==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER METAL BINDING PROTEIN 28-NOV-01 1KGN . COMPND 2 MOLECULE: RIBONUCLEOTIDE REDUCTASE PROTEIN R2F; . SOURCE 2 ORGANISM_SCIENTIFIC: CORYNEBACTERIUM AMMONIAGENES; . AUTHOR M.HOGBOM,Y.HUQUE,B.M.SJOBERG,P.NORDLUND . 1184 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 45778.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 930 78.5 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 . 14 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 142 12.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 745 62.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 29 2.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 2 6 6 3 1 0 0 1 6 8 4 0 0 0 4 0 0 0 0 4 0 0 0 0 4 3 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 S 0 0 78 0, 0.0 530,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -48.1 30.8 57.5 153.6 2 3 A N >> + 0 0 127 2,-0.1 3,-1.7 3,-0.0 4,-0.5 0.555 360.0 82.2-126.9 -32.6 34.2 57.9 152.0 3 4 A E T 34 S+ 0 0 107 1,-0.3 4,-0.3 2,-0.1 3,-0.2 0.786 101.8 37.5 -49.7 -33.4 33.8 55.7 148.8 4 5 A Y T 3> S+ 0 0 8 1,-0.1 4,-2.6 2,-0.1 -1,-0.3 0.397 87.7 96.3-100.8 0.0 32.1 58.6 146.9 5 6 A D H <> S+ 0 0 58 -3,-1.7 4,-2.9 1,-0.2 5,-0.2 0.921 84.8 50.3 -58.9 -42.7 34.1 61.6 148.3 6 7 A E H X S+ 0 0 146 -4,-0.5 4,-1.6 2,-0.2 -1,-0.2 0.935 110.6 48.2 -61.8 -46.9 36.4 61.6 145.3 7 8 A Y H > S+ 0 0 40 -4,-0.3 4,-0.6 1,-0.2 3,-0.3 0.928 113.1 49.1 -59.2 -44.4 33.6 61.6 142.8 8 9 A I H >< S+ 0 0 31 -4,-2.6 3,-1.2 1,-0.2 -2,-0.2 0.938 109.7 50.8 -63.3 -42.0 31.9 64.4 144.7 9 10 A A H 3< S+ 0 0 69 -4,-2.9 3,-0.3 1,-0.3 -1,-0.2 0.756 112.6 48.3 -65.5 -24.6 35.1 66.5 144.8 10 11 A N H 3< S+ 0 0 113 -4,-1.6 -1,-0.3 -3,-0.3 -2,-0.2 0.443 109.6 52.7 -95.2 -2.0 35.4 66.0 141.0 11 12 A H << + 0 0 78 -3,-1.2 -1,-0.2 -4,-0.6 4,-0.1 -0.566 60.4 149.0-131.8 70.4 31.8 67.0 140.2 12 13 A T + 0 0 107 -3,-0.3 -1,-0.1 -2,-0.2 3,-0.1 0.713 44.0 94.4 -77.8 -23.1 31.4 70.3 141.9 13 14 A D S S- 0 0 134 -3,-0.1 -3,-0.0 1,-0.1 2,-0.0 -0.391 90.1 -95.6 -68.2 148.6 28.9 71.7 139.4 14 15 A P - 0 0 53 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.322 30.3-122.0 -63.7 145.8 25.2 71.2 140.3 15 16 A V - 0 0 23 416,-0.2 2,-0.3 417,-0.1 426,-0.1 -0.771 37.9-133.2 -84.1 135.9 23.4 68.2 138.9 16 17 A K - 0 0 116 -2,-0.4 2,-0.3 355,-0.1 412,-0.0 -0.739 8.4-142.0-103.3 143.0 20.3 69.6 137.0 17 18 A A - 0 0 7 -2,-0.3 354,-0.2 411,-0.1 2,-0.2 -0.745 38.7-102.0 -92.6 141.4 16.7 68.6 137.1 18 19 A I - 0 0 8 352,-0.4 2,-0.6 -2,-0.3 394,-0.1 -0.452 32.5-158.0 -68.3 135.4 15.0 68.8 133.7 19 20 A N > - 0 0 25 3,-0.2 3,-1.0 -2,-0.2 76,-0.1 -0.947 12.9-175.3-115.9 108.1 12.8 72.0 133.3 20 21 A W T 3 S+ 0 0 9 -2,-0.6 3,-0.1 1,-0.2 -1,-0.1 0.425 79.8 73.5 -83.2 4.1 10.1 71.6 130.6 21 22 A N T 3 S+ 0 0 55 1,-0.2 2,-0.4 400,-0.0 -1,-0.2 0.515 98.5 50.4 -89.8 -6.2 9.1 75.3 131.1 22 23 A V < + 0 0 77 -3,-1.0 -1,-0.2 0, 0.0 -3,-0.2 -0.950 68.9 178.4-134.5 110.2 12.3 76.3 129.3 23 24 A I - 0 0 42 -2,-0.4 3,-0.2 1,-0.1 -3,-0.1 -0.896 13.0-172.6-119.6 100.8 12.9 74.6 125.9 24 25 A P S S+ 0 0 100 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 0.704 84.3 35.6 -67.7 -16.3 16.1 75.6 124.1 25 26 A D >> - 0 0 24 1,-0.1 3,-1.8 0, 0.0 4,-0.7 -0.896 69.5-158.7-137.9 106.3 15.1 73.6 121.0 26 27 A E H 3> S+ 0 0 147 -2,-0.4 4,-2.3 1,-0.3 3,-0.2 0.748 88.6 69.4 -54.0 -28.1 11.4 73.5 120.1 27 28 A K H 3> S+ 0 0 33 1,-0.2 4,-2.8 2,-0.2 -1,-0.3 0.803 91.1 59.3 -62.0 -32.1 12.0 70.4 118.1 28 29 A D H <> S+ 0 0 0 -3,-1.8 4,-2.4 2,-0.2 -1,-0.2 0.913 109.8 42.9 -64.0 -43.5 12.7 68.3 121.2 29 30 A L H X S+ 0 0 56 -4,-0.7 4,-2.8 -3,-0.2 5,-0.3 0.909 112.9 53.0 -69.7 -41.0 9.3 69.2 122.6 30 31 A E H X S+ 0 0 102 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.934 113.7 42.9 -57.3 -46.0 7.6 68.6 119.2 31 32 A V H X S+ 0 0 5 -4,-2.8 4,-3.1 2,-0.2 5,-0.3 0.908 112.6 51.8 -70.2 -40.6 9.1 65.2 118.9 32 33 A W H X S+ 0 0 2 -4,-2.4 4,-2.6 -5,-0.2 5,-0.4 0.937 112.8 46.3 -59.1 -48.4 8.4 64.2 122.5 33 34 A D H X S+ 0 0 79 -4,-2.8 4,-2.1 1,-0.2 -2,-0.2 0.922 115.0 47.1 -62.7 -42.6 4.8 65.1 122.1 34 35 A R H X S+ 0 0 142 -4,-2.2 4,-1.1 -5,-0.3 -2,-0.2 0.949 115.7 43.3 -63.1 -49.4 4.5 63.3 118.8 35 36 A L H < S+ 0 0 1 -4,-3.1 3,-0.3 1,-0.2 -2,-0.2 0.925 118.5 42.5 -66.4 -44.5 6.2 60.1 120.0 36 37 A T H >< S+ 0 0 7 -4,-2.6 3,-1.7 -5,-0.3 -1,-0.2 0.871 111.3 55.9 -70.0 -34.5 4.4 59.9 123.3 37 38 A G H 3< S+ 0 0 57 -4,-2.1 -1,-0.2 -5,-0.4 -2,-0.2 0.764 106.5 53.6 -67.6 -21.0 1.2 60.8 121.7 38 39 A N T 3< S+ 0 0 28 -4,-1.1 -1,-0.3 -3,-0.3 -2,-0.2 0.223 78.3 146.8 -98.0 14.5 1.7 57.8 119.4 39 40 A F < + 0 0 43 -3,-1.7 2,-0.3 -5,-0.1 -3,-0.1 -0.195 17.2 157.3 -51.8 137.4 2.2 55.3 122.2 40 41 A W - 0 0 11 156,-0.0 -2,-0.0 66,-0.0 69,-0.0 -0.967 30.6-149.1-156.2 160.8 0.9 51.8 121.3 41 42 A L > - 0 0 7 -2,-0.3 3,-2.1 1,-0.0 4,-0.2 -0.973 30.1-119.3-130.6 147.3 1.5 48.2 122.4 42 43 A P G > S+ 0 0 3 0, 0.0 3,-2.1 0, 0.0 5,-0.3 0.779 107.0 74.6 -58.9 -26.3 1.1 45.2 120.0 43 44 A E G 3 S+ 0 0 88 1,-0.3 4,-0.0 3,-0.1 -3,-0.0 0.719 83.5 70.3 -59.3 -18.1 -1.7 43.7 122.1 44 45 A K G < S+ 0 0 139 -3,-2.1 -1,-0.3 2,-0.1 149,-0.0 0.606 88.5 71.7 -75.0 -12.3 -3.9 46.5 120.7 45 46 A I S < S- 0 0 17 -3,-2.1 2,-2.4 -4,-0.2 3,-0.2 -0.929 85.1-129.9-107.0 126.6 -4.0 44.9 117.3 46 47 A P > + 0 0 63 0, 0.0 3,-2.3 0, 0.0 4,-0.2 -0.378 37.4 165.6 -75.2 68.7 -6.0 41.7 116.8 47 48 A V G > + 0 0 8 -2,-2.4 3,-2.9 -5,-0.3 143,-0.2 0.828 66.7 72.0 -54.9 -31.2 -3.3 39.7 115.1 48 49 A S G > S+ 0 0 68 1,-0.3 3,-1.5 -3,-0.2 -1,-0.3 0.749 83.2 70.7 -60.4 -19.6 -5.2 36.5 115.6 49 50 A N G < S+ 0 0 102 -3,-2.3 -1,-0.3 1,-0.3 4,-0.3 0.575 89.9 63.1 -71.8 -6.6 -7.6 37.7 113.0 50 51 A D G <> S+ 0 0 3 -3,-2.9 4,-3.0 -4,-0.2 -1,-0.3 0.353 71.9 99.5 -93.6 1.7 -4.8 37.0 110.5 51 52 A I H <> S+ 0 0 67 -3,-1.5 4,-2.6 1,-0.2 5,-0.2 0.903 82.5 47.2 -60.0 -39.6 -4.7 33.3 111.1 52 53 A Q H > S+ 0 0 148 -3,-0.2 4,-1.3 -4,-0.2 -1,-0.2 0.932 114.1 48.0 -66.3 -42.3 -6.8 32.3 108.0 53 54 A S H > S+ 0 0 27 -4,-0.3 4,-0.5 1,-0.2 3,-0.5 0.941 113.6 47.7 -62.8 -47.0 -4.7 34.6 105.8 54 55 A W H >< S+ 0 0 7 -4,-3.0 3,-1.3 1,-0.2 -2,-0.2 0.893 107.8 54.5 -59.8 -44.6 -1.4 33.2 107.2 55 56 A N H 3< S+ 0 0 74 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.772 105.8 54.2 -64.2 -23.0 -2.6 29.6 106.9 56 57 A K H 3< S+ 0 0 73 -4,-1.3 -1,-0.3 -3,-0.5 -2,-0.2 0.572 87.8 103.1 -85.9 -11.1 -3.3 30.2 103.2 57 58 A M S << S- 0 0 9 -3,-1.3 -3,-0.0 -4,-0.5 -4,-0.0 -0.394 78.9-107.2 -72.4 151.2 0.2 31.5 102.5 58 59 A T > - 0 0 28 1,-0.1 4,-2.9 -2,-0.1 5,-0.2 -0.240 27.5-109.5 -74.2 161.3 2.8 29.3 100.8 59 60 A P H > S+ 0 0 57 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.903 122.4 51.4 -58.0 -36.6 5.7 27.7 102.7 60 61 A Q H > S+ 0 0 75 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.882 