==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=31-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXYGEN TRANSPORT 29-SEP-94 2HHE . COMPND 2 MOLECULE: HEMOGLOBIN (DEOXY) (ALPHA CHAIN); . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR G.L.GILLILAND,I.PECHIK,C.FRONTICELLI,X.JI . 572 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24301.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 479 83.7 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 2.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 115 20.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 337 58.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.4 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 0 0 2 0 0 0 0 0 2 0 7 5 0 1 4 5 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 0 144 0, 0.0 2,-0.9 0, 0.0 428,-0.1 0.000 360.0 360.0 360.0 129.5 20.2 30.2 41.9 2 2 A L - 0 0 14 71,-0.2 122,-0.0 126,-0.1 5,-0.0 -0.883 360.0-150.1 -91.5 104.9 23.9 29.7 41.3 3 3 A S > - 0 0 53 -2,-0.9 4,-2.4 1,-0.1 5,-0.2 -0.119 34.3 -93.8 -63.8 169.0 25.8 31.8 43.9 4 4 A P H > S+ 0 0 99 0, 0.0 4,-2.7 0, 0.0 5,-0.1 0.889 127.3 54.4 -52.4 -44.1 29.2 33.2 43.0 5 5 A A H > S+ 0 0 58 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.940 107.9 49.2 -55.5 -52.4 30.9 30.2 44.5 6 6 A D H > S+ 0 0 11 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.884 110.6 50.9 -52.5 -45.9 28.9 27.9 42.3 7 7 A K H X S+ 0 0 25 -4,-2.4 4,-2.5 2,-0.2 5,-0.3 0.916 110.1 50.5 -60.0 -40.6 29.7 29.9 39.3 8 8 A T H X S+ 0 0 85 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.940 110.2 48.6 -58.5 -55.2 33.4 29.7 40.2 9 9 A N H X S+ 0 0 30 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.680 112.3 49.2 -56.0 -36.2 33.3 25.9 40.6 10 10 A V H X S+ 0 0 0 -4,-1.5 4,-3.6 -5,-0.2 5,-0.3 0.936 112.7 43.8 -72.6 -53.6 31.6 25.4 37.3 11 11 A K H X S+ 0 0 97 -4,-2.5 4,-2.8 2,-0.2 -2,-0.2 0.909 115.5 52.1 -60.3 -40.7 33.8 27.6 35.2 12 12 A A H X S+ 0 0 58 -4,-2.5 4,-1.7 -5,-0.3 -2,-0.2 0.980 118.1 34.4 -55.8 -67.4 36.8 26.0 37.0 13 13 A A H X S+ 0 0 4 -4,-2.2 4,-1.5 1,-0.2 -2,-0.2 0.799 116.1 54.8 -61.8 -36.3 35.7 22.4 36.3 14 14 A W H X S+ 0 0 17 -4,-3.6 4,-1.3 2,-0.2 3,-0.5 0.954 105.6 56.0 -59.9 -44.3 34.2 23.2 33.0 15 15 A G H >< S+ 0 0 36 -4,-2.8 3,-1.1 1,-0.3 -2,-0.2 0.923 104.1 50.9 -51.1 -55.3 37.6 24.7 32.0 16 16 A K H 3< S+ 0 0 134 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.832 100.3 64.2 -56.1 -31.0 39.5 21.5 32.9 17 17 A V H >< S+ 0 0 3 -4,-1.5 3,-1.7 -3,-0.5 -1,-0.3 0.923 82.4 150.2 -57.3 -39.8 37.0 19.6 30.7 18 18 A G G X< - 0 0 41 -4,-1.3 3,-1.2 -3,-1.1 -1,-0.2 -0.154 67.6 -8.3 47.4-130.6 38.5 21.7 27.9 19 19 A A G 3 S+ 0 0 112 1,-0.2 -1,-0.3 -3,-0.1 4,-0.2 0.085 124.8 74.3 -82.1 19.5 38.5 20.2 24.5 20 20 A H G X> + 0 0 88 -3,-1.7 4,-1.3 2,-0.1 3,-0.8 0.614 68.1 96.3 -98.3 -25.5 37.3 16.9 25.8 21 21 A A H X> S+ 0 0 7 -3,-1.2 4,-2.4 1,-0.3 3,-1.0 0.784 79.0 51.8 -31.4 -63.8 33.8 18.2 26.3 22 22 A G H 3> S+ 0 0 21 1,-0.3 4,-2.8 2,-0.3 -1,-0.3 0.884 112.9 44.5 -45.1 -53.3 32.3 17.0 23.1 23 23 A E H <> S+ 0 0 120 -3,-0.8 4,-0.7 2,-0.2 -1,-0.3 0.700 111.5 