==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXYGEN STORAGE/TRANSPORT 04-DEC-03 1RQA . COMPND 2 MOLECULE: HEMOGLOBIN ALPHA CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR N.-L.CHAN,J.S.KAVANAUGH,P.H.ROGERS,A.ARNONE . 574 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25867.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 453 78.9 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 . 15 2.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 86 15.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 337 58.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 1.9 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 4 2 0 0 0 4 0 1 1 0 2 4 0 2 4 6 0 0 0 0 0 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 V 0 0 125 0, 0.0 2,-0.2 0, 0.0 127,-0.1 0.000 360.0 360.0 360.0 162.6 6.3 22.4 -1.6 2 2 A L - 0 0 29 71,-0.1 122,-0.0 125,-0.1 3,-0.0 -0.622 360.0-153.0 -82.3 143.9 5.5 24.8 1.2 3 3 A S > - 0 0 42 -2,-0.2 4,-1.8 1,-0.1 5,-0.2 -0.708 32.8-104.2-102.6 165.4 5.0 23.3 4.6 4 4 A P H > S+ 0 0 103 0, 0.0 4,-2.0 0, 0.0 5,-0.2 0.868 125.8 52.3 -55.8 -38.1 2.9 25.0 7.2 5 5 A A H > S+ 0 0 59 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.922 105.7 53.0 -68.3 -41.1 6.1 26.0 8.9 6 6 A D H > S+ 0 0 18 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.863 109.0 50.4 -59.3 -37.5 7.5 27.5 5.7 7 7 A K H X S+ 0 0 55 -4,-1.8 4,-2.7 2,-0.2 5,-0.2 0.923 109.0 50.3 -67.7 -45.8 4.3 29.6 5.3 8 8 A T H X S+ 0 0 95 -4,-2.0 4,-2.1 2,-0.2 5,-0.2 0.898 112.5 48.4 -56.1 -42.1 4.5 30.9 8.9 9 9 A N H X S+ 0 0 42 -4,-2.3 4,-2.5 2,-0.2 5,-0.2 0.929 111.3 48.1 -69.3 -41.6 8.2 31.8 8.3 10 10 A V H X S+ 0 0 1 -4,-2.3 4,-2.9 1,-0.2 5,-0.3 0.924 112.0 50.3 -62.9 -45.8 7.5 33.6 5.0 11 11 A K H X S+ 0 0 101 -4,-2.7 4,-1.6 2,-0.2 -2,-0.2 0.904 112.9 46.0 -61.6 -40.3 4.5 35.6 6.6 12 12 A A H X S+ 0 0 64 -4,-2.1 4,-1.7 -5,-0.2 5,-0.2 0.973 115.5 44.8 -68.5 -50.1 6.6 36.8 9.6 13 13 A A H >X S+ 0 0 7 -4,-2.5 4,-1.8 1,-0.2 3,-1.0 0.966 114.6 47.7 -59.0 -50.7 9.6 37.8 7.5 14 14 A W H 3X S+ 0 0 29 -4,-2.9 4,-1.3 1,-0.3 -1,-0.2 0.814 108.9 58.0 -61.1 -27.3 7.5 39.6 4.9 15 15 A G H 3< S+ 0 0 55 -4,-1.6 -1,-0.3 -5,-0.3 -2,-0.2 0.810 104.2 48.7 -70.1 -35.1 5.7 41.2 7.8 16 16 A K H << S+ 0 0 112 -4,-1.7 -1,-0.2 -3,-1.0 -2,-0.2 0.813 102.3 64.7 -73.2 -30.3 8.9 42.7 9.2 17 17 A V H >< S+ 0 0 0 -4,-1.8 3,-1.1 -5,-0.2 -2,-0.2 0.922 79.6 150.0 -57.4 -48.4 9.7 44.0 5.7 18 18 A G G >< - 0 0 42 -4,-1.3 3,-1.2 1,-0.2 -1,-0.2 -0.213 66.0 -5.2 62.8-133.5 6.7 46.2 5.9 19 19 A A G > S+ 0 0 105 1,-0.3 3,-0.8 -3,-0.1 4,-0.3 0.776 123.9 72.7 -70.1 -26.5 6.6 49.5 4.0 20 20 A H G <> + 0 0 99 -3,-1.1 4,-2.3 1,-0.2 3,-0.5 0.491 66.4 101.7 -63.7 -8.4 10.2 49.0 3.0 21 21 A A H <> S+ 0 0 8 -3,-1.2 4,-3.2 1,-0.2 3,-0.5 0.925 80.4 49.1 -43.2 -58.0 9.1 46.3 0.5 22 22 A G H <> S+ 0 0 15 -3,-0.8 4,-1.9 1,-0.3 -1,-0.2 0.841 110.9 50.1 -52.5 -41.1 9.4 48.7 -2.5 23 23 A E H > S+ 0 0 84 -3,-0.5 4,-1.9 -4,-0.3 -1,-0.3 0.829 111.6 48.3 -68.0 -34.0 12.9 49.8 -1.4 24 24 A Y H X S+ 0 0 17 -4,-2.3 4,-2.6 -3,-0.5 -2,-0.2 0.935 109.4 53.1 -74.4 -42.8 14.0 46.2 -1.1 25 25 A G H X S+ 0 0 3 -4,-3.2 4,-1.9 -5,-0.3 -2,-0.2 0.916 109.8 48.3 -53.1 -44.6 12.6 45.4 -4.4 26 26 A A H X S+ 0 0 5 -4,-1.9 4,-2.0 1,-0.2 -1,-0.2 0.885 111.1 50.0 -68.9 -38.0 14.5 48.3 -5.9 27 27 A E H X S+ 0 0 29 -4,-1.9 4,-3.1 2,-0.2 5,-0.2 0.927 108.2 53.4 -62.8 -42.9 17.7 47.2 -4.3 28 28 A A H X S+ 0 0 1 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.893 108.8 49.8 -58.2 -43.9 17.3 43.6 -5.5 29 29 A L H X S+ 0 0 4 -4,-1.9 4,-2.6 2,-0.2 -1,-0.2 0.908 110.9 48.8 -63.0 -45.5 16.9 44.8 -9.0 30 30 A E H X S+ 0 0 42 -4,-2.0 4,-2.2 2,-0.2 5,-0.3 0.941 111.2 49.4 -61.9 -48.7 20.0 46.9 -8.8 31 31 A R H X S+ 0 0 4 -4,-3.1 4,-3.1 1,-0.2 5,-0.4 0.944 111.6 51.3 -55.2 -45.6 22.0 44.1 -7.3 32 32 A M H X S+ 0 0 11 -4,-2.6 4,-2.9 -5,-0.2 7,-0.3 0.950 109.3 48.1 -55.7 -54.9 20.8 41.9 -10.2 33 33 A F H < S+ 0 0 11 -4,-2.6 7,-0.2 1,-0.2 -1,-0.2 0.870 119.5 39.2 -56.0 -39.6 21.7 44.3 -12.9 34 34 A L H < S+ 0 0 81 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.891 120.6 41.4 -79.5 -46.7 25.2 44.8 -11.5 35 35 A S H < S+ 0 0 13 -4,-3.1 -2,-0.2 -5,-0.3 -3,-0.2 0.836 129.5 26.9 -70.9 -31.2 26.0 41.3 -10.4 36 36 A F >< - 0 0 36 -4,-2.9 3,-2.5 -5,-0.4 -1,-0.2 -0.663 67.4-178.2-135.5 78.7 24.5 39.6 -13.5 