110.1 48.1 -66.0 -42.0 8.0 30.2 100.8 61 62 A E H > S+ 0 0 29 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.923 113.3 48.0 -65.0 -45.7 5.9 33.2 101.8 62 63 A Q H X S+ 0 0 27 -4,-2.9 4,-2.8 1,-0.2 -2,-0.2 0.931 111.0 50.2 -62.3 -43.2 5.8 32.1 105.4 63 64 A L H X S+ 0 0 76 -4,-2.7 4,-2.6 1,-0.2 5,-0.2 0.921 110.7 48.8 -62.3 -42.6 9.6 31.5 105.5 64 65 A A H X S+ 0 0 5 -4,-2.1 4,-3.1 1,-0.2 5,-0.3 0.901 111.5 50.6 -63.4 -40.7 10.4 34.9 104.1 65 66 A T H X S+ 0 0 2 -4,-2.2 4,-2.5 2,-0.2 5,-0.3 0.938 110.5 49.0 -63.0 -47.4 8.0 36.5 106.6 66 67 A M H X S+ 0 0 5 -4,-2.8 4,-1.9 1,-0.2 -2,-0.2 0.929 115.9 44.3 -58.6 -43.9 9.7 34.6 109.5 67 68 A R H X S+ 0 0 78 -4,-2.6 4,-2.7 -5,-0.2 5,-0.2 0.963 113.5 46.1 -71.6 -48.6 13.1 35.7 108.3 68 69 A V H X S+ 0 0 0 -4,-3.1 4,-2.1 1,-0.2 5,-0.2 0.951 114.9 49.3 -60.3 -42.0 12.4 39.3 107.5 69 70 A F H X S+ 0 0 0 -4,-2.5 4,-2.3 -5,-0.3 -1,-0.2 0.857 110.9 49.3 -64.4 -35.3 10.6 39.8 110.8 70 71 A T H X S+ 0 0 0 -4,-1.9 4,-2.4 -5,-0.3 -1,-0.2 0.918 109.9 51.3 -70.5 -40.1 13.4 38.1 112.8 71 72 A G H X S+ 0 0 1 -4,-2.7 4,-2.0 2,-0.2 -2,-0.2 0.879 111.5 48.3 -60.5 -37.1 16.0 40.4 111.1 72 73 A L H X S+ 0 0 4 -4,-2.1 4,-2.4 -5,-0.2 5,-0.2 0.901 108.7 53.7 -70.1 -39.7 13.8 43.4 112.0 73 74 A T H X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 242,-0.4 0.930 107.1 52.2 -60.5 -41.3 13.6 42.1 115.6 74 75 A L H X S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.954 109.4 49.1 -59.5 -48.7 17.4 41.9 115.7 75 76 A L H X S+ 0 0 3 -4,-2.0 4,-2.6 1,-0.2 -1,-0.2 0.884 113.0 45.9 -58.7 -43.8 17.7 45.5 114.6 76 77 A D H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 5,-0.3 0.833 108.8 56.7 -68.3 -32.4 15.1 46.8 117.2 77 78 A T H X S+ 0 0 12 -4,-2.5 4,-2.0 -5,-0.2 5,-0.2 0.943 112.7 41.9 -62.8 -46.3 16.8 44.8 119.9 78 79 A I H X>S+ 0 0 7 -4,-2.3 5,-2.6 -5,-0.2 4,-2.5 0.939 114.5 50.1 -65.0 -49.1 20.1 46.5 119.1 79 80 A Q H <>S+ 0 0 0 -4,-2.6 5,-3.0 3,-0.2 6,-0.4 0.880 115.3 42.3 -59.8 -39.5 18.5 50.0 118.7 80 81 A G H <5S+ 0 0 0 -4,-2.6 -1,-0.2 3,-0.2 -2,-0.2 0.872 124.2 33.3 -77.9 -36.3 16.6 49.9 122.0 81 82 A T H <5S+ 0 0 20 -4,-2.0 -2,-0.2 -5,-0.3 -3,-0.2 0.676 140.4 6.1 -95.0 -16.6 19.3 48.3 124.2 82 83 A V T X5S+ 0 0 36 -4,-2.5 4,-1.9 -5,-0.2 -3,-0.2 0.630 121.3 53.7-130.1 -46.7 22.4 49.8 122.6 83 84 A G H >>4 S+ 0 0 30 -6,-0.4 3,-1.1 1,-0.3 -1,-0.3 0.866 98.3 59.8 -60.6 -38.9 21.1 54.6 124.7 86 87 A S H 3< S+ 0 0 16 -4,-1.9 -1,-0.3 -3,-0.5 -2,-0.2 0.695 99.1 59.7 -66.3 -15.3 24.5 55.4 123.1 87 88 A L H X< S+ 0 0 0 -3,-1.2 3,-1.0 -4,-0.7 -1,-0.2 0.668 82.6 83.3 -85.8 -19.0 23.1 58.8 122.0 88 89 A L G X< S+ 0 0 10 -3,-1.1 3,-1.7 -4,-0.5 -1,-0.2 0.889 85.1 53.3 -49.6 -50.4 22.4 60.1 125.5 89 90 A P G 3 S+ 0 0 108 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.686 109.9 50.3 -61.0 -20.4 25.9 61.3 126.5 90 91 A D G < S+ 0 0 40 -3,-1.0 -2,-0.2 -4,-0.2 -3,-0.1 0.293 79.3 133.8-103.2 7.3 26.1 63.5 123.4 91 92 A A < - 0 0 23 -3,-1.7 3,-0.1 -4,-0.2 -3,-0.0 -0.255 48.7-150.0 -62.3 147.0 22.7 65.3 123.7 92 93 A E S S+ 0 0 102 1,-0.1 2,-0.3 2,-0.0 -1,-0.1 0.722 82.4 24.7 -84.8 -26.0 22.6 69.0 123.2 93 94 A T S > S- 0 0 19 1,-0.1 4,-1.2 -68,-0.0 -1,-0.1 -0.937 74.6-122.1-137.5 159.6 19.7 69.4 125.6 94 95 A M H > S+ 0 0 52 -2,-0.3 4,-1.8 1,-0.2 5,-0.1 0.824 114.0 58.3 -70.5 -30.8 18.1 67.6 128.5 95 96 A H H > S+ 0 0 9 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.861 101.2 56.0 -67.3 -33.1 14.9 67.3 126.7 96 97 A E H > S+ 0 0 1 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.884 104.2 53.4 -65.4 -36.0 16.7 65.5 123.9 97 98 A E H X S+ 0 0 46 -4,-1.2 4,-1.5 1,-0.2 -1,-0.2 0.920 107.1 52.0 -64.2 -39.5 17.9 62.9 126.5 98 99 A A H X S+ 0 0 3 -4,-1.8 4,-1.6 1,-0.2 3,-0.2 0.911 106.4 53.6 -61.2 -44.9 14.3 62.4 127.5 99 100 A V H X S+ 0 0 0 -4,-2.0 4,-2.8 1,-0.2 3,-0.3 0.936 105.2 54.4 -56.2 -45.0 13.3 61.8 123.9 100 101 A Y H X S+ 0 0 0 -4,-2.2 4,-2.9 1,-0.3 -1,-0.2 0.855 103.3 55.8 -60.7 -33.9 16.0 59.1 123.6 101 102 A T H X S+ 0 0 2 -4,-1.5 4,-1.8 -3,-0.2 301,-0.4 0.892 109.6 46.5 -65.3 -37.8 14.5 57.3 126.7 102 103 A N H X S+ 0 0 1 -4,-1.6 4,-2.8 -3,-0.3 5,-0.2 0.941 112.0 50.6 -67.6 -44.1 11.2 57.1 124.9 103 104 A I H X S+ 0 0 0 -4,-2.8 4,-2.3 1,-0.2 5,-0.2 0.940 108.9 52.4 -57.7 -44.9 12.9 55.9 121.6 104 105 A A H X S+ 0 0 3 -4,-2.9 4,-1.5 1,-0.2 -1,-0.2 0.924 112.0 45.8 -55.9 -47.1 14.7 53.2 123.6 105 106 A F H X S+ 0 0 0 -4,-1.8 4,-2.1 293,-0.4 3,-0.2 0.931 111.7 49.8 -63.8 -46.9 11.5 51.9 125.1 106 107 A M H X S+ 0 0 0 -4,-2.8 4,-2.8 1,-0.2 -1,-0.2 0.846 105.3 57.3 -65.7 -28.5 9.5 52.0 121.8 107 108 A E H X S+ 0 0 0 -4,-2.3 4,-2.4 -5,-0.2 -1,-0.2 0.890 107.2 50.0 -67.6 -34.3 12.3 50.0 120.1 108 109 A S H X S+ 0 0 7 -4,-1.5 4,-2.5 -3,-0.2 -2,-0.2 0.894 109.9 50.4 -66.8 -38.3 11.7 47.4 122.8 109 110 A V H X S+ 0 0 0 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.914 110.3 50.3 -63.9 -43.4 8.0 47.5 122.0 110 111 A H H X S+ 0 0 0 -4,-2.8 4,-1.0 2,-0.2 -2,-0.2 0.958 110.9 47.9 -58.2 -50.7 8.8 47.1 118.3 111 112 A A H >X S+ 0 0 1 -4,-2.4 4,-1.0 1,-0.2 3,-0.7 0.932 111.2 50.8 -57.2 -43.9 11.0 44.1 118.9 112 113 A K H 3X S+ 0 0 13 -4,-2.5 4,-2.1 1,-0.2 3,-0.5 0.853 99.2 67.0 -63.8 -34.5 8.4 42.5 121.2 113 114 A S H 3X S+ 0 0 0 -4,-2.0 4,-2.4 1,-0.3 -1,-0.2 0.836 96.0 54.2 -56.0 -38.7 5.7 43.0 118.5 114 115 A Y H - 0 0 53 -2,-0.1 4,-2.0 1,-0.1 5,-0.2 -0.412 34.2-110.0 -79.7 164.4 4.5 27.1 115.0 124 125 A T H > S+ 0 0 82 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.920 119.0 51.1 -60.6 -45.7 7.2 26.6 117.7 125 126 A P H > S+ 0 0 76 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.902 108.2 53.4 -59.4 -41.1 9.6 24.9 115.3 126 127 A Q H > S+ 0 0 39 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.917 110.8 46.2 -59.9 -43.6 9.2 27.8 112.8 127 128 A I H X S+ 0 0 4 -4,-2.0 4,-2.2 2,-0.2 5,-0.3 0.953 114.0 47.7 -64.6 -47.7 10.0 30.3 115.6 128 129 A N H X S+ 0 0 79 -4,-2.9 4,-2.1 1,-0.2 -2,-0.2 0.892 112.9 48.7 -60.2 -39.5 13.0 28.3 116.7 129 130 A E H X S+ 0 0 113 -4,-2.8 4,-2.5 -5,-0.2 -1,-0.2 0.858 109.2 53.5 -69.5 -34.1 14.3 28.0 113.1 130 131 A A H X S+ 0 0 4 -4,-2.0 4,-2.1 -5,-0.2 -2,-0.2 0.918 110.8 44.5 -66.3 -46.3 13.8 31.7 112.5 131 132 A F H X S+ 0 0 13 -4,-2.2 4,-1.6 2,-0.2 -2,-0.2 0.911 113.6 51.5 -66.8 -39.1 15.9 32.7 115.5 132 133 A R H >X S+ 0 0 156 -4,-2.1 4,-1.6 -5,-0.3 3,-0.5 0.959 109.0 50.2 -61.4 -47.7 18.6 30.1 114.6 133 134 A W H 3X S+ 0 0 25 -4,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.897 107.3 55.5 -54.9 -42.3 18.7 31.4 111.0 134 135 A S H 3< S+ 0 0 1 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.820 106.8 49.8 -62.4 -34.3 19.2 35.0 112.4 135 136 A E H << S+ 0 0 82 -4,-1.6 -1,-0.2 -3,-0.5 -2,-0.2 0.817 118.3 39.4 -71.2 -32.1 22.2 33.9 114.4 136 137 A E H < S+ 0 0 114 -4,-1.6 2,-0.6 -3,-0.2 -2,-0.2 0.572 83.9 106.8 -96.1 -12.6 23.8 32.2 111.4 137 138 A N X - 0 0 21 -4,-1.8 4,-2.6 -5,-0.2 5,-0.3 -0.567 56.0-154.4 -77.3 119.2 23.1 34.6 108.5 138 139 A E H > S+ 0 0 125 -2,-0.6 4,-2.2 1,-0.2 -1,-0.2 0.853 90.6 48.7 -62.0 -38.5 26.2 36.3 107.6 139 140 A N H > S+ 0 0 6 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.882 112.6 48.0 -72.0 -36.4 24.6 39.4 106.1 140 141 A L H > S+ 0 0 0 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.960 115.2 44.7 -66.8 -46.8 22.3 39.9 109.1 141 142 A Q H X S+ 0 0 7 -4,-2.6 4,-2.7 1,-0.2 5,-0.2 0.898 112.6 53.6 -63.4 -38.5 25.1 39.5 111.6 142 143 A R H X S+ 0 0 88 -4,-2.2 4,-2.4 -5,-0.3 5,-0.2 0.935 108.7 45.8 -64.7 -44.3 27.4 41.8 109.5 143 144 A K H X S+ 0 0 2 -4,-2.4 4,-2.1 1,-0.2 5,-0.2 0.937 114.5 50.5 -67.2 -37.5 24.9 44.7 109.3 144 145 A A H X S+ 0 0 2 -4,-2.3 4,-2.6 -5,-0.2 -2,-0.2 0.933 113.1 43.9 -61.9 -45.3 24.3 44.3 113.0 145 146 A K H X S+ 0 0 20 -4,-2.7 4,-2.1 2,-0.2 -1,-0.2 0.839 109.9 55.8 -71.5 -33.0 28.0 44.3 114.0 146 147 A I H X S+ 0 0 1 -4,-2.4 4,-1.1 -5,-0.2 -1,-0.2 0.973 113.2 41.8 -61.3 -50.4 28.9 47.2 111.6 147 148 A I H >X S+ 0 0 1 -4,-2.1 4,-1.8 -5,-0.2 3,-0.8 0.943 114.3 50.8 -63.6 -44.7 26.3 49.4 113.3 148 149 A M H 3X S+ 0 0 23 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.828 99.5 66.3 -62.7 -28.1 27.2 48.2 116.8 149 150 A S H 3< S+ 0 0 16 -4,-2.1 -1,-0.2 1,-0.2 4,-0.2 0.888 105.6 43.0 -62.2 -34.7 30.9 48.9 116.1 150 151 A Y H X< S+ 0 0 11 -4,-1.1 3,-1.2 -3,-0.8 5,-0.3 0.891 110.5 53.9 -79.5 -37.4 30.0 52.7 115.9 151 152 A Y H 3< S+ 0 0 6 -4,-1.8 -2,-0.2 1,-0.3 -1,-0.2 0.870 111.8 47.7 -60.8 -34.3 27.7 52.6 118.9 152 153 A N T 3< S+ 0 0 94 -4,-2.4 -1,-0.3 -5,-0.2 -2,-0.2 0.511 102.8 84.5 -84.9 -2.6 30.6 51.1 120.8 153 154 A G S < S- 0 0 32 -3,-1.2 -3,-0.1 -4,-0.2 6,-0.0 -0.098 84.2-115.9 -87.2-172.5 33.0 53.7 119.5 154 155 A D S S+ 0 0 152 1,-0.0 -3,-0.1 -2,-0.0 -4,-0.1 0.146 78.8 101.5-116.3 22.9 33.8 57.2 120.7 155 156 A D > - 0 0 33 -5,-0.3 4,-1.5 1,-0.2 -2,-0.1 -0.901 51.5-164.2-108.9 108.2 32.6 59.4 117.9 156 157 A P H > S+ 0 0 51 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.891 87.6 50.7 -59.0 -41.4 29.2 60.9 118.6 157 158 A L H > S+ 0 0 17 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.884 106.7 54.1 -67.4 -35.6 28.5 61.9 115.1 158 159 A K H > S+ 0 0 38 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.842 104.2 57.3 -67.1 -29.9 29.2 58.5 113.7 159 160 A K H X S+ 0 0 29 -4,-1.5 4,-2.4 1,-0.2 -1,-0.2 0.919 108.2 46.2 -65.4 -38.7 26.8 57.1 116.2 160 161 A K H X S+ 0 0 9 -4,-1.5 4,-2.5 2,-0.2 -2,-0.2 0.883 111.5 50.0 -72.5 -38.0 24.0 59.3 114.8 161 162 A V H X S+ 0 0 0 -4,-2.2 4,-2.5 2,-0.2 5,-0.3 0.955 113.3 47.5 -62.3 -46.2 24.9 58.5 111.2 162 163 A A H X S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.933 112.6 48.8 -59.9 -46.1 24.8 54.7 112.0 163 164 A S H X S+ 0 0 0 -4,-2.4 4,-2.7 1,-0.2 -1,-0.2 0.909 112.4 48.1 -60.2 -42.5 21.5 55.1 113.9 164 165 A T H X S+ 0 0 0 -4,-2.5 4,-3.1 1,-0.2 5,-0.3 0.889 112.1 47.9 -69.6 -36.8 19.9 57.1 111.0 165 166 A L H X>S+ 0 0 0 -4,-2.5 5,-2.6 2,-0.2 4,-1.5 0.858 112.3 51.2 -71.3 -31.2 21.0 54.6 108.4 166 167 A L H <>S+ 0 0 2 -4,-2.2 5,-1.6 -5,-0.3 -2,-0.2 0.951 119.2 36.0 -68.8 -43.4 19.7 51.8 110.6 167 168 A E H <5S+ 0 0 0 -4,-2.7 -2,-0.2 -5,-0.2 -3,-0.2 0.885 126.0 34.7 -77.7 -38.4 16.4 53.4 111.0 168 169 A S H <5S+ 0 0 6 -4,-3.1 102,-0.3 -5,-0.2 -3,-0.2 0.650 135.0 14.8 -95.5 -15.2 15.8 55.0 107.7 169 170 A F T >X5S+ 0 0 0 -4,-1.5 3,-1.7 -5,-0.3 4,-0.5 0.706 118.6 51.8-121.8 -53.8 17.5 52.4 105.4 170 171 A L T >4> S+ 0 0 21 -3,-1.7 4,-1.4 1,-0.3 -1,-0.2 0.846 75.7 63.8 -78.6 -31.5 13.5 48.6 104.9 173 174 A S H << S+ 0 0 2 -3,-0.6 4,-0.3 -4,-0.5 -1,-0.3 0.742 115.4 48.4 -58.8 -10.8 14.5 45.4 103.1 174 175 A G H X4 S+ 0 0 2 -3,-0.9 3,-0.5 -4,-0.4 -2,-0.2 0.821 102.0 52.6 -95.9 -42.4 12.1 44.3 105.8 175 176 A F H 3X S+ 0 0 0 -4,-1.2 4,-1.6 1,-0.2 5,-0.2 0.652 93.7 76.9 -71.0 -16.4 9.0 46.5 105.7 176 177 A Y H 3X S+ 0 0 9 -4,-1.4 4,-2.8 1,-0.2 5,-0.3 0.952 90.7 54.5 -55.9 -47.5 8.6 45.7 102.0 177 178 A L H <> S+ 0 0 0 -3,-0.5 4,-2.8 -4,-0.3 5,-0.2 0.934 109.4 41.3 -57.3 -55.7 7.1 42.3 102.7 178 179 A P H > S+ 0 0 2 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.876 116.9 49.8 -64.3 -33.1 4.3 43.2 105.1 179 180 A M H X S+ 0 0 0 -4,-1.6 4,-1.7 2,-0.2 -2,-0.2 0.917 113.2 45.4 -70.8 -40.6 3.3 46.2 103.0 180 181 A Y H X S+ 0 0 57 -4,-2.8 4,-0.7 -5,-0.2 3,-0.3 0.961 114.1 49.1 -64.8 -50.1 3.2 44.2 99.7 181 182 A L H ><>S+ 0 0 1 -4,-2.8 5,-2.6 -5,-0.3 3,-1.3 0.908 108.7 54.8 -54.3 -41.9 1.3 41.4 101.4 182 183 A S H ><5S+ 0 0 21 -4,-2.3 3,-1.8 1,-0.3 -1,-0.2 0.875 102.7 55.5 -60.3 -37.0 -1.1 44.0 102.8 183 184 A S H 3<5S+ 0 0 44 -4,-1.7 -1,-0.3 -3,-0.3 -2,-0.2 0.644 106.2 51.7 -72.2 -12.1 -1.8 45.3 99.3 184 185 A R T <<5S- 0 0 125 -3,-1.3 -1,-0.3 -4,-0.7 -2,-0.2 0.106 124.5-107.5-104.5 17.7 -2.7 41.7 98.3 185 186 A A T < 5S+ 0 0 79 -3,-1.8 2,-0.3 1,-0.2 -3,-0.2 0.782 78.8 131.3 60.1 34.8 -5.1 41.6 101.2 186 187 A K < - 0 0 45 -5,-2.6 -1,-0.2 1,-0.2 -2,-0.2 -0.892 68.8 -0.1-117.3 145.3 -2.9 39.3 103.2 187 188 A L S > S+ 0 0 3 -2,-0.3 4,-2.3 -137,-0.2 -1,-0.2 0.896 76.7 163.4 45.4 49.1 -1.7 39.6 106.9 188 189 A T H > + 0 0 58 -3,-0.2 4,-0.7 2,-0.2 -1,-0.1 0.809 68.6 47.0 -71.4 -29.4 -3.7 42.9 107.2 189 190 A N H >> S+ 0 0 28 2,-0.2 4,-1.4 1,-0.2 3,-0.9 0.908 111.2 52.3 -77.4 -41.1 -3.8 43.1 111.0 190 191 A T H >> S+ 0 0 0 1,-0.3 4,-2.5 2,-0.2 3,-0.7 0.936 105.5 56.5 -57.3 -42.5 -0.0 42.3 111.1 191 192 A A H 3X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.3 -1,-0.3 0.808 100.0 59.0 -60.5 -27.7 0.4 45.2 108.6 192 193 A D H X S+ 0 0 0 -4,-2.2 4,-2.8 1,-0.2 3,-0.5 0.934 111.6 49.6 -67.3 -42.4 6.3 50.8 113.8 198 199 A I H 3X S+ 0 0 11 -4,-2.8 4,-2.5 1,-0.2 5,-0.2 0.895 103.6 59.2 -63.3 -38.3 6.8 52.8 110.6 199 200 A R H 3X S+ 0 0 99 -4,-2.3 4,-0.7 1,-0.2 -1,-0.2 0.821 113.3 40.4 -59.4 -31.7 5.0 55.8 112.2 200 201 A D H XX S+ 0 0 1 -4,-1.1 4,-2.8 -3,-0.5 3,-0.5 0.927 112.9 51.0 -80.6 -50.3 7.7 55.7 114.9 201 202 A E H 3X S+ 0 0 0 -4,-2.8 4,-2.9 1,-0.3 5,-0.3 0.865 104.5 59.5 -55.4 -38.6 10.8 54.9 112.8 202 203 A S H 3X S+ 0 0 71 -4,-2.5 4,-1.7 1,-0.2 -1,-0.3 0.903 111.2 40.3 -55.8 -46.5 9.9 57.8 110.4 203 204 A V H < S+ 0 0 16 -4,-1.9 3,-1.3 1,-0.2 -2,-0.2 0.918 113.0 47.4 -74.5 -42.5 26.3 68.8 115.3 216 217 A V H >< S+ 0 0 6 -4,-2.9 3,-2.1 1,-0.3 -2,-0.2 0.851 102.4 64.7 -69.1 -30.0 28.3 68.4 112.1 217 218 A K T 3< S+ 0 0 119 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.536 89.9 68.4 -71.4 -1.9 27.5 72.0 111.1 218 219 A K T < S+ 0 0 130 -3,-1.3 -1,-0.3 -4,-0.1 -2,-0.2 0.476 91.4 81.2 -90.8 -2.5 29.6 73.1 114.1 219 220 A L S < S- 0 0 49 -3,-2.1 -3,-0.0 1,-0.2 5,-0.0 -0.510 92.6 -85.8-100.8 169.7 32.7 71.8 112.4 220 221 A S > - 0 0 56 -2,-0.2 