57.3 -69.5 -13.5 33.5 13.4 23.7 24 24 A Y H XX S+ 0 0 21 -4,-1.3 4,-1.9 -3,-1.0 3,-0.8 0.945 105.4 48.8 -78.8 -42.5 32.2 14.1 27.2 25 25 A G H 3X S+ 0 0 5 -4,-2.4 4,-2.6 1,-0.3 -2,-0.2 0.903 108.8 53.9 -57.3 -50.8 28.8 14.8 25.7 26 26 A A H 3X S+ 0 0 13 -4,-2.8 4,-1.5 1,-0.2 -1,-0.3 0.696 111.3 44.0 -62.5 -21.5 29.0 11.6 23.7 27 27 A E H X S+ 0 0 0 -4,-1.9 4,-1.8 2,-0.2 3,-1.2 0.994 110.6 49.5 -61.3 -50.3 27.1 11.0 28.9 29 29 A L H >X S+ 0 0 4 -4,-2.6 4,-2.3 1,-0.3 3,-1.4 0.875 110.4 47.2 -47.5 -67.2 24.6 10.2 26.1 30 30 A E H 3X S+ 0 0 40 -4,-1.5 4,-0.8 1,-0.3 -1,-0.3 0.668 111.5 53.6 -50.2 -27.9 25.7 6.6 25.8 31 31 A R H < S- 0 0 36 -4,-3.7 3,-1.9 -5,-0.2 -1,-0.2 -0.770 71.3-179.8-121.7 74.4 17.8 5.0 31.4 37 37 A P G > S+ 0 0 45 0, 0.0 3,-1.4 0, 0.0 538,-0.2 0.681 72.3 70.1 -57.8 -16.3 16.6 3.0 28.4 38 38 A T G > S+ 0 0 39 1,-0.3 3,-3.1 2,-0.2 4,-0.3 0.861 84.5 72.0 -72.3 -28.2 13.3 5.0 28.1 39 39 A T G X S+ 0 0 2 -3,-1.9 3,-0.9 1,-0.3 -1,-0.3 0.612 82.4 70.3 -62.9 -18.3 15.4 8.0 27.0 40 40 A K G X S+ 0 0 61 -3,-1.4 3,-2.7 1,-0.2 -1,-0.3 0.688 77.3 80.8 -73.1 -15.2 16.0 6.1 23.7 41 41 A T G < S+ 0 0 9 -3,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.819 91.5 51.9 -60.1 -27.5 12.3 6.8 22.9 42 42 A Y G < S+ 0 0 20 -3,-0.9 -1,-0.3 -4,-0.3 -2,-0.2 0.467 107.9 53.9 -87.4 1.6 13.4 10.2 21.9 43 43 A F X + 0 0 37 -3,-2.7 3,-0.8 1,-0.1 -1,-0.2 -0.406 54.9 127.9-131.0 53.8 16.1 8.8 19.5 44 44 A P T 3 S+ 0 0 74 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.745 75.3 60.4 -79.5 -19.5 14.6 6.4 17.1 45 45 A H T 3 S+ 0 0 128 -3,-0.2 2,-0.4 2,-0.1 -2,-0.1 0.315 94.8 88.1 -86.0 6.9 16.1 8.2 14.1 46 46 A F S < S- 0 0 43 -3,-0.8 2,-0.6 8,-0.0 -3,-0.1 -0.841 79.3-129.9-109.4 140.7 19.6 7.6 15.5 47 47 A D - 0 0 87 -2,-0.4 8,-0.4 1,-0.1 7,-0.1 -0.841 32.2-173.3 -78.1 118.6 22.0 4.7 15.1 48 48 A L + 0 0 49 -2,-0.6 2,-0.2 6,-0.1 -1,-0.1 0.056 37.7 124.0-107.8 15.1 22.5 4.4 18.9 49 49 A S S > S- 0 0 66 1,-0.1 3,-1.6 2,-0.1 6,-0.2 -0.545 78.4 -77.1 -79.7 142.6 25.2 1.8 18.7 50 50 A H T 3 S+ 0 0 150 1,-0.3 -1,-0.1 -2,-0.2 -2,-0.1 -0.136 117.9 17.0 -39.9 122.9 28.5 2.7 20.4 51 51 A G T 3 S+ 0 0 47 1,-0.2 -1,-0.3 -25,-0.2 -2,-0.1 0.568 84.0 169.7 85.3 14.5 30.7 5.2 18.4 52 52 A S <> - 0 0 6 -3,-1.6 4,-2.0 1,-0.2 -1,-0.2 -0.236 40.4-135.8 -56.9 142.8 27.8 6.3 16.2 53 53 A A H > S+ 0 0 83 1,-0.2 4,-3.7 2,-0.2 5,-0.2 0.877 108.1 56.5 -63.2 -37.0 28.7 9.4 14.2 54 54 A Q H > S+ 0 0 83 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.934 108.1 41.8 -59.2 -57.6 25.2 10.6 15.3 55 55 A V H > S+ 0 0 10 -8,-0.4 4,-4.1 -6,-0.2 5,-0.2 0.822 117.3 48.2 -60.1 -40.1 25.8 10.3 19.0 56 56 A K H X S+ 0 0 118 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.968 114.1 45.4 -69.9 -51.7 29.3 11.8 18.8 57 57 A G H X S+ 0 0 25 -4,-3.7 4,-1.7 1,-0.2 -2,-0.2 0.826 118.6 45.3 -58.0 -36.6 28.1 14.6 16.7 58 58 A H H X S+ 0 0 51 -4,-2.0 4,-3.0 -5,-0.2 -2,-0.2 0.911 110.0 51.1 -71.7 -46.3 25.1 15.0 19.1 59 59 A G H X S+ 0 0 0 -4,-4.1 4,-2.7 1,-0.2 -34,-0.2 0.930 110.9 53.5 -58.4 -37.3 27.3 14.7 22.3 60 60 A K H X S+ 0 0 128 -4,-2.7 4,-2.5 -5,-0.2 -1,-0.2 0.919 108.0 