37 37 A P G > S+ 0 0 43 0, 0.0 3,-1.6 0, 0.0 4,-0.3 0.638 73.1 76.1 -57.2 -18.9 24.6 42.0 -16.5 38 38 A T G > S+ 0 0 37 1,-0.3 3,-1.5 2,-0.2 4,-0.1 0.797 83.7 67.9 -64.7 -24.4 22.9 39.6 -18.8 39 39 A T G X S+ 0 0 2 -3,-2.5 3,-1.7 -7,-0.3 -1,-0.3 0.737 82.7 73.5 -64.4 -21.4 19.6 40.5 -17.1 40 40 A K G X S+ 0 0 61 -3,-1.6 3,-2.1 1,-0.3 -1,-0.3 0.756 76.6 79.6 -66.4 -21.1 19.8 44.0 -18.5 41 41 A T G < S+ 0 0 11 -3,-1.5 -1,-0.3 -4,-0.3 -2,-0.1 0.656 87.6 56.0 -60.9 -18.6 18.9 42.6 -21.9 42 42 A Y G < S+ 0 0 33 -3,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.549 109.6 47.5 -87.2 -9.5 15.2 42.4 -20.9 43 43 A F X + 0 0 33 -3,-2.1 3,-1.8 -4,-0.2 -1,-0.2 -0.289 58.7 138.8-126.7 51.9 15.2 46.2 -20.0 44 44 A P T 3 S+ 0 0 70 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.826 78.4 55.4 -69.2 -24.6 16.8 47.9 -23.0 45 45 A H T 3 S+ 0 0 130 -3,-0.2 2,-0.3 2,-0.1 -2,-0.1 0.240 93.5 88.0 -87.4 7.0 14.1 50.6 -22.6 46 46 A F S < S- 0 0 38 -3,-1.8 2,-0.7 -6,-0.2 -3,-0.1 -0.746 79.3-121.8-101.2 158.9 14.9 51.4 -18.9 47 47 A D - 0 0 83 -2,-0.3 8,-0.4 1,-0.1 7,-0.2 -0.890 31.7-178.0 -89.7 117.8 17.3 53.9 -17.4 48 48 A L + 0 0 50 -2,-0.7 3,-0.1 -4,-0.1 -1,-0.1 0.149 29.3 134.3-109.4 21.1 19.4 51.5 -15.4 49 49 A S S > S- 0 0 64 1,-0.2 3,-2.3 2,-0.1 6,-0.2 -0.276 72.5 -82.6 -65.5 154.6 21.7 54.1 -13.8 50 50 A H T 3 S+ 0 0 149 1,-0.3 -1,-0.2 5,-0.0 -2,-0.0 -0.393 119.8 15.9 -57.4 131.0 22.4 53.9 -10.1 51 51 A G T 3 S+ 0 0 57 1,-0.2 -1,-0.3 -3,-0.1 5,-0.1 0.347 88.0 168.5 88.7 -5.5 19.5 55.5 -8.3 52 52 A S <> - 0 0 5 -3,-2.3 4,-2.3 1,-0.1 -1,-0.2 -0.033 36.5-142.1 -45.5 138.2 17.2 55.5 -11.4 53 53 A A H > S+ 0 0 81 2,-0.2 4,-2.9 1,-0.2 -1,-0.1 0.789 101.9 57.0 -72.7 -31.3 13.6 56.4 -10.7 54 54 A Q H > S+ 0 0 84 2,-0.2 4,-1.8 -7,-0.2 -1,-0.2 0.860 109.7 44.9 -67.3 -39.9 12.4 53.8 -13.2 55 55 A V H > S+ 0 0 13 -8,-0.4 4,-2.6 2,-0.2 -2,-0.2 0.935 114.2 48.8 -69.1 -45.8 14.3 51.1 -11.3 56 56 A K H X S+ 0 0 111 -4,-2.3 4,-1.3 1,-0.2 -2,-0.2 0.922 114.0 48.5 -57.2 -44.0 12.9 52.5 -8.0 57 57 A G H X S+ 0 0 40 -4,-2.9 4,-1.2 2,-0.2 -1,-0.2 0.844 111.1 47.8 -62.6 -34.8 9.5 52.5 -9.6 58 58 A H H X S+ 0 0 55 -4,-1.8 4,-2.1 1,-0.2 5,-0.2 0.862 104.3 61.9 -79.9 -32.8 9.8 48.9 -10.9 59 59 A G H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.881 99.7 54.2 -56.0 -41.1 11.0 47.7 -7.6 60 60 A K H X S+ 0 0 117 -4,-1.3 4,-2.6 1,-0.2 -1,-0.2 0.930 107.0 51.5 -65.3 -38.2 7.8 48.7 -6.0 61 61 A K H X S+ 0 0 145 -4,-1.2 4,-1.9 1,-0.2 -1,-0.2 0.922 110.3 47.0 -64.9 -41.2 5.8 46.7 -8.5 62 62 A V H X S+ 0 0 32 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.900 112.6 51.6 -65.2 -39.5 7.8 43.6 -8.0 63 63 A A H X S+ 0 0 2 -4,-2.3 4,-2.1 -5,-0.2 -2,-0.2 0.905 108.2 49.7 -66.8 -42.1 7.5 44.0 -4.3 64 64 A D H X S+ 0 0 81 -4,-2.6 4,-2.3 2,-0.2 -1,-0.2 0.853 107.7 54.9 -64.4 -38.6 3.7 44.4 -4.4 65 65 A A H X S+ 0 0 26 -4,-1.9 4,-2.5 -5,-0.2 -2,-0.2 0.939 109.7 47.0 -60.9 -41.9 3.4 41.3 -6.5 66 66 A L H X S+ 0 0 12 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.901 109.1 54.0 -66.8 -38.5 5.3 39.3 -3.9 67 67 A T H X S+ 0 0 57 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.919 109.3 49.1 -59.5 -44.3 3.2 40.8 -1.2 68 68 A N H X S+ 0 0 69 -4,-2.3 4,-1.7 2,-0.2 -2,-0.2 0.905 108.8 52.5 -62.0 -40.9 0.1 39.6 -3.1 69 69 A A H < S+ 0 0 0 -4,-2.5 6,-0.2 1,-0.2 -2,-0.2 0.898 108.5 50.7 -61.4 -38.5 1.7 36.1 -3.4 70 70 A V H >< S+ 0 0 12 -4,-2.3 3,-1.2 1,-0.2 -1,-0.2 0.927 108.7 51.8 -66.9 -40.4 2.2 36.0 0.3 71 71 A A H 3< S+ 0 0 61 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.799 118.6 37.7 -64.0 -28.9 -1.5 37.0 0.8 72 72 A H T >< S+ 0 0 92 -4,-1.7 3,-2.4 1,-0.1 -1,-0.3 -0.215 74.5 145.7-116.5 46.2 -2.6 34.2 -1.5 73 73 A V T < S+ 0 0 11 -3,-1.2 3,-0.4 1,-0.3 -1,-0.1 0.698 71.8 50.6 -56.0 -27.2 0.0 31.6 -0.4 74 74 A D T 3 S+ 0 0 130 1,-0.2 -1,-0.3 -3,-0.2 -2,-0.1 0.494 120.1 35.3 -91.0 -3.9 -2.4 28.7 -0.8 75 75 A D X> + 0 0 73 -3,-2.4 4,-2.2 -6,-0.2 3,-1.0 -0.125 68.1 141.4-144.7 46.0 -3.3 29.7 -4.3 76 76 A M H 3> + 0 0 16 -3,-0.4 4,-2.8 1,-0.2 5,-0.1 0.853 67.8 61.8 -58.1 -42.6 -0.3 31.2 -6.0 77 77 A P H 34 S+ 0 0 79 0, 0.0 -1,-0.2 0, 0.0 7,-0.1 0.778 115.0 34.1 -57.1 -29.5 -0.8 29.8 -9.4 78 78 A N H X4 S+ 0 0 109 -3,-1.0 3,-1.0 -6,-0.2 4,-0.2 0.752 115.6 53.9 -96.7 -30.6 -4.1 31.6 -9.8 79 79 A A H 3< S+ 0 0 27 -4,-2.2 3,-0.3 1,-0.2 4,-0.2 