4,-2.5 1,-0.1 5,-0.2 -0.225 41.8-107.6 -65.3 162.9 35.0 73.3 109.7 221 222 A E H > S+ 0 0 138 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.916 122.1 55.1 -59.0 -40.8 34.0 72.8 106.1 222 223 A A H > S+ 0 0 60 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.895 109.6 43.6 -60.0 -44.0 36.9 70.4 105.9 223 224 A E H > S+ 0 0 82 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.862 110.4 57.4 -70.6 -34.4 35.7 68.2 108.7 224 225 A Q H X S+ 0 0 43 -4,-2.5 4,-1.7 1,-0.2 -2,-0.2 0.889 105.5 50.6 -61.8 -38.0 32.1 68.4 107.3 225 226 A E H X S+ 0 0 121 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.824 107.2 53.6 -69.3 -31.8 33.4 66.9 104.1 226 227 A E H X S+ 0 0 133 -4,-1.2 4,-2.3 2,-0.2 -1,-0.2 0.871 109.0 48.4 -70.8 -36.4 35.1 64.1 105.9 227 228 A Y H X S+ 0 0 38 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.841 109.6 52.7 -71.3 -33.0 31.9 63.1 107.7 228 229 A K H X S+ 0 0 57 -4,-1.7 4,-2.6 2,-0.2 5,-0.3 0.943 110.8 47.3 -66.5 -43.4 30.0 63.3 104.4 229 230 A A H X S+ 0 0 63 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.899 112.3 49.6 -62.1 -41.7 32.6 60.9 102.9 230 231 A Y H X S+ 0 0 21 -4,-2.3 4,-2.6 2,-0.2 -1,-0.2 0.933 111.0 50.7 -61.3 -45.1 32.3 58.6 106.0 231 232 A T H X S+ 0 0 0 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.928 114.0 41.9 -60.8 -52.0 28.5 58.7 105.6 232 233 A F H X S+ 0 0 21 -4,-2.6 4,-2.7 2,-0.2 -1,-0.2 0.902 113.1 54.5 -62.8 -39.5 28.5 57.7 101.9 233 234 A D H X S+ 0 0 74 -4,-2.7 4,-1.8 -5,-0.3 -2,-0.2 0.926 109.4 47.0 -61.1 -42.9 31.2 55.2 102.5 234 235 A L H X S+ 0 0 1 -4,-2.6 4,-2.6 1,-0.2 5,-0.3 0.909 110.6 53.1 -66.0 -37.6 29.1 53.5 105.2 235 236 A M H X S+ 0 0 0 -4,-2.2 4,-2.9 1,-0.2 5,-0.3 0.913 105.7 53.5 -63.7 -42.4 26.1 53.6 102.9 236 237 A Y H X S+ 0 0 119 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.927 112.6 45.1 -56.2 -45.6 28.1 51.8 100.1 237 238 A D H X S+ 0 0 22 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.892 115.7 44.2 -65.5 -44.0 29.0 49.1 102.5 238 239 A L H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.875 113.5 52.2 -69.8 -34.9 25.5 48.6 104.0 239 240 A Y H X S+ 0 0 39 -4,-2.9 4,-2.3 -5,-0.3 -2,-0.2 0.942 109.3 48.7 -66.4 -46.7 23.9 48.8 100.6 240 241 A E H X S+ 0 0 139 -4,-2.3 4,-1.4 -5,-0.3 -1,-0.2 0.923 114.4 45.9 -57.4 -46.2 26.2 46.1 99.2 241 242 A N H X S+ 0 0 8 -4,-1.9 4,-2.0 1,-0.2 -1,-0.2 0.892 111.9 51.9 -64.9 -38.1 25.5 43.8 102.2 242 243 A E H X S+ 0 0 0 -4,-2.4 4,-2.9 1,-0.2 -2,-0.2 0.852 102.0 59.7 -69.7 -34.1 21.8 44.5 101.9 243 244 A I H X S+ 0 0 30 -4,-2.3 4,-2.7 2,-0.2 -1,-0.2 0.937 109.9 43.2 -58.2 -46.8 21.7 43.6 98.2 244 245 A E H X S+ 0 0 88 -4,-1.4 4,-2.2 2,-0.2 -2,-0.2 0.900 113.0 50.9 -66.8 -41.5 22.9 40.1 99.2 245 246 A Y H X S+ 0 0 6 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.933 112.3 49.0 -59.5 -44.8 20.6 39.8 102.2 246 247 A T H X S+ 0 0 0 -4,-2.9 4,-2.8 1,-0.2 5,-0.3 0.921 108.5 51.9 -63.7 -47.8 17.7 40.8 99.9 247 248 A E H X S+ 0 0 61 -4,-2.7 4,-2.3 1,-0.2 5,-0.2 0.935 110.5 48.8 -57.6 -43.6 18.6 38.3 97.1 248 249 A D H < S+ 0 0 95 -4,-2.2 4,-0.3 1,-0.2 -1,-0.2 0.853 117.3 40.1 -67.7 -32.8 18.7 35.4 99.7 249 250 A I H < S+ 0 0 15 -4,-1.8 4,-0.3 -5,-0.2 -1,-0.2 0.888 127.7 28.9 -80.5 -39.6 15.4 36.2 101.2 250 251 A Y H X>S+ 0 0 0 -4,-2.8 4,-1.7 -5,-0.2 5,-1.4 0.583 90.0 88.8-101.4 -12.0 13.5 37.1 98.1 251 252 A D T <5S+ 0 0 92 -4,-2.3 -1,-0.1 -5,-0.3 -3,-0.1 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-3,-2.0 2,-2.2 -4,-0.2 3,-0.2 -0.894 84.3-129.5-105.0 129.7 -4.9 64.4 134.7 343 47 B P > + 0 0 61 0, 0.0 3,-2.1 0, 0.0 4,-0.2 -0.411 39.1 162.9 -77.7 71.5 -6.8 67.6 135.0 344 48 B V G > + 0 0 7 -2,-2.2 3,-2.5 -5,-0.3 4,-0.2 0.781 66.7 72.4 -60.9 -27.5 -4.3 69.6 137.1 345 49 B S G > S+ 0 0 69 1,-0.3 3,-1.5 -3,-0.2 4,-0.3 0.750 83.5 69.5 -60.9 -21.5 -6.0 72.8 136.2 346 50 B N G < S+ 0 0 108 -3,-2.1 4,-0.3 1,-0.3 -1,-0.3 0.597 93.0 61.1 -70.9 -7.8 -8.8 71.7 138.6 347 51 B D G <> S+ 0 0 0 -3,-2.5 4,-2.4 -4,-0.2 137,-0.3 0.548 73.8 95.4 -93.9 -5.6 -6.3 72.3 141.3 348 52 B I H <> S+ 0 0 70 -3,-1.5 4,-2.3 1,-0.2 5,-0.2 0.900 84.4 49.5 -54.3 -45.0 -5.8 76.0 140.6 349 53 B Q H > S+ 0 0 173 -4,-0.3 4,-1.0 1,-0.2 -1,-0.2 0.929 113.1 44.7 -61.0 -45.5 -8.3 77.1 143.3 350 54 B S H > S+ 0 0 17 -4,-0.3 4,-1.2 1,-0.2 -1,-0.2 0.835 111.2 54.9 -70.1 -29.7 -6.8 74.9 146.0 351 55 B W H >< S+ 0 0 7 -4,-2.4 3,-0.6 1,-0.2 -1,-0.2 0.943 107.7 48.3 -64.4 -48.6 -3.3 76.0 145.1 352 56 B N H 3< S+ 0 0 113 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.744 109.9 55.4 -64.1 -21.7 -4.2 79.7 145.4 353 57 B K H 3< S+ 0 0 142 -4,-1.0 -1,-0.3 -5,-0.2 -2,-0.2 0.763 88.6 99.6 -79.2 -28.6 -5.8 78.7 148.8 354 58 B M S << S- 0 0 8 -4,-1.2 -3,-0.0 -3,-0.6 129,-0.0 -0.201 81.0-107.5 -60.3 149.6 -2.5 77.2 150.0 355 59 B T > - 0 0 52 1,-0.1 4,-2.6 4,-0.0 5,-0.3 -0.314 28.0-107.0 -75.7 161.0 -0.3 79.2 152.3 356 60 B P H > S+ 0 0 103 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.893 123.5 50.8 -52.6 -38.2 3.0 80.8 151.2 357 61 B Q H > S+ 0 0 84 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.869 109.2 48.7 -70.4 -36.5 4.7 78.1 153.3 358 62 B E H > S+ 0 0 22 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.900 112.9 48.1 -70.5 -38.8 2.8 75.2 151.7 359 63 B Q H X S+ 0 0 31 -4,-2.6 4,-2.7 2,-0.2 -2,-0.2 0.896 111.9 49.5 -69.1 -37.8 3.5 76.6 148.2 360 64 B L H X S+ 0 0 81 -4,-2.2 4,-2.4 -5,-0.3 5,-0.2 0.940 112.6 46.7 -66.1 -45.1 7.2 77.0 148.9 361 65 B A H X S+ 0 0 4 -4,-2.1 4,-2.9 2,-0.2 5,-0.3 0.895 112.3 51.3 -63.8 -39.1 7.5 73.5 150.3 362 66 B T H X S+ 0 0 2 -4,-2.2 4,-2.5 2,-0.2 5,-0.3 0.960 110.2 48.7 -63.2 -49.9 5.5 72.1 147.3 363 67 B M H X S+ 0 0 4 -4,-2.7 4,-1.6 1,-0.2 -2,-0.2 0.926 116.9 42.0 -55.1 -48.9 7.8 73.9 144.8 364 68 B R H X S+ 0 0 80 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.943 114.4 48.4 -66.5 -47.6 11.0 72.7 146.5 365 69 B V H X S+ 0 0 0 -4,-2.9 4,-2.3 1,-0.2 -2,-0.2 0.924 113.4 48.2 -58.8 -44.7 9.9 69.1 147.2 366 70 B F H X S+ 0 0 0 -4,-2.5 4,-2.3 -5,-0.3 -1,-0.2 0.830 109.8 52.0 -68.2 -33.0 8.7 68.6 143.6 367 71 B T H X S+ 0 0 0 -4,-1.6 4,-2.1 -5,-0.3 -1,-0.2 0.860 108.4 51.8 -70.4 -33.2 11.9 70.0 142.2 368 72 B G H X S+ 0 0 0 -4,-2.1 4,-1.8 2,-0.2 -2,-0.2 0.909 110.8 47.5 -67.4 -41.3 13.8 67.6 144.3 369 73 B L H X S+ 0 0 3 -4,-2.3 4,-2.4 2,-0.2 5,-0.2 0.905 108.9 54.9 -64.6 -42.6 11.7 64.7 143.0 370 74 B T H X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 -352,-0.4 0.942 106.5 52.3 -55.6 -45.5 12.2 66.0 139.4 371 75 B L H X S+ 0 0 0 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.926 109.3 48.0 -59.4 -45.0 16.0 65.9 139.9 372 76 B L H X S+ 0 0 1 -4,-1.8 4,-3.0 1,-0.2 -1,-0.2 0.905 113.1 47.8 -64.2 -38.3 15.9 62.3 141.1 373 77 B D H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.825 109.1 54.1 -69.9 -35.5 13.7 61.2 