46.3 -59.5 -49.5 29.4 17.4 20.6 61 61 A K H X S+ 0 0 146 -4,-1.7 4,-2.0 1,-0.2 -2,-0.2 0.934 112.1 53.9 -66.6 -36.4 26.4 19.8 20.1 62 62 A V H X S+ 0 0 27 -4,-3.0 4,-1.4 1,-0.2 -2,-0.2 0.946 110.6 44.3 -56.5 -55.4 25.3 19.1 23.7 63 63 A A H X S+ 0 0 1 -4,-2.7 4,-3.7 2,-0.2 3,-0.4 0.901 108.6 56.8 -54.8 -48.2 28.7 20.1 25.1 64 64 A D H X S+ 0 0 104 -4,-2.5 4,-2.2 1,-0.3 -1,-0.2 0.908 107.8 50.2 -49.2 -46.6 29.0 23.1 22.9 65 65 A A H X S+ 0 0 25 -4,-2.0 4,-2.1 2,-0.2 -1,-0.3 0.786 111.4 46.4 -60.5 -41.2 25.7 24.2 24.4 66 66 A L H X S+ 0 0 12 -4,-1.4 4,-3.7 -3,-0.4 5,-0.3 0.897 108.9 54.7 -71.1 -40.6 26.9 23.7 28.0 67 67 A T H X S+ 0 0 61 -4,-3.7 4,-3.1 1,-0.3 -2,-0.2 0.907 110.9 48.6 -58.9 -35.3 30.2 25.5 27.2 68 68 A N H X S+ 0 0 58 -4,-2.2 4,-1.2 -5,-0.3 -1,-0.3 0.916 109.7 49.0 -69.5 -46.5 27.8 28.3 26.1 69 69 A A H >< S+ 0 0 0 -4,-2.1 3,-1.1 2,-0.2 6,-0.3 0.964 115.4 45.6 -56.7 -48.9 25.8 28.1 29.3 70 70 A V H >< S+ 0 0 13 -4,-3.7 3,-1.4 1,-0.3 -2,-0.2 0.919 109.6 53.4 -58.6 -47.6 29.0 28.2 31.3 71 71 A A H 3< S+ 0 0 68 -4,-3.1 -1,-0.3 1,-0.3 -2,-0.2 0.699 125.2 29.0 -55.5 -24.3 30.4 31.0 29.1 72 72 A H T X< S+ 0 0 95 -4,-1.2 3,-1.5 -3,-1.1 -1,-0.3 -0.328 70.4 145.0-136.5 51.6 27.1 32.8 30.1 73 73 A V T < S+ 0 0 11 -3,-1.4 3,-0.2 1,-0.3 -71,-0.2 0.311 76.1 56.1 -70.7 0.5 26.1 31.5 33.5 74 74 A D T 3 S+ 0 0 117 -5,-0.2 -1,-0.3 1,-0.1 -4,-0.1 0.400 117.9 30.3-111.3 -5.7 24.7 34.9 34.3 75 75 A D S <> S+ 0 0 85 -3,-1.5 4,-1.7 -6,-0.3 -1,-0.1 -0.343 70.1 147.2-148.9 53.4 22.4 35.1 31.3 76 76 A M H > + 0 0 17 -3,-0.2 4,-3.7 2,-0.2 5,-0.2 0.883 68.8 60.4 -59.0 -43.9 21.5 31.5 30.7 77 77 A P H > S+ 0 0 75 0, 0.0 4,-0.6 0, 0.0 7,-0.2 0.881 114.5 31.2 -50.6 -54.6 18.0 32.4 29.4 78 78 A N H 4 S+ 0 0 102 2,-0.2 4,-0.4 1,-0.2 -2,-0.2 0.760 119.0 56.5 -76.6 -30.4 19.1 34.6 26.5 79 79 A A H < S+ 0 0 27 -4,-1.7 -1,-0.2 -7,-0.2 -3,-0.2 0.872 122.6 26.8 -67.2 -38.9 22.2 32.5 26.0 80 80 A L H >X S+ 0 0 5 -4,-3.7 4,-1.6 1,-0.1 3,-1.1 0.353 88.1 110.2-101.0 4.1 20.0 29.4 25.7 81 81 A S H >X S+ 0 0 48 -4,-0.6 4,-2.8 1,-0.3 3,-0.7 0.875 76.5 55.5 -49.3 -48.0 16.8 30.9 24.3 82 82 A A H 3> S+ 0 0 76 -4,-0.4 4,-1.9 1,-0.3 -1,-0.3 0.840 113.6 42.5 -51.7 -40.0 17.1 29.4 20.9 83 83 A L H <> S+ 0 0 53 -3,-1.1 4,-1.0 2,-0.2 -1,-0.3 0.706 108.1 55.8 -83.6 -27.5 17.4 26.0 22.4 84 84 A S H S+ 0 0 63 -4,-1.9 5,-2.8 1,-0.3 4,-0.9 0.651 114.2 48.9 -62.3 -28.0 13.4 24.1 20.1 87 87 A H H <>S+ 0 0 35 -4,-1.0 5,-1.1 -3,-0.3 6,-0.7 0.767 118.5 38.9 -81.2 -35.2 13.0 21.9 23.2 88 88 A A H <5S+ 0 0 6 -4,-2.0 -2,-0.2 -3,-0.5 -3,-0.2 0.926 129.0 29.2 -83.8 -43.5 9.6 23.3 24.1 89 89 A H H <5S+ 0 0 106 -4,-3.2 -3,-0.2 -5,-0.2 -2,-0.2 0.507 132.4 18.8 -97.1 -14.6 8.2 23.6 20.5 90 90 A K T <5S+ 0 0 108 -4,-0.9 -3,-0.2 -5,-0.3 -4,-0.1 0.679 129.8 27.9-122.6 -55.3 9.9 20.9 18.5 91 91 A L T - 0 0 9 -2,-0.5 3,-2.6 1,-0.2 4,-0.2 -0.400 27.9-121.3 -57.8 137.3 9.5 15.3 28.9 95 95 A P T >> S+ 0 0 33 0, 0.0 4,-0.8 0, 0.0 3,-0.5 0.462 104.5 73.6 -52.6 -9.7 11.3 17.3 31.7 96 96 A V H 3> S+ 0 0 42 1,-0.2 4,-0.5 2,-0.2 -2,-0.1 0.703 90.3 59.8 -76.8 -28.7 12.0 14.1 33.7 97 97 A N H <> S+ 0 0 9 -3,-2.6 