0.875 115.1 41.6 -72.1 -36.2 -3.2 34.7 -7.9 80 80 A L T 3X S+ 0 0 6 -4,-2.8 4,-2.4 -5,-0.2 -1,-0.2 0.154 83.6 118.4 -94.1 25.5 -0.1 35.3 -10.1 81 81 A S H <> S+ 0 0 40 -3,-1.0 4,-1.7 1,-0.2 -1,-0.2 0.901 73.8 43.6 -59.8 -47.3 -2.1 34.3 -13.2 82 82 A A H > S+ 0 0 80 -3,-0.3 4,-2.1 -4,-0.2 -1,-0.2 0.880 113.7 51.7 -68.6 -36.3 -1.7 37.6 -15.1 83 83 A L H > S+ 0 0 56 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.831 106.2 55.5 -69.0 -33.2 1.9 37.9 -14.2 84 84 A S H X>S+ 0 0 1 -4,-2.4 4,-2.2 2,-0.2 5,-0.5 0.912 107.2 48.8 -62.2 -44.9 2.6 34.4 -15.5 85 85 A D H X>S+ 0 0 72 -4,-1.7 4,-1.9 -5,-0.2 5,-1.1 0.941 114.0 48.1 -60.5 -44.4 1.1 35.3 -18.9 86 86 A L H X>S+ 0 0 56 -4,-2.1 5,-2.9 3,-0.2 4,-1.1 0.964 118.5 36.2 -57.8 -55.4 3.2 38.4 -19.0 87 87 A H H <5S+ 0 0 48 -4,-2.7 6,-2.0 3,-0.2 5,-0.5 0.909 127.0 34.8 -70.0 -44.2 6.6 36.8 -18.0 88 88 A A H <5S+ 0 0 11 -4,-2.2 -3,-0.2 -5,-0.3 -1,-0.2 0.815 131.1 24.2 -84.8 -32.3 6.2 33.5 -19.8 89 89 A H H < - 0 0 22 -2,-0.5 3,-1.6 1,-0.1 4,-0.4 -0.370 24.3-123.3 -57.7 133.1 14.5 32.6 -19.7 95 95 A P T >> S+ 0 0 64 0, 0.0 3,-1.3 0, 0.0 4,-0.9 0.715 103.5 70.1 -51.4 -31.2 14.0 30.7 -16.3 96 96 A V H >> S+ 0 0 35 1,-0.3 4,-1.3 2,-0.2 3,-0.6 0.868 90.2 65.5 -59.0 -31.3 17.6 31.0 -15.2 97 97 A N H <> S+ 0 0 9 -3,-1.6 4,-2.2 1,-0.2 -1,-0.3 0.817 93.7 58.1 -63.0 -27.2 17.0 34.7 -14.7 98 98 A F H <> S+ 0 0 24 -3,-1.3 4,-3.1 -4,-0.4 -1,-0.2 0.853 101.4 54.8 -68.6 -35.7 14.5 34.1 -11.9 99 99 A K H - 0 0 59 -2,-2.5 4,-2.6 1,-0.1 5,-0.2 -0.372 60.1-100.3 -82.2 167.7 17.9 32.8 10.5 119 119 A P H > S+ 0 0 22 0, 0.0 4,-2.6 0, 0.0 5,-0.1 0.932 123.7 49.4 -51.6 -46.7 18.9 29.6 8.7 120 120 A A H > S+ 0 0 36 2,-0.2 4,-2.3 1,-0.2 5,-0.1 0.881 113.0 45.6 -62.3 -44.3 15.2 28.3 8.9 121 121 A V H > S+ 0 0 19 2,-0.2 4,-2.6 -5,-0.2 5,-0.2 0.898 111.7 53.1 -66.5 -40.3 13.7 31.5 7.6 122 122 A H H X S+ 0 0 1 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.924 108.8 50.4 -60.1 -41.8 16.4 31.6 4.9 123 123 A A H X S+ 0 0 17 -4,-2.6 4,-2.1 -5,-0.2 -2,-0.2 0.945 113.2 45.0 -62.9 -45.9 15.4 28.0 3.9 124 124 A S H X S+ 0 0 2 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.908 111.6 51.1 -62.2 -45.0 11.6 29.0 3.8 125 125 A L H X S+ 0 0 3 -4,-2.6 4,-2.7 1,-0.2 5,-0.2 0.868 109.5 52.4 -61.4 -36.2 12.2 32.2 1.8 126 126 A D H X S+ 0 0 17 -4,-2.0 4,-2.1 -5,-0.2 -1,-0.2 0.946 110.5 46.2 -69.7 -43.7 14.3 30.3 -0.7 127 127 A K H X S+ 0 0 26 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.889 112.8 50.8 -65.8 -38.0 11.5 27.7 -1.2 128 128 A F H X S+ 0 0 1 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.931 110.1 48.3 -62.9 -49.8 8.9 30.5 -1.5 129 129 A L H X S+ 0 0 9 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.899 111.3 52.5 -59.7 -35.6 10.9 32.4 -4.2 130 130 A A H X S+ 0 0 25 -4,-2.1 4,-2.2 -5,-0.2 -2,-0.2 0.924 109.4 48.6 -66.5 -41.0 11.4 29.1 -6.0 131 131 A S H X S+ 0 0 33 -4,-2.3 4,-1.8 1,-0.2 -2,-0.2 0.897 112.0 48.5 -64.9 -40.6 7.6 28.5 -5.9 132 132 A V H X S+ 0 0 10 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.914 111.1 49.7 -65.1 -43.2 6.9 32.0 -7.2 133 133 A S H X S+ 0 0 18 -4,-2.5 4,-1.0 1,-0.2 -2,-0.2 0.855 108.3 54.9 -61.6 -40.6 9.5 31.6 -10.0 134 134 A T H < S+ 0 0 90 -4,-2.2 4,-0.5 -5,-0.2 3,-0.3 0.899 108.9 47.1 -58.8 -44.0 8.0 28.3 -11.0 135 135 A V H >< S+ 0 0 16 -4,-1.8 3,-1.0 1,-0.2 4,-0.3 0.919 112.2 49.5 -65.3 -42.8 4.5 29.8 -11.4 136 136 A L H 3< S+ 0 0 15 -4,-2.0 -48,-0.2 1,-0.3 -1,-0.2 0.646 117.8 40.2 -73.3 -14.4 5.8 32.8 -13.4 137 137 A T T >< S+ 0 0 32 -4,-1.0 3,-0.8 -3,-0.3 -1,-0.3 0.410 90.2 102.6-108.5 -0.9 7.7 30.5 -15.7 138 138 A S T < S+ 0 0 70 -3,-1.0 3,-0.2 -4,-0.5 -2,-0.1 0.713 75.2 48.9 -67.2 -33.2 5.0 27.8 -15.9 139 139 A K T 3 S+ 0 0 71 -4,-0.3 -1,-0.3 1,-0.2 -4,-0.0 -0.211 70.3 142.1 -99.7 45.9 3.3 28.4 -19.3 140 140 A Y < 0 0 32 -3,-0.8 328,-0.2 -2,-0.1 -1,-0.2 0.444 360.0 360.0 -70.8 -3.7 6.7 28.5 -21.0 141 141 A R 0 0 127 -3,-0.2 -1,-0.1 326,-0.1 325,-0.0 -0.994 360.0 360.0-173.4 360.0 5.5 26.6 -24.2 142 !