138.1 374 78 B T H X S+ 0 0 11 -4,-2.5 4,-2.2 -5,-0.2 5,-0.3 0.947 114.2 42.9 -60.8 -46.3 16.0 63.1 135.7 375 79 B I H X>S+ 0 0 5 -4,-2.3 5,-2.5 -5,-0.2 4,-2.1 0.923 115.3 47.5 -64.2 -49.3 18.9 61.1 137.2 376 80 B Q H <>S+ 0 0 0 -4,-3.0 5,-2.7 3,-0.2 6,-0.5 0.884 115.4 45.6 -65.5 -35.3 17.1 57.8 137.2 377 81 B G H <5S+ 0 0 0 -4,-2.4 -2,-0.2 27,-0.2 -1,-0.2 0.906 122.9 30.4 -77.2 -37.9 15.8 58.2 133.7 378 82 B T H <5S+ 0 0 21 -4,-2.2 -2,-0.2 -5,-0.2 -3,-0.2 0.635 140.3 7.9 -98.0 -13.6 19.0 59.3 131.9 379 83 B V T X5S+ 0 0 36 -4,-2.1 4,-1.8 -5,-0.3 -3,-0.2 0.656 120.5 53.2-130.0 -48.3 21.6 57.6 134.0 380 84 B G H >>4 S+ 0 0 25 -6,-0.5 3,-1.2 1,-0.3 -1,-0.3 0.893 98.9 60.5 -60.8 -37.4 20.4 53.0 131.8 383 87 B S H 3< S+ 0 0 14 -4,-1.8 -1,-0.3 -3,-0.5 4,-0.2 0.680 98.3 59.8 -65.4 -16.9 23.4 51.9 133.9 384 88 B L H X< S+ 0 0 0 -3,-1.3 3,-1.1 -4,-0.7 -1,-0.2 0.701 83.2 82.5 -84.5 -20.3 21.6 48.6 134.7 385 89 B L G X< S+ 0 0 8 -3,-1.2 3,-1.8 -4,-0.6 -1,-0.2 0.904 85.1 53.9 -52.3 -51.6 21.3 47.4 131.1 386 90 B P G 3 S+ 0 0 106 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.725 109.8 48.7 -58.1 -23.1 24.9 46.0 130.7 387 91 B D G < S+ 0 0 46 -3,-1.1 -2,-0.2 -4,-0.2 -3,-0.1 0.193 81.1 138.4-103.8 16.8 24.6 43.8 133.8 388 92 B A < - 0 0 24 -3,-1.8 3,-0.1 1,-0.1 -3,-0.1 -0.327 48.6-148.6 -67.3 141.4 21.2 42.2 132.9 389 93 B E S S+ 0 0 104 1,-0.1 2,-0.3 -2,-0.0 -1,-0.1 0.802 82.4 22.1 -74.8 -33.3 20.6 38.5 133.6 390 94 B T S > S- 0 0 17 1,-0.1 4,-1.3 -68,-0.0 -1,-0.1 -0.921 73.6-121.0-134.5 162.8 18.1 38.3 130.6 391 95 B M H > S+ 0 0 45 -2,-0.3 4,-1.8 1,-0.2 5,-0.1 0.851 114.4 57.4 -69.5 -31.8 17.3 40.1 127.4 392 96 B H H > S+ 0 0 8 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.850 102.0 55.8 -70.4 -30.5 13.7 40.7 128.7 393 97 B E H > S+ 0 0 1 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.888 103.9 54.5 -63.6 -41.1 15.2 42.4 131.7 394 98 B E H X S+ 0 0 50 -4,-1.3 4,-1.4 1,-0.2 -2,-0.2 0.950 107.9 50.0 -57.9 -44.6 17.0 44.8 129.3 395 99 B A H X S+ 0 0 4 -4,-1.8 4,-1.5 1,-0.2 3,-0.4 0.908 107.2 53.8 -59.9 -44.3 13.7 45.6 127.7 396 100 B V H X S+ 0 0 0 -4,-2.1 4,-2.5 1,-0.2 3,-0.4 0.928 104.4 55.3 -58.3 -43.8 12.1 46.3 131.0 397 101 B Y H X S+ 0 0 1 -4,-2.4 4,-2.9 1,-0.2 -1,-0.2 0.844 102.3 56.4 -60.9 -32.6 14.9 48.8 131.9 398 102 B T H X S+ 0 0 2 -4,-1.4 4,-1.9 -3,-0.4 -293,-0.4 0.886 108.9 47.2 -65.9 -35.3 14.1 50.8 128.6 399 103 B N H X S+ 0 0 1 -4,-1.5 4,-3.0 -3,-0.4 5,-0.2 0.929 111.5 50.5 -68.0 -42.1 10.5 51.1 129.8 400 104 B I H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 5,-0.2 0.955 109.5 51.3 -61.0 -46.5 11.7 52.2 133.3 401 105 B A H X S+ 0 0 3 -4,-2.9 4,-1.3 1,-0.2 -1,-0.2 0.930 112.7 45.4 -54.3 -49.0 14.0 54.8 131.7 402 106 B F H X S+ 0 0 0 -4,-1.9 4,-1.7 -301,-0.4 3,-0.4 0.938 111.6 50.9 -62.0 -47.7 11.2 56.2 129.7 403 107 B M H X S+ 0 0 0 -4,-3.0 4,-2.6 1,-0.3 -1,-0.2 0.824 104.4 57.8 -64.7 -29.0 8.7 56.3 132.5 404 108 B E H X S+ 0 0 0 -4,-2.4 4,-2.7 -5,-0.2 -1,-0.3 0.881 105.8 50.6 -65.1 -36.7 11.2 58.1 134.7 405 109 B S H X S+ 0 0 8 -4,-1.3 4,-2.3 -3,-0.4 -2,-0.2 0.862 109.4 50.7 -67.3 -33.8 11.3 60.8 132.0 406 110 B V H X S+ 0 0 0 -4,-1.7 4,-1.9 2,-0.2 -2,-0.2 0.927 110.6 49.5 -66.7 -42.8 7.5 60.9 132.1 407 111 B H H X S+ 0 0 0 -4,-2.6 4,-1.0 1,-0.2 -2,-0.2 0.948 111.5 48.8 -59.1 -48.4 7.6 61.3 135.9 408 112 B A H >X S+ 0 0 2 -4,-2.7 4,-0.9 1,-0.2 3,-0.7 0.935 111.5 48.9 -60.0 -43.2 10.1 64.1 135.7 409 113 B K H 3X S+ 0 0 13 -4,-2.3 4,-2.0 1,-0.2 3,-0.4 0.825 98.3 69.9 -66.8 -29.6 8.0 65.9 133.1 410 114 B S H 3X S+ 0 0 0 -4,-1.9 4,-2.2 1,-0.3 -1,-0.2 0.859 95.1 54.4 -56.0 -38.4 4.9 65.6 135.2 411 115 B Y H - 0 0 51 1,-0.1 4,-2.2 -2,-0.1 5,-0.2 -0.496 32.4-113.4 -83.1 158.4 4.4 81.6 138.5 421 125 B T H > S+ 0 0 78 1,-0.2 4,-3.4 2,-0.2 5,-0.2 0.919 117.8 52.5 -58.0 -44.0 7.5 81.7 136.4 422 126 B P H > S+ 0 0 69 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.905 108.3 50.6 -60.7 -39.5 9.5 83.3 139.2 423 127 B Q H > S+ 0 0 43 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.937 113.0 46.9 -63.2 -42.4 8.4 80.5 141.6 424 128 B I H X S+ 0 0 3 -4,-2.2 4,-2.3 2,-0.2 5,-0.2 0.959 113.5 47.0 -62.7 -50.3 9.5 78.0 139.0 425 129 B N H X S+ 0 0 79 -4,-3.4 4,-2.1 1,-0.2 -1,-0.2 0.906 113.0 49.4 -57.6 -45.6 12.9 79.7 138.4 426 130 B E H X S+ 0 0 121 -4,-2.9 4,-2.7 -5,-0.2 -1,-0.2 0.863 109.6 52.6 -63.0 -36.6 13.5 80.1 142.2 427 131 B A H X S+ 0 0 4 -4,-2.1 4,-2.2 -5,-0.2 -2,-0.2 0.929 110.5 45.7 -65.4 -47.5 12.7 76.4 142.8 428 132 B F H X S+ 0 0 15 -4,-2.3 4,-1.3 2,-0.2 -2,-0.2 0.894 114.1 49.8 -65.3 -36.1 15.1 75.2 140.1 429 133 B R H X S+ 0 0 153 -4,-2.1 4,-1.6 -5,-0.2 3,-0.4 0.938 109.6 51.2 -66.1 -43.7 17.8 77.6 141.5 430 134 B W H X S+ 0 0 28 -4,-2.7 4,-1.8 1,-0.2 -2,-0.2 0.904 106.8 54.8 -58.4 -40.8 17.2 76.3 145.0 431 135 B S H < S+ 0 0 0 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.814 107.5 50.2 -64.7 -30.0 17.6 72.7 143.8 432 136 B E H < S+ 0 0 66 -4,-1.3 -1,-0.2 -3,-0.4 -2,-0.2 0.823 117.5 39.5 -76.9 -30.3 21.0 73.6 142.3 433 137 B E H < S+ 0 0 116 -4,-1.6 2,-0.6 -3,-0.1 -2,-0.2 0.583 84.5 107.5 -97.3 -10.9 22.2 75.2 145.6 434 138 B N X - 0 0 13 -4,-1.8 4,-2.4 -5,-0.2 5,-0.3 -0.558 55.9-155.5 -76.2 117.7 20.8 72.9 148.2 435 139 B E H > S+ 0 0 104 -2,-0.6 4,-1.8 1,-0.2 -1,-0.2 0.829 89.1 49.0 -61.6 -35.0 23.6 71.0 149.6 436 140 B N H > S+ 0 0 5 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.898 112.0 48.0 -75.1 -38.8 21.6 67.9 150.8 437 141 B L H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.939 114.6 46.0 -66.9 -40.8 19.8 67.5 147.5 438 142 B Q H X S+ 0 0 13 -4,-2.4 4,-2.7 1,-0.2 5,-0.2 0.871 111.7 53.4 -69.1 -34.0 23.0 67.7 145.6 439 143 B R H X S+ 0 0 91 -4,-1.8 4,-2.5 -5,-0.3 5,-0.3 0.945 109.5 45.5 -68.0 -44.1 24.7 65.4 148.0 440 144 B K H X S+ 0 0 2 -4,-2.4 4,-2.1 1,-0.2 5,-0.2 0.936 114.6 50.9 -66.6 -36.6 22.1 62.7 147.6 441 145 B A H X S+ 0 0 2 -4,-2.3 4,-2.5 -5,-0.2 -2,-0.2 0.928 113.8 42.7 -62.7 -45.3 22.2 63.1 143.8 442 146 B K H X S+ 0 0 19 -4,-2.7 4,-1.8 2,-0.2 -1,-0.2 0.852 109.9 55.7 -73.9 -32.2 26.0 62.8 143.6 443 147 B I H X S+ 0 0 1 -4,-2.5 4,-1.0 -5,-0.2 -1,-0.2 0.954 112.9 43.7 -61.9 -46.6 26.2 59.9 146.0 444 148 B I H >X S+ 0 0 1 -4,-2.1 4,-1.7 -5,-0.3 3,-0.8 0.947 113.3 49.7 -64.3 -46.3 23.8 58.0 143.8 445 149 B M H 3X S+ 0 0 21 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.791 99.1 67.8 -65.7 -25.8 25.5 59.0 140.6 446 150 B S H 3< S+ 0 0 15 -4,-1.8 4,-0.3 1,-0.2 -1,-0.2 0.904 105.6 42.5 -60.2 -37.2 28.9 58.0 141.9 447 151 B Y H X< S+ 0 0 13 -4,-1.0 3,-1.1 -3,-0.8 5,-0.3 0.897 110.9 53.2 -76.7 -38.7 27.7 54.4 141.9 448 152 B Y H 3< S+ 0 0 7 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.848 112.1 47.1 -63.7 -32.2 26.0 54.6 138.5 449 153 B N T 3< S+ 0 0 94 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.518 