4,-0.9 2,-0.2 -1,-0.2 0.517 91.6 66.2 -71.9 -23.7 14.7 13.2 31.1 98 98 A F H X> S+ 0 0 22 -3,-0.5 4,-2.3 -4,-0.2 3,-0.9 0.954 101.9 49.9 -61.9 -53.6 16.8 16.4 31.7 99 99 A K H 3X S+ 0 0 142 -4,-0.8 4,-1.7 1,-0.3 -1,-0.2 0.731 107.0 54.0 -50.5 -41.3 17.5 15.1 35.2 100 100 A L H 3X S+ 0 0 40 -4,-0.5 4,-1.7 2,-0.2 -1,-0.3 0.727 111.9 44.0 -68.1 -34.0 18.6 11.7 33.9 101 101 A L H X S+ 0 0 14 -4,-2.3 4,-1.6 1,-0.2 3,-0.6 0.937 109.6 49.5 -60.5 -41.2 22.3 15.7 34.3 103 103 A H H >X S+ 0 0 12 -4,-1.7 4,-2.6 1,-0.3 3,-0.6 0.889 110.2 44.8 -59.9 -68.1 23.0 12.6 36.2 104 104 A C H 3X S+ 0 0 0 -4,-1.7 4,-1.4 1,-0.2 -1,-0.3 0.533 111.5 58.3 -56.7 -15.7 24.9 10.7 33.6 105 105 A L H X S+ 0 0 4 -4,-1.7 3,-3.1 -3,-0.4 4,-1.5 0.991 107.9 53.9 -62.4 -61.9 32.6 14.2 35.0 110 110 A A H 3< S+ 0 0 0 -4,-2.6 -1,-0.2 1,-0.3 150,-0.2 0.653 112.1 46.8 -38.9 -41.5 33.4 12.4 38.2 111 111 A A T 3< S+ 0 0 10 -4,-1.3 150,-0.4 -5,-0.3 -1,-0.3 0.376 116.2 42.0 -90.1 -9.1 35.2 9.7 36.2 112 112 A H T <4 S+ 0 0 55 -3,-3.1 -2,-0.2 -4,-0.2 -1,-0.2 0.536 115.4 47.1-116.4 -13.1 37.2 12.0 34.0 113 113 A L X + 0 0 7 -4,-1.5 4,-1.6 1,-0.1 3,-0.3 -0.592 57.9 166.8-131.1 68.4 38.2 14.6 36.6 114 114 A P T 4 S+ 0 0 87 0, 0.0 -1,-0.1 0, 0.0 -4,-0.0 0.771 81.5 41.6 -55.4 -27.7 39.5 12.7 39.7 115 115 A A T 4 S+ 0 0 80 1,-0.1 3,-0.1 -3,-0.1 -5,-0.0 0.831 114.3 45.8 -88.9 -39.9 41.0 15.9 41.1 116 116 A E T 4 S+ 0 0 66 -3,-0.3 2,-1.5 1,-0.2 -1,-0.1 0.664 88.6 88.6 -78.3 -18.2 38.3 18.5 40.4 117 117 A F < + 0 0 0 -4,-1.6 -1,-0.2 -7,-0.1 140,-0.0 -0.492 54.5 149.2 -87.8 63.9 35.3 16.5 41.6 118 118 A T >> - 0 0 64 -2,-1.5 4,-2.6 -3,-0.1 3,-2.3 -0.532 65.8 -92.8 -88.1 168.8 35.1 17.3 45.3 119 119 A P H 3> S+ 0 0 21 0, 0.0 4,-2.5 0, 0.0 5,-0.1 0.840 127.8 49.1 -50.1 -38.3 31.9 17.5 47.4 120 120 A A H 3> S+ 0 0 33 2,-0.2 4,-1.2 1,-0.2 -111,-0.1 0.714 112.2 44.5 -80.1 -20.4 31.7 21.2 46.6 121 121 A V H <> S+ 0 0 16 -3,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.826 112.6 53.0 -87.3 -42.4 32.2 20.9 42.9 122 122 A H H >X S+ 0 0 3 -4,-2.6 4,-2.1 2,-0.2 3,-0.5 0.993 110.2 48.7 -46.1 -63.6 29.8 18.0 42.8 123 123 A A H 3X S+ 0 0 15 -4,-2.5 4,-2.4 1,-0.3 -2,-0.2 0.827 113.8 47.5 -44.3 -53.4 27.3 20.2 44.6 124 124 A S H 3X S+ 0 0 5 -4,-1.2 4,-1.6 1,-0.2 -1,-0.3 0.804 110.1 47.8 -65.5 -40.5 27.9 23.1 42.2 125 125 A L H < S+ 0 0 15 -4,-1.6 3,-1.0 -3,-0.4 4,-0.4 0.946 113.0 47.1 -62.8 -51.1 16.1 27.2 31.2 136 136 A L H 3< S+ 0 0 17 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.565 119.1 39.9 -59.2 -23.9 15.5 24.6 28.5 137 137 A T H >< S+ 0 0 39 -4,-0.7 3,-1.7 -3,-0.3 4,-0.3 0.356 88.8 95.3-107.5 -8.5 12.2 23.6 30.1 138 138 A S T << S+ 0 0 54 -3,-1.0 3,-0.4 -4,-0.7 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159 18 B V < - 0 0 20 -3,-1.4 2,-1.0 -2,-0.6 3,-0.1 -0.899 60.5-145.0-116.3 146.4 35.8 -1.3 47.5 160 19 B N >> - 0 0 88 -2,-0.4 4,-2.9 1,-0.2 3,-0.5 -0.796 15.7-163.3-104.1 93.4 36.5 0.1 50.9 161 20 B V H 3> S+ 0 0 37 -2,-1.0 4,-3.2 1,-0.3 -1,-0.2 0.863 88.7 47.5 -47.0 -44.9 33.1 0.1 52.5 162 21 B D H 3> S+ 0 0 102 2,-0.2 4,-1.7 1,-0.2 -1,-0.3 0.840 114.5 45.9 -65.2 -44.5 