* 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 0.0 143 1 B M 0 0 100 0, 0.0 2,-1.9 0, 0.0 132,-0.0 0.000 360.0 360.0 360.0 110.0 38.9 36.1 -14.5 144 2 B H + 0 0 137 130,-0.1 2,-0.6 2,-0.0 130,-0.1 -0.464 360.0 147.7 -77.8 72.7 37.7 39.6 -15.3 145 3 B L - 0 0 26 -2,-1.9 126,-0.0 75,-0.1 75,-0.0 -0.928 36.6-147.2-106.7 117.9 38.4 41.5 -12.0 146 4 B T > - 0 0 55 -2,-0.6 4,-2.2 1,-0.1 5,-0.2 -0.315 32.8-104.2 -71.8 164.5 39.3 45.1 -12.4 147 5 B P H > S+ 0 0 108 0, 0.0 4,-2.1 0, 0.0 5,-0.1 0.798 122.2 55.9 -61.8 -28.8 41.7 46.5 -9.8 148 6 B E H > S+ 0 0 142 2,-0.2 4,-1.8 1,-0.2 5,-0.1 0.892 108.4 46.2 -69.2 -41.0 38.8 48.2 -8.0 149 7 B E H > S+ 0 0 36 2,-0.2 4,-3.7 1,-0.2 5,-0.2 0.942 112.0 51.7 -64.4 -48.2 36.9 45.0 -7.7 150 8 B K H X S+ 0 0 63 -4,-2.2 4,-2.9 1,-0.2 5,-0.2 0.922 111.4 46.7 -52.4 -49.5 40.0 43.2 -6.4 151 9 B S H X S+ 0 0 62 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.843 112.7 50.3 -66.7 -31.4 40.6 45.9 -3.8 152 10 B A H X S+ 0 0 27 -4,-1.8 4,-2.1 2,-0.2 5,-0.3 0.954 113.0 46.3 -71.1 -47.5 36.9 45.8 -2.8 153 11 B V H X S+ 0 0 0 -4,-3.7 4,-2.1 1,-0.2 -2,-0.2 0.981 116.2 43.8 -53.8 -60.6 37.1 42.0 -2.5 154 12 B T H X S+ 0 0 77 -4,-2.9 4,-1.2 1,-0.2 -1,-0.2 0.865 111.7 54.2 -54.4 -41.5 40.4 42.0 -0.5 155 13 B A H >X S+ 0 0 61 -4,-2.2 3,-0.7 -5,-0.2 4,-0.6 0.953 111.5 43.1 -61.6 -52.3 39.3 44.9 1.8 156 14 B L H >< S+ 0 0 9 -4,-2.1 3,-1.4 1,-0.2 4,-0.2 0.900 108.9 59.9 -59.8 -37.2 36.1 43.3 2.9 157 15 B W H >< S+ 0 0 28 -4,-2.1 3,-1.1 -5,-0.3 -1,-0.2 0.755 93.6 63.5 -69.8 -23.4 37.8 40.0 3.4 158 16 B G H << S+ 0 0 70 -4,-1.2 -1,-0.3 -3,-0.7 -2,-0.2 0.738 100.6 55.2 -68.2 -20.6 40.3 41.3 5.9 159 17 B K T << S+ 0 0 136 -3,-1.4 2,-0.3 -4,-0.6 -1,-0.2 0.523 87.9 105.2 -90.6 -2.8 37.3 42.0 8.1 160 18 B V < - 0 0 16 -3,-1.1 2,-1.0 -4,-0.2 3,-0.1 -0.596 63.8-143.7 -88.5 136.5 36.0 38.5 8.1 161 19 B N > - 0 0 87 -2,-0.3 4,-2.6 1,-0.2 3,-0.4 -0.807 18.7-166.9 -92.4 96.5 36.3 35.9 10.9 162 20 B V H > S+ 0 0 44 -2,-1.0 4,-2.3 1,-0.2 5,-0.3 0.841 80.9 58.7 -60.1 -39.1 36.9 32.8 8.8 163 21 B D H > S+ 0 0 80 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.957 116.0 35.6 -52.1 -50.5 36.3 30.4 11.6 164 22 B E H > S+ 0 0 113 -3,-0.4 4,-2.1 1,-0.2 5,-0.2 0.964 117.3 49.1 -70.4 -51.9 32.8 31.8 12.1 165 23 B V H X S+ 0 0 2 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.848 108.8 55.3 -61.5 -32.0 31.8 32.6 8.6 166 24 B G H X S+ 0 0 2 -4,-2.3 4,-2.6 -5,-0.3 5,-0.3 0.935 108.4 46.2 -68.0 -48.5 32.9 29.1 7.4 167 25 B G H X S+ 0 0 6 -4,-1.5 4,-2.3 -5,-0.3 -1,-0.2 0.894 114.3 48.8 -60.7 -40.0 30.7 27.3 9.8 168 26 B E H X S+ 0 0 36 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.903 112.3 49.0 -67.6 -39.7 27.7 29.5 9.0 169 27 B A H X S+ 0 0 5 -4,-2.5 4,-1.9 -5,-0.2 -2,-0.2 0.953 115.3 40.3 -68.7 -50.0 28.2 29.1 5.3 170 28 B L H X S+ 0 0 6 -4,-2.6 4,-1.9 1,-0.2 -2,-0.2 0.918 114.8 55.1 -67.3 -38.7 28.5 25.3 5.3 171 29 B G H X S+ 0 0 0 -4,-2.3 4,-1.5 -5,-0.3 -2,-0.2 0.932 108.3 47.0 -54.0 -49.8 25.7 25.1 7.9 172 30 B R H X S+ 0 0 2 -4,-2.5 4,-3.6 1,-0.2 5,-0.5 0.844 106.8 58.1 -67.2 -32.5 23.3 27.1 5.8 173 31 B L H X S+ 0 0 11 -4,-1.9 4,-2.5 1,-0.2 7,-0.3 0.961 108.8 45.3 -58.0 -48.6 24.1 25.1 2.7 174 32 B L H < S+ 0 0 0 -4,-1.9 7,-0.2 1,-0.2 -1,-0.2 0.782 119.6 41.5 -68.9 -26.9 23.0 21.9 4.5 175 33 B V H < S+ 0 0 17 -4,-1.5 -2,-0.2 -5,-0.2 -1,-0.2 0.874 121.2 38.6 -86.4 -44.0 19.9 23.5 5.8 176 34 B V H < S+ 0 0 5 -4,-3.6 -3,-0.2 1,-0.3 -2,-0.2 0.877 130.3 29.5 -77.2 -36.4 18.8 25.5 2.8 177 35 B Y S >< S+ 0 0 25 -4,-2.5 3,-2.3 -5,-0.5 4,-0.3 -0.650 72.2 176.0-119.9 75.0 19.7 22.8 0.2 178 36 B P G > + 0 0 53 0, 0.0 3,-1.2 0, 0.0 4,-0.2 0.631 68.1 78.2 -62.3 -11.0 19.3 19.6 2.2 179 37 B E G > S+ 0 0 49 1,-0.2 3,-1.2 2,-0.2 4,-0.1 0.816 84.6 64.8 -66.9 -26.1 20.0 17.5 -0.8 180 38 B T G X S+ 0 0 2 -3,-2.3 3,-2.2 -7,-0.3 4,-0.3 0.768 79.4 82.8 -66.3 -20.9 23.7 18.3 -0.1 181 39 B Q G X S+ 0 0 50 -3,-1.2 3,-1.5 -4,-0.3 -1,-0.2 0.699 72.3 76.9 -57.2 -19.0 23.5 16.4 3.2 182 40 B R G < S+ 0 0 64 -3,-1.2 3,-0.4 1,-0.3 -1,-0.3 0.683 89.8 57.1 -67.6 -16.5 24.1 13.1 1.4 183 41 B F G < S+ 0 0 57 -3,-2.2 -1,-0.3 1,-0.2 3,-0.2 0.608 107.8 45.9 -88.2 -12.3 27.8 14.0 1.1 184 42 B F X + 0 0 36 -3,-1.5 3,-1.9 -4,-0.3 4,-0.2 -0.198 58.7 137.2-125.5 43.5 28.3 14.4 4.8 185 43 B E G > + 0 0 158 -3,-0.4 3,-0.9 1,-0.3 -1,-0.1 0.761 69.2 67.0 -66.9 -12.2 26.7 11.4 6.6 186 44 B S G 3 S+ 0 0 92 1,-0.2 -1,-0.3 -3,-0.2 3,-0.1 0.578 81.3 78.3 -80.0 -6.8 29.7 11.1 8.9 187 45 B F G < S- 0 0 23 -3,-1.9 2,-0.4 1,-0.2 14,-0.3 0.641 94.7-138.7 -75.5 -13.7 28.9 14.5 10.5 188 46 B G < + 0 0 50 -3,-0.9 2,-0.4 -4,-0.2 -1,-0.2 -0.744 63.0 25.0 100.1-137.6 26.2 12.8 12.6 