103.4 85.0 -84.5 -5.3 29.2 55.9 137.1 450 154 B G S < S- 0 0 25 -3,-1.1 -3,-0.1 -4,-0.3 -4,-0.0 0.042 84.6-116.2 -83.3-166.8 31.2 53.2 138.8 451 155 B D S S+ 0 0 158 1,-0.0 -3,-0.1 5,-0.0 -4,-0.1 0.308 78.1 102.3-121.5 14.7 32.0 49.7 137.7 452 156 B D > - 0 0 40 -5,-0.3 4,-1.5 1,-0.2 3,-0.1 -0.849 51.5-162.9-103.3 107.3 30.2 47.6 140.4 453 157 B P H > S+ 0 0 48 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.837 88.5 50.5 -55.9 -39.9 26.9 46.2 139.0 454 158 B L H > S+ 0 0 17 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.891 106.5 54.2 -70.5 -38.2 25.4 45.3 142.4 455 159 B K H > S+ 0 0 33 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.856 104.0 56.6 -62.2 -35.8 26.1 48.7 143.8 456 160 B K H X S+ 0 0 26 -4,-1.5 4,-2.3 1,-0.2 -1,-0.2 0.902 108.7 46.9 -62.4 -38.5 24.2 50.2 141.0 457 161 B K H X S+ 0 0 10 -4,-1.3 4,-2.5 2,-0.2 -2,-0.2 0.892 112.3 49.0 -72.5 -39.3 21.2 48.1 141.9 458 162 B V H X S+ 0 0 0 -4,-2.3 4,-2.7 2,-0.2 5,-0.3 0.958 113.5 46.7 -61.4 -50.0 21.4 49.0 145.6 459 163 B A H X S+ 0 0 0 -4,-2.8 4,-2.2 1,-0.2 -2,-0.2 0.938 114.0 48.7 -57.8 -43.5 21.7 52.7 144.8 460 164 B S H X S+ 0 0 0 -4,-2.3 4,-2.8 -5,-0.2 -1,-0.2 0.908 112.0 47.9 -63.4 -43.2 18.8 52.4 142.4 461 165 B T H X S+ 0 0 0 -4,-2.5 4,-2.9 2,-0.2 5,-0.3 0.903 112.1 48.4 -68.7 -36.8 16.6 50.6 144.9 462 166 B L H X>S+ 0 0 0 -4,-2.7 5,-2.2 2,-0.2 4,-1.5 0.876 112.7 50.1 -70.7 -32.2 17.4 53.1 147.7 463 167 B L H <>S+ 0 0 0 -4,-2.2 5,-0.7 -5,-0.3 -2,-0.2 0.942 118.1 38.8 -68.5 -45.0 16.6 55.9 145.3 464 168 B E H <5S+ 0 0 0 -4,-2.8 -2,-0.2 1,-0.2 -3,-0.2 0.860 126.5 32.2 -74.8 -37.0 13.3 54.3 144.2 465 169 B S H <5S+ 0 0 7 -4,-2.9 102,-0.3 -5,-0.2 -3,-0.2 0.573 135.8 15.5-100.2 -8.3 12.1 53.0 147.6 466 170 B F T >X5S+ 0 0 0 -4,-1.5 3,-1.3 -5,-0.3 4,-0.5 0.705 110.9 58.7-126.8 -54.6 13.5 55.6 149.9 467 171 B L T 34> S+ 0 0 19 -3,-1.3 4,-1.5 1,-0.3 -2,-0.2 0.842 79.5 64.0 -66.3 -29.0 9.5 59.6 150.0 470 174 B S H 3< S+ 0 0 2 -4,-0.5 4,-0.3 1,-0.2 -1,-0.3 0.787 115.6 40.2 -59.9 -19.0 10.5 62.8 151.9 471 175 B G H X4 S+ 0 0 1 -3,-1.6 3,-0.6 -4,-0.1 -2,-0.2 0.804 105.9 58.2 -96.2 -38.9 8.8 64.3 148.8 472 176 B F H 3X S+ 0 0 0 -4,-1.9 4,-1.4 1,-0.2 5,-0.2 0.706 93.7 73.5 -65.6 -19.9 5.7 62.1 148.3 473 177 B Y H 3X S+ 0 0 3 -4,-1.5 4,-2.7 1,-0.2 -1,-0.2 0.938 89.7 57.3 -58.5 -48.6 4.6 63.0 151.9 474 178 B L H <> S+ 0 0 0 -3,-0.6 4,-3.0 -4,-0.3 5,-0.3 0.909 107.8 42.1 -55.3 -50.6 3.6 66.5 151.0 475 179 B P H > S+ 0 0 0 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.865 115.1 51.8 -69.7 -28.4 1.0 65.8 148.2 476 180 B M H X S+ 0 0 0 -4,-1.4 4,-1.0 2,-0.2 -2,-0.2 0.891 113.9 44.6 -70.1 -39.7 -0.4 62.9 150.3 477 181 B Y H >< S+ 0 0 44 -4,-2.7 3,-1.0 -5,-0.2 4,-0.5 0.983 115.9 46.2 -63.3 -57.5 -0.8 65.2 153.3 478 182 B L H ><>S+ 0 0 0 -4,-3.0 5,-2.3 1,-0.3 3,-1.5 0.865 108.5 55.6 -54.6 -41.3 -2.3 68.0 151.2 479 183 B S H ><5S+ 0 0 16 -4,-2.4 3,-1.2 1,-0.3 -1,-0.3 0.797 100.0 59.0 -68.1 -25.2 -4.7 65.8 149.3 480 184 B S T <<5S+ 0 0 50 -3,-1.0 -1,-0.3 -4,-1.0 -2,-0.2 0.626 106.9 50.9 -75.0 -10.0 -6.2 64.6 152.6 481 185 B R T < 5S- 0 0 108 -3,-1.5 -1,-0.3 -4,-0.5 -2,-0.2 -0.050 125.2-100.4-114.1 29.3 -7.0 68.2 153.3 482 186 B A T < 5S+ 0 0 67 -3,-1.2 2,-0.4 1,-0.2 -3,-0.2 0.771 84.7 126.0 58.0 31.9 -8.7 68.9 149.9 483 187 B K S S+ 0 0 0 -2,-0.4 4,-1.6 -137,-0.3 -1,-0.2 0.909 76.5 158.9 52.1 48.6 -3.9 69.5 145.2 485 189 B T H > S+ 0 0 61 2,-0.2 4,-0.6 -3,-0.2 -1,-0.1 0.851 71.7 44.1 -72.4 -31.7 -6.2 66.5 144.8 486 190 B 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100.6 54.9 -68.4 -34.1 5.9 -5.6 76.7 690 97 C E H > S+ 0 0 1 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.890 105.6 53.8 -65.0 -38.4 4.3 -4.0 73.7 691 98 C E H X S+ 0 0 40 -4,-1.3 4,-1.7 1,-0.2 -2,-0.2 0.921 105.4 52.1 -61.2 -45.2 3.1 -1.2 76.0 692 99 C A H X S+ 0 0 3 -4,-1.9 4,-1.5 1,-0.2 -1,-0.2 0.916 107.9 53.2 -58.0 -42.8 6.6 -0.6 77.3 693 100 C V H X S+ 0 0 0 -4,-2.0 4,-2.4 1,-0.2 3,-0.3 0.913 104.4 54.1 -60.1 -44.3 7.8 -0.3 73.7 694 101 C Y H X S+ 0 0 0 -4,-2.0 4,-2.8 1,-0.2 -1,-0.2 0.857 104.4 55.8 -60.0 -34.1 5.2 2.3 72.8 695 102 C T H X S+ 0 0 0 -4,-1.7 4,-1.8 -3,-0.2 301,-0.4 0.877 107.9 48.3 -67.8 -32.0 6.5 4.4 75.8 696 103 C N H X S+ 0 0 2 -4,-1.5 4,-2.6 -3,-0.3 -2,-0.2 0.922 110.8 50.8 -69.3 -42.6 9.9 4.3 74.2 697 104 C I H X S+ 0 0 0 -4,-2.4 4,-2.2 2,-0.2 5,-0.2 0.932 108.3 52.4 -60.1 -44.9 8.5 5.3 70.8 698 105 C A H X S+ 0 0 0 -4,-2.8 4,-1.5 1,-0.2 -1,-0.2 0.931 111.4 47.1 -56.6 -47.0 6.7 8.3 72.4 699 106 C F H X S+ 0 0 0 -4,-1.8 4,-1.7 293,-0.4 3,-0.3 0.947 111.6 49.2 -59.7 -50.3 9.8 9.5 74.0 700 107 C M H X S+ 0 0 1 -4,-2.6 4,-2.8 1,-0.2 -1,-0.2 0.810 104.6 58.6 -64.6 -29.5 12.0 9.2 70.9 701 108 C E H X S+ 0 0 0 -4,-2.2 4,-2.7 1,-0.2 -1,-0.2 0.899 106.3 50.0 -64.8 -37.0 9.4 11.0 68.8 702 109 C S H X S+ 0 0 8 -4,-1.5 4,-2.2 -3,-0.3 -2,-0.2 0.877 109.7 50.5 -64.4 -36.5 9.9 13.9 71.2 703 110 C V H X S+ 0 0 0 -4,-1.7 4,-2.4 2,-0.2 -2,-0.2 0.935 110.5 50.3 -64.5 -44.5 13.7 13.5 70.7 704 111 C H H X S+ 0 0 0 -4,-2.8 4,-1.1 1,-0.2 -2,-0.2 0.942 111.6 47.1 -58.0 -47.6 13.1 13.6 66.9 705 112 C A H >X S+ 0 0 0 -4,-2.7 4,-0.9 1,-0.2 3,-0.6 0.917 111.3 51.1 -65.1 -38.0 11.0 16.8 67.1 706 113 C K H >X S+ 0 0 13 -4,-2.2 4,-1.7 1,-0.2 3,-0.8 0.888 99.0 66.2 -67.3 -33.5 13.5 18.5 69.3 707 114 C S H 3X S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.3 -1,-0.2 0.837 95.4 56.4 -58.7 -34.1 16.3 17.7 66.9 708 115 C Y H - 0 0 52 -2,-0.1 4,-2.3 1,-0.1 5,-0.2 -0.535 32.4-113.6 -84.5 157.4 17.7 33.3 62.2 718 125 C T H > S+ 0 0 75 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.830 119.1 54.5 -61.4 -33.7 15.0 33.7 64.8 719 126 C P H > S+ 0 0 76 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.945 108.3 49.9 -64.9 -42.9 12.8 35.5 62.2 720 127 C Q H > S+ 0 0 39 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.903 111.8 48.7 -60.1 -43.3 13.2 32.5 59.9 721 128 C I H X S+ 0 0 2 -4,-2.3 4,-2.3 2,-0.2 5,-0.3 0.955 112.0 46.9 -63.1 -50.1 12.2 30.2 62.7 722 129 C N H X S+ 0 0 83 -4,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.907 111.7 52.3 -60.3 -37.7 9.2 32.2 63.7 723 130 C E H X S+ 0 0 118 -4,-2.6 4,-2.8 -5,-0.2 -1,-0.2 0.901 108.6 50.7 -64.1 -40.1 8.1 32.4 60.1 724 131 C A H X S+ 0 0 4 -4,-2.0 4,-2.3 -5,-0.2 -1,-0.2 0.924 110.9 46.7 -66.3 -43.1 8.4 28.7 59.7 725 132 C F H X S+ 0 0 16 -4,-2.3 4,-1.4 2,-0.2 -2,-0.2 0.907 112.8 50.8 -67.2 -37.1 6.3 27.9 62.7 726 133 C R H X S+ 0 0 168 -4,-2.5 4,-1.2 -5,-0.3 3,-0.5 0.943 109.6 50.4 -61.4 -47.0 3.7 30.5 61.6 727 134 C W H >X S+ 0 0 28 -4,-2.8 4,-1.8 1,-0.2 3,-0.6 0.920 107.0 55.3 -56.1 -42.9 3.6 28.9 58.1 728 135 C S H 3< S+ 0 0 0 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.818 106.5 50.0 -63.6 -31.3 3.1 25.4 59.7 729 136 C E H 3< S+ 0 0 70 -4,-1.4 -1,-0.2 -3,-0.5 -2,-0.2 0.741 118.9 