34.1 2.4 55.3 163 22 B E H <> S+ 0 0 82 -3,-0.5 4,-1.4 2,-0.2 -2,-0.2 0.952 120.0 37.5 -61.7 -63.7 35.8 4.8 52.9 164 23 B V H X S+ 0 0 0 -4,-2.9 4,-2.8 2,-0.2 3,-0.3 0.904 111.2 64.2 -56.1 -44.0 33.0 5.0 50.3 165 24 B G H X S+ 0 0 1 -4,-3.2 4,-2.7 -5,-0.5 5,-0.3 0.961 108.0 39.1 -39.3 -69.3 30.5 4.8 53.2 166 25 B G H X S+ 0 0 9 -4,-1.7 4,-1.1 1,-0.2 -1,-0.3 0.741 115.2 51.8 -55.2 -38.7 31.6 8.1 54.5 167 26 B E H X S+ 0 0 30 -4,-1.4 4,-2.3 -3,-0.3 -1,-0.2 0.889 112.1 46.1 -68.3 -44.2 32.1 9.8 51.2 168 27 B A H X S+ 0 0 1 -4,-2.8 4,-1.9 1,-0.2 3,-0.5 0.992 114.6 46.3 -61.7 -60.4 28.6 8.8 49.9 169 28 B L H X S+ 0 0 8 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1,-0.3 -1,-0.3 0.614 83.3 74.8 -55.9 -11.7 18.9 15.3 53.8 180 39 B Q G X + 0 0 34 -3,-1.2 3,-3.5 1,-0.2 -1,-0.3 0.672 66.9 93.1 -74.8 -23.3 20.7 16.8 56.9 181 40 B R G < S+ 0 0 62 -3,-2.3 3,-0.4 1,-0.3 -1,-0.2 0.709 84.9 50.7 -44.0 -34.5 17.4 17.1 58.7 182 41 B F G < S+ 0 0 57 -3,-0.9 -1,-0.3 1,-0.2 3,-0.1 0.377 105.4 56.3 -84.4 -4.8 18.0 13.7 60.2 183 42 B F X + 0 0 22 -3,-3.5 3,-1.0 1,-0.1 -1,-0.2 -0.280 56.2 125.1-127.4 40.6 21.5 14.3 61.5 184 43 B E T 3 S+ 0 0 129 -3,-0.4 3,-0.4 1,-0.2 -1,-0.1 0.583 77.5 55.8 -80.9 -2.9 21.2 17.4 63.7 185 44 B S T 3 S+ 0 0 98 1,-0.2 -1,-0.2 -3,-0.1 3,-0.1 0.382 85.2 84.5 -99.9 -0.6 22.8 15.4 66.6 186 45 B F S < S- 0 0 31 -3,-1.0 14,-0.4 1,-0.3 2,-0.3 0.394 93.1-139.1 -82.4 1.1 25.8 14.6 64.4 187 46 B G + 0 0 50 -3,-0.4 -1,-0.3 13,-0.1 2,-0.3 -0.583 63.2 32.6 79.1-137.1 27.2 18.0 65.4 188 47 B D + 0 0 92 -2,-0.3 10,-0.2 1,-0.1 -3,-0.0 -0.433 48.9 143.3 -69.9 122.5 28.9 20.3 62.9 189 48 B L + 0 0 18 -2,-0.3 -1,-0.1 5,-0.1 6,-0.1 0.026 32.6 122.1-141.5 17.6 27.7 20.3 59.3 190 49 B S S S+ 0 0 88 4,-0.0 -2,-0.0 2,-0.0 3,-0.0 0.581 76.4 22.4 -64.4 -20.8 28.1 24.0 58.6 191 50 B T S > S- 0 0 67 1,-0.1 4,-2.3 -3,-0.0 5,-0.2 -0.930 84.3-106.0-142.3 164.1 30.5 23.5 55.7 192 51 B P H > S+ 0 0 52 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.823 124.5 51.9 -55.5 -35.8 31.4 20.8 53.2 193 52 B D H > S+ 0 0 139 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.934 106.8 51.2 -69.2 -46.6 34.6 20.4 55.2 194 53 B A H > S+ 0 0 17 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.948 114.8 44.3 -52.6 -51.7 32.7 20.0 58.4 195 54 B V H < S+ 0 0 2 -4,-2.3 -1,-0.2 2,-0.2 -2,-0.2 0.906 114.3 45.5 -56.0 -58.8 30.4 17.4 56.9 196 55 B M H < S+ 0 0 52 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.809 120.6 43.5 -60.9 -31.9 33.1 15.3 55.1 197 56 B G H < S+ 0 0 50 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.711 84.5 114.5 -84.0 -31.4 35.2 15.5 58.3 198 57 B N X - 0 0 9 -4,-2.4 4,-1.2 -5,-0.2 -11,-0.1 -0.159 57.9-149.7 -52.0 129.7 32.4 14.8 60.8 199 58 B P H > S+ 0 0 79 0, 0.0 4,-2.4 0, 0.0 -1,-0.1 0.832 93.5 52.4 -72.4 -33.8 33.1 11.5 62.5 200 59 B K H > S+ 0 0 96 -14,-0.4 4,-4.8 2,-0.3 5,-0.3 0.962 108.3 49.7 -68.4 -48.4 29.4 10.6 63.1 201 60 B V H > S+ 0 0 0 -15,-0.3 4,-3.3 1,-0.3 -1,-0.2 0.899 112.8 51.7 -52.1 -39.3 28.5 11.2 59.4 202 61 B K H X S+ 0 0 99 -4,-1.2 4,-1.2 2,-0.2 -2,-0.3 0.910 111.6 43.1 -67.3 -44.6 31.5 9.0 59.0 203 