189 47 B D + 0 0 102 -2,-0.4 10,-0.1 1,-0.1 3,-0.0 -0.528 53.0 154.5 -70.7 121.3 22.8 14.3 13.3 190 48 B L + 0 0 16 -2,-0.4 6,-0.1 1,-0.0 -1,-0.1 0.063 34.8 115.6-129.1 27.5 21.7 16.8 10.7 191 49 B S S S+ 0 0 91 4,-0.1 3,-0.0 5,-0.0 -1,-0.0 0.713 74.2 30.8 -79.6 -23.5 17.9 16.6 11.1 192 50 B T S > S- 0 0 67 1,-0.1 4,-1.8 -3,-0.0 5,-0.2 -0.894 86.2-106.0-129.2 160.9 17.0 20.1 12.3 193 51 B P H > S+ 0 0 51 0, 0.0 4,-3.0 0, 0.0 3,-0.4 0.932 120.5 46.9 -50.1 -49.0 18.5 23.5 11.7 194 52 B D H > S+ 0 0 136 1,-0.3 4,-2.0 2,-0.2 5,-0.2 0.886 107.3 56.6 -65.5 -36.5 20.0 23.6 15.2 195 53 B A H 4 S+ 0 0 22 1,-0.2 4,-0.3 2,-0.2 -1,-0.3 0.876 115.6 39.9 -59.8 -32.6 21.4 20.1 14.9 196 54 B V H >< S+ 0 0 1 -4,-1.8 3,-1.0 -3,-0.4 -2,-0.2 0.959 114.9 46.8 -81.2 -52.2 23.2 21.4 11.8 197 55 B M H 3< S+ 0 0 33 -4,-3.0 -3,-0.2 1,-0.3 -2,-0.2 0.786 119.0 40.8 -66.7 -34.0 24.3 24.9 12.8 198 56 B G T 3< S+ 0 0 46 -4,-2.0 -1,-0.3 -5,-0.3 -2,-0.2 0.469 82.0 122.0 -92.5 -2.6 25.7 23.8 16.1 199 57 B N <> - 0 0 19 -3,-1.0 4,-2.3 -4,-0.3 5,-0.2 -0.466 57.3-145.2 -62.0 120.4 27.3 20.6 14.9 200 58 B P H > S+ 0 0 99 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.777 99.3 52.7 -59.2 -32.0 31.1 20.7 15.7 201 59 B K H > S+ 0 0 115 -14,-0.3 4,-2.1 2,-0.2 5,-0.2 0.857 108.3 51.3 -74.8 -32.0 32.0 18.7 12.6 202 60 B V H > S+ 0 0 0 -15,-0.2 4,-2.4 2,-0.2 5,-0.2 0.966 112.5 45.4 -65.0 -47.2 30.0 21.2 10.5 203 61 B K H X S+ 0 0 120 -4,-2.3 4,-1.3 1,-0.2 -2,-0.2 0.873 114.0 48.4 -65.6 -40.8 31.8 24.1 12.1 204 62 B A H X S+ 0 0 59 -4,-2.1 4,-1.5 2,-0.2 -1,-0.2 0.872 113.4 47.2 -64.0 -38.7 35.3 22.5 11.7 205 63 B H H X S+ 0 0 48 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.926 107.5 56.5 -73.6 -35.9 34.7 21.5 8.1 206 64 B G H X S+ 0 0 1 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.864 104.9 52.6 -59.6 -37.9 33.4 25.0 7.3 207 65 B K H X S+ 0 0 107 -4,-1.3 4,-1.9 2,-0.2 -1,-0.2 0.877 107.9 51.7 -66.5 -36.1 36.6 26.5 8.6 208 66 B K H X S+ 0 0 142 -4,-1.5 4,-1.9 1,-0.2 -2,-0.2 0.942 110.8 48.0 -63.7 -46.8 38.6 24.1 6.3 209 67 B V H X S+ 0 0 55 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.912 111.3 48.7 -61.9 -44.5 36.5 25.2 3.3 210 68 B L H X S+ 0 0 6 -4,-2.2 4,-2.7 2,-0.2 -1,-0.2 0.851 106.8 57.6 -70.5 -30.0 36.9 28.9 4.0 211 69 B G H X S+ 0 0 26 -4,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.930 108.1 46.2 -61.5 -44.8 40.7 28.5 4.4 212 70 B A H X S+ 0 0 23 -4,-1.9 4,-1.7 2,-0.2 -2,-0.2 0.903 110.7 54.0 -64.8 -37.0 40.9 27.1 0.9 213 71 B F H X S+ 0 0 19 -4,-2.1 4,-1.9 1,-0.2 3,-0.3 0.948 106.0 52.5 -60.6 -44.1 38.7 29.9 -0.2 214 72 B S H X S+ 0 0 30 -4,-2.7 4,-1.6 1,-0.3 -2,-0.2 0.904 104.2 55.6 -60.3 -36.0 41.2 32.3 1.4 215 73 B D H < S+ 0 0 94 -4,-2.0 4,-0.3 1,-0.2 -1,-0.3 0.874 106.6 52.9 -63.5 -33.7 44.1 30.7 -0.5 216 74 B G H >< S+ 0 0 1 -4,-1.7 3,-1.6 -3,-0.3 -1,-0.2 0.912 103.4 54.2 -66.9 -45.5 42.1 31.5 -3.6 217 75 B L H >< S+ 0 0 14 -4,-1.9 3,-0.7 1,-0.3 -1,-0.2 0.821 106.8 53.6 -59.5 -30.2 41.7 35.2 -2.8 218 76 B A T 3< S+ 0 0 77 -4,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.544 115.8 39.5 -82.1 -3.8 45.4 35.4 -2.5 219 77 B H T X + 0 0 104 -3,-1.6 3,-2.3 -4,-0.3 -1,-0.2 -0.203 67.3 149.5-137.8 50.6 45.9 33.9 -6.0 220 78 B L G X S+ 0 0 7 -3,-0.7 3,-0.5 1,-0.3 -1,-0.1 0.701 72.0 57.5 -59.8 -22.3 43.1 35.5 -8.0 221 79 B D G 3 S+ 0 0 135 1,-0.2 -1,-0.3 -3,-0.1 3,-0.0 0.402 115.0 34.7 -95.7 9.0 45.2 35.3 -11.2 222 80 B N G <> + 0 0 96 -3,-2.3 4,-2.2 -6,-0.2 -1,-0.2 -0.209 64.8 143.0-152.6 54.1 45.7 31.5 -11.0 223 81 B L H <> S+ 0 0 10 -3,-0.5 4,-1.8 1,-0.2 5,-0.1 0.858 73.0 58.6 -59.3 -39.7 42.5 30.0 -9.5 224 82 B K H 4 S+ 0 0 121 1,-0.2 4,-0.3 2,-0.2 -1,-0.2 0.902 110.3 40.3 -63.3 -39.4 42.8 27.0 -11.7 225 83 B G H >4 S+ 0 0 40 1,-0.2 3,-0.9 2,-0.2 4,-0.4 0.900 112.5 55.6 -75.3 -40.9 46.2 25.9 -10.5 226 84 B T H 3< S+ 0 0 43 -4,-2.2 3,-0.2 1,-0.2 4,-0.2 0.860 117.4 35.3 -55.9 -42.2 45.5 26.7 -6.9 227 85 B F T 3X S+ 0 0 7 -4,-1.8 4,-2.4 -5,-0.2 3,-0.2 0.375 85.9 106.2 -98.8 8.2 42.4 24.5 -6.9 228 86 B A H <> S+ 0 0 19 -3,-0.9 4,-2.1 -4,-0.3 5,-0.2 0.914 83.6 42.3 -57.1 -47.4 43.7 21.7 -9.2 229 87 B T H > S+ 0 0 110 -4,-0.4 4,-1.4 1,-0.2 -1,-0.2 0.811 115.3 51.2 -70.9 -30.4 44.3 19.1 -6.5 230 88 B L H > S+ 0 0 55 -3,-0.2 4,-2.5 -4,-0.2 -1,-0.2 0.823 107.5 53.9 -72.5 -35.4 41.0 19.9 -4.8 231 89 B S H X