0.2 -1,-0.2 0.872 111.0 47.0 -57.0 -44.0 20.8 37.5 32.0 391 49 D R H X S+ 0 0 68 -4,-2.3 4,-2.6 2,-0.2 5,-0.2 0.948 114.7 45.2 -61.0 -57.4 23.0 39.3 34.6 392 50 D C H X S+ 0 0 1 -4,-2.1 4,-2.5 -5,-0.2 -2,-0.2 0.857 115.4 48.4 -57.6 -36.6 23.9 36.1 36.4 393 51 D T H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 5,-0.3 0.932 111.2 48.6 -71.1 -51.4 24.6 34.3 33.1 394 52 D G H X S+ 0 0 23 -4,-2.7 4,-1.8 1,-0.2 -2,-0.2 0.901 117.2 44.0 -53.0 -49.1 26.7 37.1 31.6 395 53 D K H X S+ 0 0 65 -4,-2.6 4,-2.7 -5,-0.2 5,-0.2 0.924 113.9 47.5 -67.1 -50.6 28.8 37.3 34.9 396 54 D H H X S+ 0 0 2 -4,-2.5 4,-3.5 -5,-0.2 5,-0.3 0.933 111.5 51.1 -55.6 -49.9 29.2 33.5 35.4 397 55 D F H X S+ 0 0 6 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.932 113.4 44.5 -57.9 -42.6 30.3 32.9 31.8 398 56 D L H X S+ 0 0 92 -4,-1.8 4,-2.5 -5,-0.3 -1,-0.2 0.949 114.2 49.4 -68.8 -45.3 32.9 35.6 32.0 399 57 D N H X S+ 0 0 59 -4,-2.7 4,-1.8 1,-0.2 -2,-0.2 0.900 113.5 46.2 -59.4 -45.0 34.1 34.5 35.4 400 58 D E H X S+ 0 0 0 -4,-3.5 4,-2.1 -5,-0.2 -1,-0.2 0.900 110.7 53.2 -67.9 -35.1 34.4 30.9 34.2 401 59 D Q H X S+ 0 0 13 -4,-2.3 4,-2.3 -5,-0.3 -2,-0.2 0.892 107.7 51.9 -63.3 -39.8 36.1 32.1 31.0 402 60 D Q H X S+ 0 0 93 -4,-2.5 4,-1.5 2,-0.2 -1,-0.2 0.862 108.1 50.0 -63.3 -47.3 38.7 33.9 33.1 403 61 D L H X S+ 0 0 53 -4,-1.8 4,-0.7 2,-0.2 -2,-0.2 0.885 110.6 51.4 -60.4 -39.5 39.4 30.9 35.2 404 62 D M H ><>S+ 0 0 0 -4,-2.1 5,-2.8 1,-0.2 3,-1.1 0.947 110.2 48.5 -61.7 -47.1 39.9 28.8 32.1 405 63 D Q H ><5S+ 0 0 92 -4,-2.3 3,-1.7 1,-0.2 -1,-0.2 0.798 97.4 69.6 -64.1 -34.5 42.3 31.4 30.6 406 64 D S H 3<5S+ 0 0 101 -4,-1.5 -1,-0.2 1,-0.3 -2,-0.2 0.729 111.7 32.0 -61.0 -23.0 44.4 31.6 33.8 407 65 D S T <<5S- 0 0 64 -3,-1.1 -1,-0.3 -4,-0.7 -2,-0.2 0.133 114.5-114.8-114.2 14.2 45.7 28.0 33.2 408 66 D Q T < 5 - 0 0 177 -3,-1.7 -3,-0.2 1,-0.2 -2,-0.1 0.881 39.2-149.8 54.9 43.3 45.5 28.4 29.4 409 67 D Y > < - 0 0 24 -5,-2.8 3,-1.7 -6,-0.2 4,-0.2 -0.148 8.3-143.0 -48.7 125.7 42.8 25.8 29.2 410 68 D A T 3 S+ 0 0 109 1,-0.3 3,-0.3 -3,-0.2 -1,-0.1 0.763 97.6 54.9 -66.1 -22.7 43.0 23.9 25.9 411 69 D G T 