37.7 -77.6 -22.5 -0.0 26.6 61.6 730 137 C E H << S+ 0 0 120 -4,-1.2 2,-0.5 -3,-0.6 -2,-0.2 0.561 83.8 108.8-106.9 -10.1 -1.6 28.1 58.6 731 138 C N X - 0 0 22 -4,-1.8 4,-2.6 -5,-0.2 5,-0.3 -0.554 57.5-151.5 -75.0 118.5 -0.8 25.7 55.8 732 139 C E H > S+ 0 0 152 -2,-0.5 4,-2.4 1,-0.2 -1,-0.2 0.860 90.7 47.9 -58.1 -38.4 -3.9 23.9 54.9 733 140 C N H > S+ 0 0 5 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.870 113.1 47.2 -74.0 -37.2 -2.4 20.7 53.7 734 141 C L H > S+ 0 0 0 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.958 115.4 46.2 -67.8 -45.8 -0.1 20.3 56.7 735 142 C Q H X S+ 0 0 14 -4,-2.6 4,-2.7 1,-0.2 -2,-0.2 0.897 112.4 51.9 -62.0 -39.4 -3.0 21.0 59.0 736 143 C R H X S+ 0 0 79 -4,-2.4 4,-2.7 -5,-0.3 5,-0.3 0.927 109.8 46.7 -64.0 -46.9 -5.3 18.6 57.1 737 144 C K H X S+ 0 0 3 -4,-2.2 4,-2.1 1,-0.2 5,-0.2 0.929 113.9 49.7 -64.6 -38.7 -2.9 15.7 57.3 738 145 C A H X S+ 0 0 0 -4,-2.3 4,-2.5 -5,-0.2 -2,-0.2 0.935 114.4 44.1 -63.8 -46.2 -2.3 16.3 61.0 739 146 C K H X S+ 0 0 22 -4,-2.7 4,-2.0 2,-0.2 -2,-0.2 0.884 109.8 54.6 -68.3 -35.6 -6.0 16.4 61.7 740 147 C I H X S+ 0 0 1 -4,-2.7 4,-1.0 -5,-0.2 -2,-0.2 0.967 114.1 42.0 -62.2 -48.2 -6.9 13.4 59.6 741 148 C I H >X S+ 0 0 0 -4,-2.1 4,-1.8 -5,-0.3 3,-1.0 0.951 113.5 51.2 -64.2 -46.7 -4.4 11.3 61.5 742 149 C M H 3X S+ 0 0 23 -4,-2.5 4,-2.3 1,-0.3 -1,-0.2 0.811 98.8 68.2 -59.8 -28.6 -5.3 12.7 64.9 743 150 C S H 3< S+ 0 0 14 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.888 105.1 41.1 -59.5 -37.7 -9.0 12.0 64.1 744 151 C Y H X< S+ 0 0 22 -3,-1.0 3,-1.8 -4,-1.0 5,-0.3 0.891 110.3 55.9 -77.8 -38.2 -8.2 8.3 64.3 745 152 C Y H 3< S+ 0 0 7 -4,-1.8 -2,-0.2 1,-0.3 -1,-0.2 0.866 111.0 46.9 -59.9 -34.2 -5.9 8.6 67.3 746 153 C N T 3< S+ 0 0 94 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.413 103.5 86.2 -87.2 4.6 -8.8 10.2 69.1 747 154 C G S < S- 0 0 35 -3,-1.8 -3,-0.1 2,-0.1 6,-0.0 -0.107 82.3-118.5 -91.7-171.3 -11.2 7.5 67.9 748 155 C D S S+ 0 0 156 -2,-0.0 -3,-0.1 4,-0.0 -4,-0.1 0.275 77.8 102.8-118.2 14.6 -12.1 4.1 69.3 749 156 C D > - 0 0 33 -5,-0.3 4,-1.3 1,-0.2 -2,-0.1 -0.873 52.5-163.4-100.4 112.1 -11.0 1.8 66.6 750 157 C P H > S+ 0 0 49 0, 0.0 4,-1.3 0, 0.0 3,-0.3 0.912 87.3 49.0 -57.8 -50.3 -7.7 0.1 67.6 751 158 C L H > S+ 0 0 20 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.881 106.3 56.0 -63.9 -38.1 -6.7 -1.1 64.1 752 159 C K H > S+ 0 0 41 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.850 103.8 56.0 -63.4 -29.9 -7.4 2.3 62.5 753 160 C K H X S+ 0 0 18 -4,-1.3 4,-2.3 -3,-0.3 -1,-0.2 0.884 108.2 47.5 -67.5 -36.4 -4.9 3.9 64.9 754 161 C K H X S+ 0 0 10 -4,-1.3 4,-2.1 2,-0.2 -1,-0.2 0.837 112.0 49.0 -73.9 -33.4 -2.2 1.5 63.8 755 162 C V H X S+ 0 0 0 -4,-2.0 4,-2.6 2,-0.2 5,-0.3 0.950 112.1 49.1 -68.6 -46.8 -3.0 2.1 60.1 756 163 C A H X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.922 113.0 47.7 -56.8 -46.1 -2.9 5.9 60.7 757 164 C S H X S+ 0 0 0 -4,-2.3 4,-2.9 1,-0.2 -1,-0.2 0.893 111.4 49.5 -64.1 -41.2 0.4 5.6 62.6 758 165 C T H X S+ 0 0 0 -4,-2.1 4,-3.1 2,-0.2 5,-0.4 0.892 112.5 46.9 -68.3 -36.5 2.0 3.4 59.9 759 166 C L H X>S+ 0 0 0 -4,-2.6 5,-2.6 2,-0.2 4,-1.8 0.909 112.1 51.5 -72.0 -34.8 1.0 5.7 57.1 760 167 C L H <>S+ 0 0 1 -4,-2.4 5,-3.0 -5,-0.3 6,-0.3 0.959 119.9 35.9 -64.2 -44.8 2.3 8.7 59.2 761 168 C E H <>S+ 0 0 0 -4,-2.9 5,-1.0 3,-0.2 -2,-0.2 0.956 126.7 32.4 -75.3 -46.7 5.6 7.0 59.7 762 169 C S H <5S+ 0 0 5 -4,-3.1 102,-0.3 -5,-0.2 -3,-0.2 0.687 135.0 21.0 -86.4 -21.1 6.2 5.1 56.5 763 170 C F T X5S+ 0 0 0 -4,-1.8 4,-1.6 -5,-0.4 -3,-0.2 0.774 127.6 36.3-111.0 -57.2 4.6 7.5 54.1 764 171 C L H >44< S+ 0 0 3 -4,-1.6 3,-1.1 1,-0.3 -1,-0.3 0.803 96.8 61.3 -62.2 -25.4 8.6 11.5 52.3 768 175 C G T << S+ 0 0 9 -3,-1.4 3,-0.4 -4,-0.7 -1,-0.3 0.593 86.8 74.6 -77.7 -8.0 10.1 14.5 54.1 769 176 C F T <> S+ 0 0 0 -3,-1.7 4,-1.8 -4,-0.4 5,-0.2 0.481 72.1 87.2 -80.0 -4.2 13.6 13.0 54.1 770 177 C Y H <> S+ 0 0 8 -3,-1.1 4,-3.0 2,-0.2 5,-0.3 0.965 86.3 49.9 -59.0 -52.0 13.9 13.8 50.4 771 178 C L H > S+ 0 0 0 -3,-0.4 4,-2.7 -4,-0.2 5,-0.3 0.929 112.8 42.7 -58.1 -49.5 15.3 17.2 51.0 772 179 C P H > S+ 0 0 1 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.892 116.8 47.7 -67.1 -34.6 18.0 16.4 53.5 773 180 C M H X S+ 0 0 0 -4,-1.8 4,-1.8 2,-0.2 -2,-0.2 0.909 113.9 46.7 -70.7 -43.0 19.2 13.3 51.6 774 181 C Y H X S+ 0 0 52 -4,-3.0 4,-0.7 -5,-0.2 -1,-0.2 0.947 114.5 46.7 -63.9 -46.5 19.3 15.2 48.2 775 182 C L H ><>S+ 0 0 1 -4,-2.7 5,-2.5 -5,-0.3 3,-1.4 0.937 110.4 54.1 -62.1 -42.3 21.1 18.2 49.8 776 183 C S H ><5S+ 0 0 19 -4,-2.3 3,-1.9 -5,-0.3 -1,-0.2 0.873 103.0 56.1 -56.2 -40.0 23.5 15.7 51.5 777 184 C S H 3<5S+ 0 0 47 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.636 106.8 51.2 -67.7 -16.3 24.3 14.1 48.0 778 185 C R T <<5S- 0 0 124 -3,-1.4 -1,-0.3 -4,-0.7 -2,-0.2 0.062 125.4-105.4-104.0 18.1 25.3 17.6 46.9 779 186 C A T < 5S+ 0 0 75 -3,-1.9 2,-0.4 1,-0.2 -3,-0.2 0.784 81.0 127.5 63.5 29.5 27.6 18.0 49.9 780 187 C K S S+ 0 0 0 -2,-0.4 4,-2.1 -137,-0.3 -1,-0.2 0.898 75.5 162.6 53.0 46.8 23.9 20.0 55.3 782 189 C T H > S+ 0 0 59 -3,-0.2 4,-0.7 1,-0.2 -1,-0.1 0.841 70.6 45.6 -67.7 -33.8 25.9 16.8 55.8 783 190 C N H > S+ 0 0 26 2,-0.2 4,-1.3 1,-0.2 3,-0.4 0.870 109.8 54.2 -76.4 -36.4 25.8 16.8 59.6 784 191 C T H > S+ 0 0 0 1,-0.3 4,-2.4 2,-0.2 3,-0.4 0.902 104.3 57.4 -60.3 -41.7 22.1 17.6 59.5 785 192 C A H X S+ 0 0 0 -4,-2.1 4,-2.4 1,-0.3 -1,-0.3 0.829 99.6 58.1 -60.8 -28.8 21.7 14.6 57.3 786 193 C D H X S+ 0 0 68 -4,-0.7 4,-1.4 -3,-0.4 -1,-0.3 0.881 105.5 48.7 -70.1 -35.6 23.4 12.5 60.0 787 194 C I H X S+ 0 0 0 -4,-1.3 4,-2.1 -3,-0.4 3,-0.4 0.938 110.0 52.6 -65.1 -43.2 20.6 13.5 62.5 788 195 C I H X S+ 0 0 0 -4,-2.4 4,-2.8 1,-0.2 -2,-0.2 0.898 106.3 53.3 -58.8 -40.5 18.1 12.6 59.8 789 196 C R H X S+ 0 0 80 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.824 107.3 51.0 -65.5 -32.3 19.7 9.1 59.5 790 197 C L H X S+ 0 0 18 -4,-1.4 4,-1.0 -3,-0.4 -1,-0.2 0.867 111.2 49.0 -69.0 -35.8 19.4 8.6 63.2 791 198 C I H >X S+ 0 0 0 -4,-2.1 4,-3.0 1,-0.2 3,-0.7 0.931 110.9 49.8 -68.8 -43.3 15.7 9.5 62.9 792 199 C I H 3X S+ 0 0 3 -4,-2.8 4,-2.7 1,-0.2 5,-0.3 0.897 102.9 60.2 -60.2 -40.6 15.4 7.1 59.9 793 200 C R H 3X S+ 0 0 94 -4,-2.0 4,-0.6 1,-0.2 -1,-0.2 0.801 114.1 37.9 -59.0 -29.8 17.0 4.3 61.9 794 201 C D H < S+ 0 0 17 -4,-2.2 3,-0.7 1,-0.2 -2,-0.2 0.899 114.5 44.7 -65.8 -43.7 -4.7 -8.0 64.8 810 217 C V H >< S+ 0 0 3 -4,-3.0 3,-2.1 1,-0.2 -1,-0.2 0.888 104.1 64.1 -71.7 -33.4 -6.4 -7.8 61.4 811 218 C K H 3< S+ 0 0 127 -4,-2.4 -1,-0.2 -5,-0.3 -2,-0.2 0.702 96.7 60.9 -61.2 -18.2 -5.5 -11.5 60.6 812 219 C K T << S+ 0 0 127 -3,-0.7 -1,-0.3 -4,-0.6 -2,-0.2 0.518 91.1 89.0 -85.4 -8.3 -7.7 -12.5 63.5 813 220 C L S < S- 0 0 48 -3,-2.1 -3,-0.0 -4,-0.2 5,-0.0 -0.367 88.1 -83.0 -91.0 172.2 -10.9 -11.0 62.1 814 221 C S > - 0 0 65 1,-0.1 