S+ 0 0 0 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.959 109.3 47.0 -61.1 -54.3 39.1 19.7 -8.1 232 90 B E H X>S+ 0 0 87 -4,-2.1 4,-3.1 1,-0.2 5,-0.5 0.858 113.0 50.2 -55.3 -41.4 40.4 16.2 -8.7 233 91 B L H X>S+ 0 0 73 -4,-1.4 5,-2.0 2,-0.2 4,-1.4 0.927 109.7 48.4 -65.7 -45.0 39.6 15.1 -5.2 234 92 B H H <5S+ 0 0 46 -4,-2.5 6,-2.2 3,-0.2 -2,-0.2 0.856 121.3 40.1 -64.4 -32.7 36.0 16.5 -5.3 235 93 B C H X5S+ 0 0 12 -4,-2.3 4,-0.9 4,-0.2 -2,-0.2 0.977 125.2 28.5 -76.1 -65.7 35.7 14.6 -8.6 236 94 B D H <5S+ 0 0 59 -4,-3.1 -3,-0.2 1,-0.2 -2,-0.1 0.849 132.3 27.6 -71.4 -36.5 37.5 11.2 -8.1 237 95 B K T < - 0 0 4 -2,-0.6 3,-2.0 1,-0.2 4,-0.3 -0.449 21.2-132.8 -60.1 124.4 28.3 17.2 -8.9 242 100 B P T >> S+ 0 0 14 0, 0.0 3,-1.6 0, 0.0 4,-0.7 0.663 98.5 80.2 -59.7 -15.2 29.9 20.6 -9.6 243 101 B E H >> S+ 0 0 49 1,-0.3 3,-1.4 2,-0.2 4,-1.0 0.892 85.4 64.0 -55.0 -36.9 26.4 22.3 -9.7 244 102 B N H <> S+ 0 0 20 -3,-2.0 4,-1.9 1,-0.3 -1,-0.3 0.727 89.3 64.9 -59.9 -25.7 26.8 22.1 -5.9 245 103 B F H <> S+ 0 0 20 -3,-1.6 4,-1.8 -4,-0.3 -1,-0.3 0.821 100.2 52.3 -66.6 -31.2 29.8 24.5 -5.9 246 104 B R H < S- 0 0 27 -4,-2.4 3,-2.1 1,-0.2 -2,-0.2 0.593 82.9-176.8 -99.2 -11.3 28.3 43.1 6.9 261 119 B G G >< S+ 0 0 12 -4,-1.8 3,-2.0 -5,-0.3 -1,-0.2 -0.188 70.0 5.6 54.6-132.7 24.9 44.6 6.2 262 120 B K G 3 S+ 0 0 160 1,-0.3 -1,-0.3 -151,-0.3 -150,-0.1 0.729 121.5 71.7 -58.4 -18.8 24.8 47.9 4.4 263 121 B E G < S+ 0 0 85 -3,-2.1 2,-2.0 1,-0.2 -1,-0.3 0.853 82.1 78.1 -67.2 -26.9 28.6 47.6 3.9 264 122 B F S < S+ 0 0 0 -3,-2.0 -1,-0.2 -7,-0.2 -153,-0.1 -0.475 76.9 179.6 -81.3 73.2 27.8 44.8 1.4 265 123 B T > - 0 0 58 -2,-2.0 4,-2.4 1,-0.1 5,-0.2 -0.093 44.5 -97.7 -74.6 165.8 26.8 47.1 -1.4 266 124 B P H > S+ 0 0 15 0, 0.0 4,-2.3 0, 0.0 5,-0.1 0.901 124.2 47.7 -47.4 -47.2 25.7 46.3 -4.9 267 125 B P H > S+ 0 0 74 0, 0.0 4,-2.0 0, 0.0 5,-0.1 0.890 111.2 49.4 -65.2 -40.0 29.2 46.9 -6.3 268 126 B V H > S+ 0 0 23 2,-0.2 4,-2.3 1,-0.2 5,-0.1 0.861 110.8 52.2 -64.8 -35.5 30.9 44.8 -3.6 269 127 B Q H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 5,-0.2 0.948 106.4 52.5 -66.4 -50.9 28.4 42.0 -4.3 270 128 B A H X S+ 0 0 12 -4,-2.3 4,-1.6 1,-0.2 -2,-0.2 0.895 109.5 49.6 -51.2 -43.3 29.1 42.1 -8.0 271 129 B A H X S+ 0 0 1 -4,-2.0 4,-1.8 1,-0.2 3,-0.2 0.956 111.5 49.4 -62.6 -44.8 32.9 41.7 -7.2 272 130 B Y H X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 5,-0.2 0.864 106.9 54.8 -64.3 -35.7 32.1 38.8 -4.9 273 131 B Q H X S+ 0 0 12 -4,-2.7 4,-2.2 2,-0.2 -1,-0.2 0.868 106.6 50.5 -63.7 -41.9 29.9 37.0 -7.5 274 132 B K H X S+ 0 0 79 -4,-1.6 4,-2.3 -3,-0.2 -1,-0.2 0.901 112.1 50.2 -63.7 -38.0 32.7 37.0 -10.1 275 133 B V H X S+ 0 0 1 -4,-1.8 4,-2.4 -5,-0.2 -2,-0.2 0.932 111.7 43.9 -66.3 -45.2 34.9 35.6 -7.4 276 134 B V H X S+ 0 0 11 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.849 113.7 52.4 -73.5 -28.2 32.6 32.7 -6.4 277 135 B A H X S+ 0 0 38 -4,-2.2 4,-2.2 -5,-0.2 -1,-0.2 0.915 110.6 48.0 -67.8 -44.1 31.9 31.9 -10.0 278 136 B G H X S+ 0 0 10 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.889 111.6 49.8 -60.2 -41.4 35.6 31.8 -10.7 279 137 B V H X S+ 0 0 12 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.946 111.4 49.1 -66.0 -40.2 36.2 29.5 -7.7 280 138 B A H X S+ 0 0 5 -4,-2.4 4,-1.3 2,-0.2 -2,-0.2 0.889 111.4 48.9 -65.3 -38.6 33.4 27.2 -8.8 281 139 B N H X S+ 0 0 78 -4,-2.2 4,-1.2 1,-0.2 3,-0.3 0.936 112.0 49.7 -68.7 -38.7 34.8 27.0 -12.3 282 140 B A H < S+ 0 0 1 -4,-2.5 3,-0.5 1,-0.2 4,-0.4 0.909 109.1 50.8 -64.2 -40.4 38.2 26.3 -10.9 283 141 B L H < S+ 0 0 24 -4,-2.5 -1,-0.2 1,-0.2 3,-0.2 0.783 113.5 47.7 -69.2 -23.7 36.9 23.5 -8.7 284 142 B A H >< S+ 0 0 27 -4,-1.3 3,-1.7 -3,-0.3 -1,-0.2 0.618 87.1 89.0 -88.5 -13.8 35.1 22.0 -11.7 285 143 B H T 3< S+ 0 0 61 -4,-1.2 -1,-0.1 -3,-0.5 -2,-0.1 0.774 83.8 50.8 -63.4 -30.6 38.0 22.1 -14.2 286 144 B K T 3 S+ 0 0 94 -4,-0.4 -1,-0.3 -3,-0.2 2,-0.2 0.308 78.4 122.9 -91.8 12.4 39.6 18.7 -13.5 287 145 B Y < 0 0 24 -3,-1.7 40,-0.1 -52,-0.1 -55,-0.1 -0.543 360.0 360.0 -72.4 139.3 36.4 16.7 -13.8 288 146 B H 0 0 128 -2,-0.2 -2,-0.0 38,-0.2 41,-0.0 -0.922 360.0 360.0-154.3 360.0 36.7 14.0 -16.4 289 !