3> S+ 0 0 27 1,-0.2 4,-1.7 2,-0.1 -1,-0.3 0.245 75.7 107.5 -94.9 13.4 39.2 23.7 25.6 412 70 D Y H <> S+ 0 0 56 -3,-1.7 4,-3.3 1,-0.2 5,-0.3 0.864 72.4 53.1 -57.6 -50.4 38.5 27.4 26.0 413 71 D A H > S+ 0 0 69 -3,-0.3 4,-1.6 1,-0.2 -1,-0.2 0.935 112.4 43.7 -59.8 -47.4 37.5 28.2 22.4 414 72 D E H > S+ 0 0 159 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.892 115.5 49.9 -66.6 -31.7 34.9 25.6 22.2 415 73 D H H X S+ 0 0 4 -4,-1.7 4,-1.8 1,-0.2 -2,-0.2 0.916 108.3 51.3 -74.0 -39.5 33.6 26.4 25.6 416 74 D K H X S+ 0 0 68 -4,-3.3 4,-2.9 1,-0.2 -1,-0.2 0.886 106.8 56.2 -62.6 -38.2 33.4 30.1 24.9 417 75 D K H X S+ 0 0 109 -4,-1.6 4,-2.1 -5,-0.3 -1,-0.2 0.929 106.4 48.5 -59.8 -43.8 31.4 29.3 21.8 418 76 D A H X S+ 0 0 29 -4,-1.6 4,-1.5 2,-0.2 -1,-0.2 0.883 113.3 48.1 -65.0 -41.1 28.8 27.3 23.8 419 77 D H H X S+ 0 0 0 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.947 109.7 52.3 -62.9 -49.7 28.4 30.2 26.3 420 78 D D H X S+ 0 0 64 -4,-2.9 4,-2.1 1,-0.3 -2,-0.2 0.877 107.0 52.7 -59.8 -42.3 28.1 32.9 23.5 421 79 D D H X S+ 0 0 70 -4,-2.1 4,-2.0 1,-0.2 -1,-0.3 0.909 109.0 49.0 -62.8 -38.4 25.3 30.9 21.8 422 80 D F H X S+ 0 0 3 -4,-1.5 4,-2.0 2,-0.2 -1,-0.2 0.880 108.3 53.2 -71.6 -34.3 23.3 30.7 25.1 423 81 D I H X S+ 0 0 26 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.900 107.2 53.7 -60.5 -44.5 23.8 34.5 25.7 424 82 D H H X S+ 0 0 102 -4,-2.1 4,-0.9 1,-0.2 -2,-0.2 0.925 106.4 51.3 -59.1 -41.9 22.4 35.0 22.2 425 83 D K H < S+ 0 0 69 -4,-2.0 3,-0.4 1,-0.2 -1,-0.2 0.844 110.9 48.1 -62.9 -41.4 19.3 32.9 23.1 426 84 D L H >< S+ 0 0 4 -4,-2.0 3,-1.1 1,-0.2 -1,-0.2 0.830 108.3 54.4 -67.5 -31.5 18.7 35.0 26.2 427 85 D D H 3< S+ 0 0 93 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.629 117.9 36.5 -74.7 -16.5 19.2 38.2 24.2 428 86 D T T 3< S- 0 0 78 -4,-0.9 -1,-0.3 -3,-0.4 -2,-0.1 -0.321 91.8-169.7-124.1 42.5 16.4 37.0 21.8 429 87 D W < - 0 0 40 -3,-1.1 -3,-0.1 1,-0.2 -4,-0.0 -0.107 14.6-176.9 -45.2 127.0 14.3 35.3 24.5 430 88 D D - 0 0 44 -5,-0.2 -1,-0.2 2,-0.1 3,-0.1 0.188 49.2-107.7-109.1 1.5 11.5 33.1 22.9 431 89 D G S S+ 0 0 29 1,-0.2 2,-1.7 2,-0.0 3,-0.2 