62 B A H X S+ 0 0 41 -4,-2.4 4,-1.9 2,-0.2 3,-0.4 0.932 116.6 48.8 -64.6 -44.8 30.1 6.3 61.4 204 63 B H H X S+ 0 0 38 -4,-4.8 4,-2.8 1,-0.2 3,-0.3 0.945 107.0 55.6 -56.8 -52.0 26.7 6.7 59.8 205 64 B G H X S+ 0 0 2 -4,-3.3 4,-1.7 -5,-0.3 -1,-0.2 0.796 108.8 48.1 -49.6 -39.5 28.1 6.3 56.3 206 65 B K H X S+ 0 0 78 -4,-1.2 4,-1.9 -3,-0.4 -1,-0.2 0.822 111.3 47.3 -80.1 -33.0 29.8 3.0 57.2 207 66 B K H X S+ 0 0 123 -4,-1.9 4,-2.0 -3,-0.3 -2,-0.2 0.934 114.2 47.0 -72.6 -42.6 26.8 1.4 58.8 208 67 B V H >X S+ 0 0 43 -4,-2.8 4,-2.4 1,-0.2 3,-0.7 0.994 117.4 44.1 -56.5 -61.1 24.4 2.4 56.0 209 68 B L H 3X S+ 0 0 3 -4,-1.7 4,-2.0 1,-0.3 -1,-0.2 0.707 108.9 53.7 -59.1 -32.0 26.9 1.2 53.4 210 69 B G H 3X S+ 0 0 18 -4,-1.9 4,-2.2 2,-0.2 -1,-0.3 0.837 109.7 50.9 -67.8 -38.4 27.8 -2.1 55.2 211 70 B A H < S+ 0 0 104 -4,-2.2 3,-1.4 -3,-0.4 4,-0.3 0.886 106.2 60.9 -58.4 -33.1 25.1 -7.3 52.8 215 74 B G H >< S+ 0 0 1 -4,-1.7 3,-1.9 1,-0.3 -2,-0.2 0.842 92.1 61.4 -56.9 -44.9 22.5 -6.4 50.1 216 75 B L G >< S+ 0 0 18 -4,-1.3 3,-0.6 -3,-0.3 -1,-0.3 0.645 98.1 59.0 -60.4 -22.4 24.7 -7.2 47.2 217 76 B A G < S+ 0 0 79 -3,-1.4 -1,-0.3 -4,-0.5 -2,-0.2 0.566 108.3 46.7 -84.4 -10.5 24.9 -10.8 48.4 218 77 B H G X + 0 0 95 -3,-1.9 3,-2.1 -4,-0.3 -1,-0.2 -0.382 61.0 143.6-127.1 47.3 21.1 -11.0 48.1 219 78 B L T < S+ 0 0 7 -3,-0.6 3,-0.3 1,-0.3 -1,-0.1 0.556 76.1 58.6 -65.4 -8.7 20.5 -9.5 44.6 220 79 B D T 3 S+ 0 0 115 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.0 0.316 116.2 28.1-105.9 12.0 17.7 -12.1 44.4 221 80 B N <> + 0 0 91 -3,-2.1 4,-2.4 -6,-0.2 -1,-0.2 -0.203 61.2 150.0-163.1 54.2 15.8 -11.0 47.5 222 81 B L H > S+ 0 0 12 -3,-0.3 4,-2.8 1,-0.2 -3,-0.1 0.747 82.8 49.8 -64.6 -24.3 16.2 -7.3 48.2 223 82 B K H > S+ 0 0 74 2,-0.2 4,-1.8 3,-0.2 -1,-0.2 0.919 109.9 48.7 -78.6 -45.2 12.8 -7.2 49.7 224 83 B G H 4 S+ 0 0 41 2,-0.2 4,-0.3 1,-0.2 -2,-0.2 0.920 118.2 43.6 -52.3 -48.2 13.5 -10.2 51.9 225 84 B T H < S+ 0 0 42 -4,-2.4 4,-0.3 -7,-0.2 -2,-0.2 0.931 118.8 39.0 -64.8 -58.1 16.7 -8.5 52.9 226 85 B F H X S+ 0 0 7 -4,-2.8 4,-2.9 1,-0.2 3,-0.4 0.530 84.7 106.7 -80.9 0.1 15.4 -4.9 53.4 227 86 B A H X S+ 0 0 26 -4,-1.8 4,-2.6 1,-0.3 3,-0.3 0.826 86.4 31.4 -40.0 -75.7 12.0 -5.7 55.1 228 87 B T H > S+ 0 0 106 -4,-0.3 4,-2.3 1,-0.2 -1,-0.3 0.751 120.3 55.0 -52.3 -36.2 12.6 -4.8 58.8 229 88 B L H > S+ 0 0 72 -3,-0.4 4,-1.8 -4,-0.3 -2,-0.2 0.866 107.0 50.7 -74.8 -32.0 15.0 -2.1 57.7 230 89 B S H X S+ 0 0 0 -4,-2.9 4,-2.1 -3,-0.3 -2,-0.2 0.963 110.5 50.6 -65.5 -49.2 12.2 -0.7 55.4 231 90 B E H X S+ 0 0 63 -4,-2.6 4,-3.5 1,-0.2 5,-0.4 0.906 109.9 47.5 -52.0 -54.4 9.8 -0.7 58.4 232 91 B L H X>S+ 0 0 67 -4,-2.3 5,-2.8 1,-0.3 4,-2.0 0.893 109.4 52.6 -56.8 -46.4 12.2 1.1 60.8 233 92 B H H <>S+ 0 0 32 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39.4-148.9 -49.2 123.5 -7.9 15.7 63.0 341 53 C A H > S+ 0 0 70 1,-0.2 4,-5.4 2,-0.2 5,-0.2 0.756 97.3 66.4 -66.8 -28.8 -7.9 19.4 63.7 342 54 C Q H > S+ 0 0 87 2,-0.2 4,-3.3 1,-0.2 5,-0.3 0.938 105.5 40.6 -55.2 -51.3 -4.2 19.3 63.3 343 55 C V H > S+ 0 0 10 -8,-0.4 4,-2.9 2,-0.2 -2,-0.2 0.887 116.2 51.6 -63.4 -43.8 -4.6 18.5 59.6 