* 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 0.0 290 1 C V 0 0 133 0, 0.0 2,-0.4 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 131.5 2.2 21.7 -21.7 291 2 C L - 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0 0 37 -4,-2.4 3,-2.1 -5,-0.3 -1,-0.3 -0.707 67.8-177.6-134.3 78.7 29.0 15.7 -20.1 326 37 C P G > S+ 0 0 43 0, 0.0 3,-1.8 0, 0.0 4,-0.2 0.714 73.3 73.9 -54.7 -27.3 31.5 14.1 -17.8 327 38 C T G > S+ 0 0 39 1,-0.3 3,-1.5 2,-0.2 4,-0.2 0.765 84.0 68.1 -63.7 -20.7 30.0 15.6 -14.6 328 39 C T G X S+ 0 0 3 -3,-2.1 3,-1.3 1,-0.3 -1,-0.3 0.698 83.4 73.5 -72.1 -16.3 27.0 13.2 -14.9 329 40 C K G X S+ 0 0 59 -3,-1.8 3,-2.0 -4,-0.3 -1,-0.3 0.694 76.8 78.9 -65.9 -20.7 29.4 10.3 -14.1 330 41 C T G < S+ 0 0 12 -3,-1.5 -1,-0.2 1,-0.3 -2,-0.2 0.701 89.8 54.6 -64.4 -18.7 29.4 11.5 -10.5 331 42 C Y G < S+ 0 0 33 -3,-1.3 -1,-0.3 1,-0.2 -2,-0.2 0.551 108.9 48.4 -88.2 -6.2 26.1 9.8 -10.0 332 43 C F X + 0 0 34 -3,-2.0 3,-1.7 -4,-0.2 -1,-0.2 -0.296 60.3 136.1-127.8 49.2 27.4 6.5 -11.2 333 44 C P T 3 S+ 0 0 66 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.785 75.3 56.4 -69.7 -23.8 30.6 5.8 -9.4 334 45 C H T 3 S+ 0 0 138 -3,-0.2 2,-0.4 2,-0.1 -2,-0.1 0.294 94.2 95.0 -89.7 9.8 29.6 2.2 -8.7 335 46 C F S < S- 0 0 37 -3,-1.7 2,-0.7 -6,-0.2 -3,-0.1 -0.786 78.4-128.1-100.3 145.8 29.2 1.7 -12.5 336 47 C D - 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0 0 17 -3,-1.2 4,-2.9 -4,-0.5 5,-0.2 -0.492 55.7-150.2 -74.9 120.9 11.1 31.0 -45.1 489 58 D P H > S+ 0 0 99 0, 0.0 4,-1.6 0, 0.0 -1,-0.1 0.701 96.3 50.1 -64.1 -25.9 13.9 32.4 -47.3 490 59 D K H > S+ 0 0 116 -14,-0.3 4,-2.3 2,-0.2 5,-0.2 0.818 110.6 51.4 -80.4 -34.3 15.2 34.9 -44.8 491 60 D V H > S+ 0 0 0 -15,-0.2 4,-2.4 2,-0.2 5,-0.2 0.980 113.6 44.7 -57.5 -54.8 15.3 32.1 -42.2 492 61 D K H X S+ 0 0 119 -4,-2.9 4,-1.5 1,-0.2 -2,-0.2 0.899 114.8 47.3 -58.7 -41.9 17.3 30.0 -44.6 493 62 D A H X S+ 0 0 58 -4,-1.6 4,-1.5 1,-0.2 -1,-0.2 0.880 112.7 48.4 -70.6 -35.2 19.6 32.8 -45.7 494 63 D H H X S+ 0 0 55 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.884 105.8 57.7 -74.0 -35.2 20.3 33.9 -42.1 495 64 D G H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.903 104.0 54.1 -56.4 -42.8 21.0 30.4 -41.0 496 65 D K H X S+ 0 0 95 -4,-1.5 4,-1.9 1,-0.2 -1,-0.2 0.930 107.3 49.4 -61.4 -45.1 23.7 30.3 -43.7 497 66 D K H X S+ 0 0 154 -4,-1.5 4,-1.8 2,-0.2 -1,-0.2 0.912 108.6 53.6 -60.4 -42.7 25.3 33.4 -42.3 498 67 D V H X S+ 0 0 47 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.935 108.8 49.4 -59.0 -44.6 25.2 31.9 -38.7 499 68 D L H X S+ 0 0 5 -4,-2.4 4,-2.7 1,-0.2 -1,-0.2 0.858 104.8 57.7 -65.3 -33.3 27.1 28.8 -40.0 500 69 D G H X S+ 0 0 31 -4,-1.9 4,-1.6 1,-0.2 -1,-0.2 0.896 108.1 46.9 -64.0 -38.0 29.7 30.9 -41.7 501 70 D A H X S+ 0 0 23 -4,-1.8 4,-1.4 2,-0.2 -1,-0.2 0.869 109.1 53.9 -71.2 -36.8 30.5 32.5 -38.4 502 71 D F H X S+ 0 0 17 -4,-2.0 4,-1.9 1,-0.2 3,-0.4 0.944 105.9 55.9 -57.7 -42.2 30.6 29.1 -36.8 503 72 D S H X S+ 0 0 37 -4,-2.7 4,-1.7 1,-0.3 -2,-0.2 0.888 101.9 54.1 -56.0 -44.4 33.1 28.2 -39.6 504 73 D D H X S+ 0 0 90 -4,-1.6 4,-0.9 1,-0.2 -1,-0.3 0.869 107.4 53.5 -60.2 -34.8 35.4 31.1 -38.6 505 74 D G H >< S+ 0 0 0 -4,-1.4 3,-0.8 -3,-0.4 -2,-0.2 0.919 103.8 52.9 -66.8 -44.6 35.4 29.7 -35.1 506 75 D L H >< S+ 0 0 16 -4,-1.9 3,-0.7 1,-0.2 -1,-0.2 0.856 110.6 49.7 -61.5 -31.1 36.4 26.2 -36.1 507 76 D A H 3< S+ 0 0 84 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.664 118.5 37.8 -80.9 -16.3 39.4 27.7 -38.0 508 77 D H T X< S+ 0 0 88 -4,-0.9 3,-2.7 -3,-0.8 -1,-0.2 -0.252 72.4 148.1-121.5 44.1 40.4 29.9 -34.9 509 78 D L G X + 0 0 13 -3,-0.7 3,-0.6 1,-0.3 -1,-0.1 0.750 69.2 56.8 -54.6 -27.1 39.7 27.3 -32.1 510 79 D D G 3 S+ 0 0 126 1,-0.2 -1,-0.3 -3,-0.1 3,-0.1 0.530 116.2 36.1 -85.7 -0.2 42.5 28.6 -29.9 511 80 D N G <> + 0 0 101 -3,-2.7 4,-1.7 -6,-0.2 3,-0.4 -0.280 62.7 141.3-144.6 56.0 41.0 32.1 -29.9 512 81 D L H <> S+ 0 0 12 -3,-0.6 4,-2.4 1,-0.2 5,-0.2 0.910 74.0 61.9 -63.9 -40.5 37.2 32.0 -30.0 513 82 D K H 4 S+ 0 0 105 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.850 109.6 39.4 -51.5 -42.1 37.1 35.0 -27.6 514 83 D G H 4 S+ 0 0 45 -3,-0.4 4,-0.3 2,-0.2 -1,-0.2 0.794 113.0 55.3 -83.6 -28.3 38.8 37.2 -30.1 515 84 D T H < S+ 0 0 39 -4,-1.7 4,-0.3 -7,-0.2 3,-0.2 0.892 116.4 35.0 -70.4 -39.3 37.0 35.9 -33.2 516 85 D F S X S+ 0 0 5 -4,-2.4 4,-2.9 1,-0.2 -1,-0.2 0.381 85.1 105.5 -97.6 4.2 33.5 36.5 -31.8 517 86 D A H > S+ 0 0 18 -4,-0.4 4,-2.6 1,-0.2 5,-0.2 0.928 83.2 44.5 -53.1 -52.3 34.1 39.8 -29.9 518 87 D T H > S+ 0 