0.413 71.6 142.7 83.9 1.5 9.9 32.1 26.1 432 90 D D > + 0 0 11 1,-0.2 4,-1.4 2,-0.1 3,-0.2 -0.518 14.3 165.2 -82.3 87.7 11.1 28.5 25.9 433 91 D V H > S+ 0 0 25 -2,-1.7 4,-3.2 1,-0.2 -1,-0.2 0.784 73.4 62.3 -65.3 -36.7 11.9 27.7 29.6 434 92 D T H > S+ 0 0 55 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.915 102.9 49.2 -57.4 -46.3 12.1 24.0 28.7 435 93 D Y H > S+ 0 0 72 -3,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.872 112.6 47.9 -56.6 -51.2 15.0 24.6 26.4 436 94 D A H X S+ 0 0 1 -4,-1.4 4,-2.2 2,-0.2 5,-0.3 0.913 109.5 51.5 -61.3 -42.6 16.8 26.7 29.1 437 95 D K H X S+ 0 0 38 -4,-3.2 4,-1.3 1,-0.2 -2,-0.2 0.885 115.8 43.4 -60.5 -44.1 16.2 24.1 31.8 438 96 D N H X S+ 0 0 74 -4,-2.0 4,-2.1 -5,-0.2 5,-0.2 0.853 109.8 55.9 -63.1 -48.5 17.7 21.5 29.5 439 97 D W H X S+ 0 0 37 -4,-2.6 4,-2.7 1,-0.2 -2,-0.2 0.915 108.1 46.8 -56.2 -50.3 20.6 23.6 28.3 440 98 D L H X S+ 0 0 2 -4,-2.2 4,-2.5 2,-0.2 5,-0.3 0.903 110.7 50.6 -64.1 -46.1 22.0 24.3 31.7 441 99 D V H X S+ 0 0 2 -4,-1.3 4,-2.1 -5,-0.3 -1,-0.2 0.942 116.5 41.5 -56.0 -50.3 21.8 20.7 33.0 442 100 D N H X>S+ 0 0 81 -4,-2.1 4,-1.8 2,-0.2 5,-0.6 0.879 111.9 55.7 -66.2 -40.8 23.6 19.5 30.0 443 101 D H H X>S+ 0 0 3 -4,-2.7 5,-2.5 -5,-0.2 4,-1.2 0.933 112.6 40.6 -59.5 -49.5 26.1 22.4 29.9 444 102 D I H <>S+ 0 0 0 -4,-2.5 5,-2.0 3,-0.2 -2,-0.2 0.978 118.8 45.1 -62.2 -52.2 27.4 21.8 33.4 445 103 D K H <5S+ 0 0 34 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.653 128.6 23.2 -74.2 -15.9 27.4 18.0 33.3 446 104 D T H X5S+ 0 0 47 -4,-1.8 4,-0.5 -5,-0.2 -3,-0.2 0.813 133.0 25.9-113.8 -49.3 29.1 17.7 29.9 447 105 D I T <44 S+ 0 0 0 -3,-1.7 3,-2.4 -4,-0.4 4,-0.7 0.499 77.3 125.0 -85.2 -6.5 37.7 21.4 32.7 452 110 D R T <4 S+ 0 0 100 -3,-1.1 -93,-0.1 -4,-0.4 -3,-0.0 -0.356 83.3 9.0 -57.5 124.3 37.7 19.7 36.2 453 111 D G T 34 S+ 0 0 75 1,-0.1 -1,-0.3 -2,-0.0 -2,-0.1 0.330 117.4 79.0 86.9 -3.3 41.3 19.2 37.3 454 112 D K T <4 0 0 124 -3,-2.4 -2,-0.2 1,-0.0 -44,-0.1 0.452 360.0 360.0-113.3 -10.4 42.7 21.2 34.4 455 113 D I < 0 0 39 -4,-0.7 -3,-0.1 -46,-0.1 -47,-0.1 0.319 360.0 360.0-133.7 360.0 42.1 24.8 35.7