344 56 C K H X S+ 0 0 116 -4,-1.9 4,-2.4 2,-0.2 -30,-0.3 0.961 113.2 44.7 -55.9 -58.1 -7.5 21.0 59.6 345 57 C G H X S+ 0 0 36 -4,-5.4 4,-2.0 2,-0.2 -2,-0.2 0.907 115.7 44.1 -56.4 -47.3 -5.2 23.6 61.2 346 58 C H H X S+ 0 0 51 -4,-3.3 4,-2.8 1,-0.2 -1,-0.2 0.922 112.5 57.4 -67.1 -33.6 -2.2 22.8 58.9 347 59 C G H X S+ 0 0 0 -4,-2.9 4,-2.3 -5,-0.3 -2,-0.2 0.929 105.5 48.8 -58.0 -44.1 -4.8 22.8 56.1 348 60 C K H X S+ 0 0 97 -4,-2.4 4,-3.1 2,-0.2 -1,-0.2 0.902 109.9 51.4 -58.8 -48.9 -5.8 26.3 56.9 349 61 C K H X S+ 0 0 147 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.936 110.7 47.9 -60.4 -50.2 -2.2 27.5 57.0 350 62 C V H X S+ 0 0 24 -4,-2.8 4,-3.3 2,-0.2 -2,-0.2 0.911 112.9 48.2 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6,-0.2 0.810 95.9 67.0 -77.3 -32.1 -7.0 -3.9 32.8 504 75 D L H X< S+ 0 0 18 -4,-1.5 3,-0.9 -3,-0.5 -1,-0.2 0.873 99.1 56.1 -50.9 -37.9 -9.4 -3.0 35.7 505 76 D A T 3< S+ 0 0 80 -4,-1.0 -1,-0.3 1,-0.3 -2,-0.2 0.680 112.9 39.3 -64.8 -30.2 -10.7 -6.5 35.1 506 77 D H T X + 0 0 99 -3,-1.6 3,-2.3 -4,-0.3 -1,-0.3 -0.409 66.5 149.2-125.7 54.9 -7.3 -8.1 35.6 507 78 D L T < S+ 0 0 13 -3,-0.9 -75,-0.2 1,-0.3 -1,-0.1 0.448 76.1 54.6 -63.9 -7.4 -6.0 -5.9 38.4 508 79 D D T 3 S+ 0 0 108 -5,-0.1 -1,-0.3 1,-0.1 -4,-0.1 0.134 113.6 38.2-112.1 8.2 -4.1 -9.0 39.5 509 80 D N S <> S+ 0 0 113 -3,-2.3 4,-2.7 -6,-0.2 5,-0.2 -0.083 71.1 145.8-148.8 31.6 -2.3 -9.6 36.2 510 81 D L H > S+ 0 0 19 1,-0.2 4,-1.4 2,-0.2 -3,-0.1 0.763 76.2 42.4 -47.4 -36.5 -1.7 -5.9 35.3 511 82 D K H > S+ 0 0 110 2,-0.2 4,-1.1 1,-0.1 -1,-0.2 0.941 111.0 51.7 -76.6 -56.8 1.6 -6.8 33.6 512 83 D G H >4 S+ 0 0 51 1,-0.2 3,-0.8 2,-0.2 4,-0.3 0.922 112.4 50.4 -43.4 -50.4 0.5 -9.9 31.7 513 84 D T H >< S+ 0 0 51 -4,-2.7 3,-0.5 1,-0.2 4,-0.3 0.880 114.2 39.5 -56.5 -55.6 -2.5 -7.9 30.3 514 85 D F H 3X S+ 0 0 8 -4,-1.4 4,-3.7 -5,-0.2 3,-0.3 0.415 84.2 106.1 -85.6 10.8 -0.6 -4.8 29.1 515 86 D A H S+ 0 0 116 -3,-0.5 4,-1.1 -4,-0.3 -1,-0.3 0.856 118.3 44.9 -75.9 -37.2 1.5 -6.4 24.1 517 88 D L H > S+ 0 0 58 -4,-0.3 4,-2.4 -3,-0.3 -2,-0.2 0.832 109.2 55.9 -74.1 -41.5 0.6 -2.8 24.5 518 89 D S H X S+ 0 0 0 -4,-3.7 4,-1.4 1,-0.2 3,-0.2 0.983 111.7 45.7 -50.7 -53.7 3.8 -2.2 26.6 519 90 D E H X S+ 0 0 97 -4,-1.8 4,-1.9 1,-0.2 -1,-0.2 0.726 111.9 49.5 -60.1 -37.1 5.8 -3.5 23.7 520 91 D L H X>S+ 0 0 68 -4,-1.1 5,-2.0 2,-0.2 4,-1.7 0.823 107.8 52.5 -75.8 -37.8 3.9 -1.5 21.0 521 92 D H H <>S+ 0 0 37 -4,-2.4 6,-2.7 -3,-0.2 5,-0.5 0.805 119.5 38.5 -64.0 -29.8 4.3 1.8 22.7 522 93 D C H X5S+ 0 0 8 -4,-1.4 4,-0.9 -5,-0.2 -2,-0.2 0.967 121.6 37.2 -76.8 -74.9 8.0 1.1 23.0 523 94 D D H <5S+ 0 0 62 -4,-1.9 -2,-0.2 1,-0.2 -3,-0.2 0.469 135.5 11.7 -57.0 -25.8 8.9 -0.5 19.7 524 95 D K T <5S+ 0 0 130 -4,-1.7 -3,-0.2 -5,-0.1 -1,-0.2 0.596 130.6 40.6-128.4 -35.2 6.6 1.4 17.3 525 96 D L T 4 - 0 0 3 -2,-0.7 3,-2.0 1,-0.2 4,-0.4 -0.421 20.2-130.5 -60.8 120.8 8.3 7.8 26.9 529 100 D P T 3> S+ 0 0 5 0, 0.0 4,-0.5 0, 0.0 3,-0.4 0.586 98.4 82.4 -49.1 -9.7 6.6 5.9 29.7 530 101 D E H >> S+ 0 0 55 1,-0.2 3,-1.2 2,-0.2 4,-1.1 0.895 81.5 62.1 -65.2 -40.2 6.5 9.2 31.6 531 102 D N H <> S+ 0 0 13 -3,-2.0 4,-2.9 