0 110 -4,-0.3 4,-2.3 1,-0.2 -1,-0.2 0.925 116.2 47.3 -60.3 -44.1 32.4 42.0 -32.4 519 88 D L H > S+ 0 0 63 -4,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.803 108.3 56.9 -66.0 -34.0 29.5 39.6 -32.7 520 89 D S H X S+ 0 0 0 -4,-2.9 4,-1.8 2,-0.2 -2,-0.2 0.984 108.6 45.2 -57.5 -56.0 29.4 39.4 -29.0 521 90 D E H X>S+ 0 0 85 -4,-2.6 4,-3.2 1,-0.2 5,-0.5 0.890 112.9 53.6 -56.3 -40.3 29.0 43.2 -28.7 522 91 D L H X>S+ 0 0 70 -4,-2.3 5,-2.0 -5,-0.2 4,-1.1 0.911 108.3 45.8 -61.7 -47.9 26.4 43.1 -31.5 523 92 D H H <5S+ 0 0 49 -4,-2.2 6,-2.6 3,-0.2 -1,-0.2 0.807 122.6 39.6 -69.3 -26.0 24.1 40.5 -29.9 524 93 D C H X5S+ 0 0 12 -4,-1.8 4,-0.9 4,-0.2 -2,-0.2 0.959 123.7 32.9 -82.0 -63.4 24.4 42.4 -26.6 525 94 D D H <5S+ 0 0 50 -4,-3.2 -3,-0.2 -5,-0.2 -2,-0.1 0.901 133.1 21.5 -65.3 -50.7 24.3 46.1 -27.6 526 95 D K T < - 0 0 4 -2,-0.5 3,-2.4 1,-0.2 4,-0.3 -0.533 19.5-133.6 -62.2 121.3 20.0 36.8 -23.5 531 100 D P T >> S+ 0 0 14 0, 0.0 3,-1.3 0, 0.0 4,-0.7 0.665 98.7 78.5 -57.4 -18.6 23.1 34.6 -23.9 532 101 D E H >> S+ 0 0 40 1,-0.3 4,-1.0 2,-0.2 3,-0.7 0.845 85.0 62.8 -59.8 -28.3 21.2 31.7 -22.5 533 102 D N H <> S+ 0 0 21 -3,-2.4 4,-1.7 1,-0.2 -1,-0.3 0.814 87.9 70.6 -66.4 -26.1 19.7 31.4 -25.9 534 103 D F H <> S+ 0 0 26 -3,-1.3 4,-1.7 -4,-0.3 -1,-0.2 0.856 95.7 52.8 -59.4 -35.6 23.1 30.7 -27.4 535 104 D R H < S+ 0 0 31 -4,-2.6 3,-2.0 1,-0.2 -2,-0.2 0.605 76.0 177.7 -95.9 -12.8 25.3 12.2 -40.5 550 119 D G G >< S+ 0 0 18 -4,-2.0 3,-2.0 1,-0.3 -1,-0.2 -0.227 72.7 13.7 54.0-126.4 23.6 9.2 -38.8 551 120 D K G 3 S+ 0 0 201 1,-0.3 -1,-0.3 -151,-0.1 -2,-0.1 0.696 122.7 63.9 -50.1 -34.0 26.2 6.5 -37.9 552 121 D E G < S+ 0 0 87 -3,-2.0 2,-1.9 1,-0.2 -1,-0.3 0.723 84.2 76.8 -68.3 -22.0 29.1 8.9 -38.5 553 122 D F S < S+ 0 0 0 -3,-2.0 -1,-0.2 -7,-0.2 -3,-0.1 -0.599 76.6 175.6 -91.3 75.9 28.0 11.2 -35.6 554 123 D T > - 0 0 50 -2,-1.9 4,-2.5 1,-0.1 3,-0.4 -0.281 46.4 -96.6 -81.8 164.5 29.4 8.8 -33.1 555 124 D P H > S+ 0 0 18 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.909 124.6 48.9 -51.5 -48.9 29.5 9.4 -29.3 556 125 D P H > S+ 0 0 74 0, 0.0 4,-1.7 0, 0.0 5,-0.1 0.865 110.8 50.8 -60.2 -35.1 33.1 10.6 -29.4 557 126 D V H > S+ 0 0 22 -3,-0.4 4,-2.2 1,-0.2 5,-0.1 0.926 109.7 50.1 -68.0 -42.4 32.4 13.0 -32.3 558 127 D Q H X S+ 0 0 0 -4,-2.5 4,-3.0 1,-0.2 -1,-0.2 0.914 106.2 56.4 -60.1 -44.9 29.4 14.5 -30.5 559 128 D A H X S+ 0 0 6 -4,-2.2 4,-1.7 -5,-0.3 -1,-0.2 0.903 108.3 47.0 -55.7 -41.0 31.5 15.0 -27.4 560 129 D A H X S+ 0 0 1 -4,-1.7 4,-1.9 1,-0.2 -1,-0.2 0.924 112.5 49.2 -70.0 -37.5 34.0 17.1 -29.4 561 130 D Y H X S+ 0 0 0 -4,-2.2 4,-2.9 1,-0.2 5,-0.2 0.867 106.1 57.4 -66.9 -36.4 31.2 19.1 -31.0 562 131 D Q H X S+ 0 0 12 -4,-3.0 4,-1.8 2,-0.2 -1,-0.2 0.878 106.6 49.0 -58.2 -44.3 29.6 19.7 -27.6 563 132 D K H X S+ 0 0 62 -4,-1.7 4,-2.1 -5,-0.2 -1,-0.2 0.900 112.7 48.5 -60.9 -41.9 32.9 21.3 -26.4 564 133 D V H X S+ 0 0 1 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.958 110.2 49.5 -63.9 -52.7 33.0 23.5 -29.5 565 134 D V H X S+ 0 0 10 -4,-2.9 4,-2.5 1,-0.2 -1,-0.2 0.841 113.1 47.5 -57.4 -37.6 29.4 24.6 -29.2 566 135 D A H X S+ 0 0 47 -4,-1.8 4,-2.9 -5,-0.2 5,-0.2 0.889 109.2 55.0 -66.9 -40.4 30.0 25.6 -25.5 567 136 D G H X S+ 0 0 10 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.934 111.2 44.9 -57.1 -43.0 33.2 27.3 -26.6 568 137 D V H X S+ 0 0 16 -4,-2.6 4,-3.0 2,-0.2 5,-0.2 0.943 111.2 51.1 -68.9 -49.5 31.2 29.4 -29.0 569 138 D A H X S+ 0 0 7 -4,-2.5 4,-1.4 1,-0.2 -1,-0.2 0.926 113.1 46.3 -54.0 -46.3 28.4 30.1 -26.6 570 139 D N H X S+ 0 0 79 -4,-2.9 4,-1.0 1,-0.2 3,-0.3 0.912 111.6 51.9 -64.9 -38.9 30.9 31.3 -24.0 571 140 D A H >< S+ 0 0 1 -4,-2.3 3,-0.7 -5,-0.2 4,-0.3 0.912 108.5 50.8 -66.0 -37.7 32.7 33.4 -26.6 572 141 D L H 3< S+ 0 0 23 -4,-3.0 3,-0.3 1,-0.2 -1,-0.2 0.779 111.7 47.6 -68.8 -27.2 29.5 35.0 -27.7 573 142 D A H >< S+ 0 0 33 -4,-1.4 3,-1.9 -3,-0.3 -1,-0.2 0.589 86.8 93.3 -84.7 -11.4 28.6 36.0 -24.1 574 143 D H T << S+ 0 0 95 -4,-1.0 -1,-0.2 -3,-0.7 -2,-0.1 0.752 84.4 45.1 -60.9 -34.2 32.1 37.4 -23.2 575 144 D K T 3 S+ 0 0 85 -4,-0.3 2,-0.3 -3,-0.3 -1,-0.3 0.167 77.6 126.9 -97.1 15.6 31.4 41.0 -24.1 576 145 D Y < 0 0 23 -3,-1.9 -538,-0.1 -52,-0.1 -55,-0.1 -0.618 360.0 360.0 -72.1 132.3 28.1 41.4 -22.4 577 146 D H 0 0 137 -2,-0.3 -537,-0.1 -540,-0.2 -2,-0.1 -0.819 360.0 360.0-139.7 360.0 28.2 44.3 -19.9