1,-0.3 -1,-0.2 0.783 92.0 63.0 -51.6 -45.0 3.3 10.1 29.7 532 103 D F H 3> S+ 0 0 26 -4,-0.4 4,-1.9 -3,-0.4 -1,-0.3 0.731 105.2 50.3 -53.6 -29.3 1.4 7.2 31.2 533 104 D R H X S+ 0 0 18 -4,-1.1 4,-2.3 2,-0.2 3,-0.6 0.976 113.3 51.1 -65.0 -46.6 0.7 12.3 33.3 535 106 D L H 3X S+ 0 0 24 -4,-2.9 4,-3.1 1,-0.3 5,-0.2 0.897 105.3 52.6 -57.1 -51.8 -2.3 10.5 32.0 536 107 D G H 3X S+ 0 0 6 -4,-1.9 4,-1.5 1,-0.3 -1,-0.3 0.789 114.0 45.1 -56.1 -36.8 -3.1 8.6 35.2 537 108 D N H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 3,-0.9 0.936 111.7 53.4 -57.1 -45.7 -5.1 13.8 34.5 539 110 D L H 3X S+ 0 0 1 -4,-3.1 4,-3.4 1,-0.3 -2,-0.2 0.853 104.9 51.8 -52.6 -52.3 -7.5 10.9 34.7 540 111 D V H 3X S+ 0 0 0 -4,-1.5 4,-1.8 1,-0.2 -1,-0.3 0.752 110.3 51.6 -58.7 -30.4 -7.8 11.1 38.5 541 112 D C H X S+ 0 0 5 -4,-2.3 4,-2.5 2,-0.2 3,-1.4 0.968 110.6 52.6 -57.6 -53.7 -11.3 14.0 35.4 543 114 D L H 3X S+ 0 0 0 -4,-3.4 4,-2.1 1,-0.3 5,-0.2 0.910 112.6 45.2 -46.3 -56.0 -12.8 11.3 37.7 544 115 D A H 3X S+ 0 0 0 -4,-1.8 4,-1.0 2,-0.2 -1,-0.3 0.618 110.1 52.6 -59.6 -35.5 -12.9 13.8 40.6 545 116 D H H << S+ 0 0 37 -3,-1.4 -1,-0.2 -4,-1.2 -2,-0.2 0.909 116.2 41.6 -68.2 -47.6 -14.3 16.7 38.5 546 117 D H H < S+ 0 0 82 -4,-2.5 -2,-0.2 -3,-0.2 -3,-0.2 0.694 123.3 36.4 -71.0 -37.2 -17.1 14.4 37.3 547 118 D F H >< S- 0 0 18 -4,-2.1 3,-2.0 -5,-0.3 -1,-0.2 0.531 82.9-178.3 -98.6 -10.1 -17.8 12.7 40.6 548 119 D G G >< S+ 0 0 17 -4,-1.0 3,-3.3 1,-0.3 -1,-0.2 -0.021 71.5 6.2 43.1-137.5 -17.3 15.6 43.0 549 120 D K G 3 S+ 0 0 182 -150,-0.5 -1,-0.3 1,-0.3 -149,-0.1 0.590 124.5 68.8 -44.4 -13.2 -17.7 14.7 46.7 550 121 D E G < S+ 0 0 86 -3,-2.0 2,-1.7 1,-0.2 -1,-0.3 0.799 81.5 74.8 -82.0 -32.6 -18.1 11.1 45.7 551 122 D F S < S- 0 0 0 -3,-3.3 -1,-0.2 -7,-0.2 -152,-0.1 -0.693 81.3-177.6 -82.8 77.7 -14.4 10.8 44.6 552 123 D T >> - 0 0 50 -2,-1.7 4,-2.8 1,-0.0 3,-1.1 -0.416 43.0 -97.5 -79.3 160.0 -13.3 10.8 48.2 553 124 D P H 3> S+ 0 0 16 0, 0.0 4,-2.8 0, 0.0 3,-0.5 0.884 125.8 49.2 -42.2 -53.5 -9.8 10.7 49.7 554 125 D P H 3> S+ 0 0 75 0, 0.0 4,-2.0 0, 0.0 5,-0.1 0.771 111.6 46.5 -61.6 -33.1 -10.1 6.9 50.1 555 126 D V H <> S+ 0 0 22 -3,-1.1 4,-2.2 2,-0.2 5,-0.1 0.819 112.6 50.7 -79.1 -32.8 -11.3 6.3 46.5 556 127 D Q H X S+ 0 0 0 -4,-2.8 4,-2.3 -3,-0.5 5,-0.2 0.930 107.0 54.6 -63.1 -48.4 -8.6 8.5 45.1 557 128 D A H >X S+ 0 0 7 -4,-2.8 4,-1.9 -5,-0.3 3,-0.7 0.943 109.9 46.7 -47.6 -55.9 -6.1 6.6 47.1 558 129 D A H 3X S+ 0 0 0 -4,-2.0 4,-1.6 1,-0.3 -1,-0.2 0.895 114.7 47.5 -57.6 -39.2 -7.4 3.4 45.5 559 130 D Y H 3X S+ 0 0 0 -4,-2.2 4,-2.0 2,-0.2 -1,-0.3 0.687 103.9 59.4 -75.3 -23.8 -7.2 5.0 42.1 560 131 D Q H < S+ 0 0 20 -4,-1.2 3,-2.9 -3,-0.5 -1,-0.2 0.671 85.9 97.3 -97.3 -21.2 6.4 0.6 30.7 572 143 D H T 3< S+ 0 0 97 -4,-1.6 -1,-0.1 1,-0.3 -2,-0.1 0.604 84.6 43.1 -45.8 -30.7 7.3 -2.9 31.7 573 144 D K T 3 S+ 0 0 58 -3,-0.2 -1,-0.3 -4,-0.2 -2,-0.1 0.227 82.3 128.3-106.0 12.3 8.6 -4.0 28.3 574 145 D Y < 0 0 28 -3,-2.9 -536,-0.1 -52,-0.1 -55,-0.1 -0.408 360.0 360.0 -67.6 143.2 10.6 -0.8 27.5 575 146 D H 0 0 121 -538,-0.2 -535,-0.1 -537,-0.1 -2,-0.1 -0.867 360.0 360.0-170.3 360.0 14.2 -1.4 26.5