4,-2.4 -2,-0.1 5,-0.2 -0.238 44.4-106.7 -65.2 157.7 -13.6 -12.4 59.9 815 222 C E H > S+ 0 0 146 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.893 120.7 52.2 -51.2 -45.0 -13.0 -12.4 56.1 816 223 C A H > S+ 0 0 48 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.914 110.6 45.6 -62.6 -45.4 -15.5 -9.5 55.8 817 224 C E H > S+ 0 0 88 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.854 110.3 54.0 -68.5 -32.3 -13.9 -7.4 58.4 818 225 C Q H X S+ 0 0 51 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.910 110.0 48.7 -66.0 -39.5 -10.4 -8.0 56.9 819 226 C E H X S+ 0 0 114 -4,-2.3 4,-2.4 -5,-0.2 -2,-0.2 0.906 110.1 51.4 -65.2 -40.5 -11.8 -6.8 53.6 820 227 C E H X S+ 0 0 121 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.898 110.0 48.6 -64.5 -40.6 -13.3 -3.7 55.2 821 228 C Y H X S+ 0 0 34 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.847 110.1 51.7 -68.5 -36.3 -10.0 -2.8 56.9 822 229 C K H X S+ 0 0 73 -4,-1.9 4,-2.4 2,-0.2 5,-0.2 0.948 112.1 46.2 -63.9 -45.9 -8.1 -3.3 53.6 823 230 C A H X S+ 0 0 52 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.922 112.6 51.1 -61.4 -42.7 -10.6 -0.9 51.8 824 231 C Y H X S+ 0 0 17 -4,-2.7 4,-2.6 1,-0.2 -1,-0.2 0.931 109.5 51.0 -57.5 -46.6 -10.3 1.5 54.7 825 232 C T H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.919 111.9 44.7 -59.8 -47.9 -6.5 1.5 54.5 826 233 C F H X S+ 0 0 17 -4,-2.4 4,-2.7 2,-0.2 -1,-0.2 0.903 111.9 53.6 -65.8 -37.5 -6.4 2.1 50.7 827 234 C D H X S+ 0 0 91 -4,-2.5 4,-2.2 -5,-0.2 -2,-0.2 0.926 109.8 47.4 -61.5 -43.7 -9.1 4.9 51.1 828 235 C L H X S+ 0 0 4 -4,-2.6 4,-2.9 1,-0.2 5,-0.2 0.918 111.5 51.5 -65.2 -41.2 -7.0 6.6 53.7 829 236 C M H X S+ 0 0 0 -4,-2.2 4,-2.7 -5,-0.2 5,-0.2 0.908 107.9 52.1 -62.1 -42.3 -3.9 6.3 51.5 830 237 C Y H X S+ 0 0 110 -4,-2.7 4,-2.5 2,-0.2 -1,-0.2 0.931 112.6 45.3 -59.3 -45.4 -5.8 7.8 48.6 831 238 C D H X S+ 0 0 36 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.919 115.4 45.5 -64.8 -44.9 -6.8 10.8 50.7 832 239 C L H X S+ 0 0 0 -4,-2.9 4,-2.8 2,-0.2 -1,-0.2 0.878 113.4 50.8 -67.4 -35.8 -3.4 11.3 52.3 833 240 C Y H X S+ 0 0 41 -4,-2.7 4,-2.3 -5,-0.2 -2,-0.2 0.953 109.4 49.7 -65.2 -48.0 -1.7 11.0 48.8 834 241 C E H X S+ 0 0 124 -4,-2.5 4,-1.4 -5,-0.2 -2,-0.2 0.934 115.6 43.7 -56.4 -46.5 -4.0 13.5 47.2 835 242 C N H X S+ 0 0 0 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.910 111.6 53.4 -66.1 -41.5 -3.3 15.9 50.0 836 243 C E H X S+ 0 0 8 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.819 102.8 59.5 -63.7 -31.5 0.5 15.2 50.0 837 244 C I H X S+ 0 0 29 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.940 108.6 42.8 -61.8 -47.6 0.6 15.9 46.2 838 245 C E H X S+ 0 0 87 -4,-1.4 4,-2.3 2,-0.2 -2,-0.2 0.914 113.4 52.2 -67.2 -41.0 -0.6 19.5 46.8 839 246 C Y H X S+ 0 0 15 -4,-2.2 4,-1.7 1,-0.2 -1,-0.2 0.910 110.9 48.6 -58.1 -43.3 1.7 19.9 49.8 840 247 C T H X S+ 0 0 2 -4,-2.4 4,-3.0 2,-0.2 5,-0.3 0.910 107.9 53.3 -66.9 -44.8 4.6 18.8 47.7 841 248 C E H X S+ 0 0 61 -4,-2.4 4,-2.3 1,-0.2 5,-0.2 0.949 110.7 47.6 -57.4 -46.0 3.8 21.1 44.8 842 249 C D H < S+ 0 0 93 -4,-2.3 4,-0.3 1,-0.2 -1,-0.2 0.848 116.9 41.3 -70.1 -30.5 3.7 24.1 47.1 843 250 C I H < S+ 0 0 17 -4,-1.7 -1,-0.2 -5,-0.2 4,-0.2 0.873 127.9 26.7 -80.1 -36.5 7.0 23.3 48.9 844 251 C Y H X>S+ 0 0 7 -4,-3.0 5,-1.4 -5,-0.2 4,-1.4 0.589 90.1 91.1-107.4 -9.9 9.0 22.2 45.9 845 252 C D T ><5S+ 0 0 88 -4,-2.3 3,-0.6 -5,-0.3 -1,-0.1 0.903 90.6 49.4 -54.2 -47.3 7.7 23.9 42.7 846 253 C D T 345S+ 0 0 143 -4,-0.3 -1,-0.2 1,-0.3 -2,-0.1 0.831 112.9 48.2 -62.4 -33.4 10.1 26.9 43.0 847 254 C L T 345S- 0 0 29 -3,-0.4 -1,-0.3 -4,-0.2 -2,-0.2 0.698 107.2-127.7 -77.4 -22.0 13.0 24.6 43.5 848 255 C G T <<5S+ 0 0 64 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3,-0.1 -4,-0.2 -3,-0.0 -0.298 47.1-152.1 -63.2 143.0 0.2 20.4 80.1 983 93 D E S S+ 0 0 109 1,-0.1 2,-0.3 2,-0.0 -1,-0.1 0.742 82.1 26.2 -83.4 -28.6 0.8 24.1 80.3 984 94 D T S > S- 0 0 20 1,-0.1 4,-1.2 -68,-0.0 -1,-0.1 -0.922 75.5-123.7-133.0 158.2 3.5 24.0 77.7 985 95 D M H > S+ 0 0 39 -2,-0.3 4,-1.8 1,-0.2 5,-0.1 0.821 113.1 59.9 -70.4 -27.9 4.4 21.7 74.8 986 96 D H H > S+ 0 0 10 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.874 99.7 55.9 -67.6 -35.6 7.8 21.2 76.4 987 97 D E H > S+ 0 0 1 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.878 104.6 53.2 -61.3 -39.4 6.1 19.7 79.5 988 98 D E H X S+ 0 0 42 -4,-1.2 4,-1.6 2,-0.2 -1,-0.2 0.933 107.1 51.8 -62.0 -43.4 4.4 17.2 77.2 989 99 D A H X S+ 0 0 2 -4,-1.8 4,-1.7 1,-0.2 3,-0.4 0.932 107.6 52.9 -58.5 -44.6 7.8 16.2 75.8 990 100 D V H X S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.907 104.9 54.2 -58.2 -41.9 9.0 15.7 79.4 991 101 D Y H X S+ 0 0 1 -4,-2.3 4,-2.8 1,-0.2 -1,-0.2 0.843 104.0 55.8 -63.9 -30.4 6.0 13.4 80.2 992 102 D T H X S+ 0 0 1 -4,-1.6 4,-2.1 -3,-0.4 -293,-0.4 0.915 109.4 46.3 -68.8 -37.0 6.9 11.2 77.2 993 103 D N H X S+ 0 0 2 -4,-1.7 4,-2.9 2,-0.2 -2,-0.2 0.941 112.2 51.0 -65.4 -45.2 10.4 10.8 78.7 994 104 D I H X S+ 0 0 0 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.937 109.0 51.1 -58.4 -47.0 9.0 10.1 82.1 995 105 D A H X S+ 0 0 0 -4,-2.8 4,-1.5 1,-0.2 -1,-0.2 0.942 112.1 47.3 -56.2 -47.9 6.6 7.4 80.7 996 106 D F H X S+ 0 0 0 -4,-2.1 4,-1.9 -301,-0.4 3,-0.3 0.940 111.0 49.9 -60.3 -46.1 9.6 5.7 78.9 997 107 D M H X S+ 0 0 0 -4,-2.9 4,-2.7 1,-0.2 -1,-0.2 0.810 104.2 58.7 -66.5 -26.1 11.8 5.7 82.0 998 108 D E H X S+ 0 0 0 -4,-2.0 4,-2.8 2,-0.2 -1,-0.2 0.883 106.3 49.8 -67.1 -37.8 9.1 4.2 84.2 999 109 D S H X S+ 0 0 8 -4,-1.5 4,-2.6 -3,-0.3 -2,-0.2 0.882 109.9 51.0 -64.6 -38.8 9.1 1.3 81.7 1000 110 D V H X S+ 0 0 0 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.937 111.6 47.2 -62.5 -43.7 12.9 1.2 82.1 1001 111 D H H X S+ 0 0 0 -4,-2.7 4,-1.1 2,-0.2 -2,-0.2 0.935 112.5 49.2 -61.5 -48.1 12.5 1.2 86.0 1002 112 D A H >X S+ 0 0 1 -4,-2.8 4,-0.9 1,-0.2 3,-0.8 0.950 111.2 49.0 -58.4 -47.8 9.9 -1.6 85.8 1003 113 D K H >X S+ 0 0 11 -4,-2.6 4,-2.2 1,-0.2 3,-0.5 0.861 99.9 68.4 -61.5 -34.8 12.1 -3.7 83.5 1004 114 D S H 3X S+ 0 0 0 -4,-2.1 4,-2.2 1,-0.3 -1,-0.2 0.857 94.0 55.4 -52.7 -40.0 15.0 -3.3 85.8 1005 115 D Y H X S+ 0 0 1 -4,-2.2 4,-2.5 -5,-0.2 3,-1.2 0.969 115.2 45.4 -65.0 -54.0 17.4 -8.3 88.9 1009 119 D F H 3X S+ 0 0 3 -4,-3.0 4,-1.7 1,-0.3 -2,-0.2 0.855 111.1 53.5 -56.8 -40.4 15.0 -11.2 89.4 1010 120 D M H 3< S+ 0 0 91 -4,-2.9 -1,-0.3 -5,-0.2 -2,-0.2 0.645 114.0 43.0 -72.5 -14.1 16.2 -13.0 86.3 1011 121 D T H << S+ 0 0 54 -3,-1.2 -2,-0.2 -4,-0.6 -1,-0.2 0.829 129.5 20.8 -94.9 -42.0 19.8 -12.8 87.5 1012 122 D L H < S+ 0 0 19 -4,-2.5 -3,-0.2 -5,-0.1 -2,-0.2 0.846 109.2 61.3 -97.4 -43.6 19.2 -13.7 91.2 1013 123 D A S < S- 0 0 18 -4,-1.7 2,-0.2 -5,-0.3 -68,-0.0 -0.406 73.4-113.9 -92.5 167.7 16.0 -15.6 91.8 1014 124 D S > - 0 0 53 -2,-0.1 4,-2.2 1,-0.1 5,-0.2 -0.570 34.4-110.5 -90.5 159.9 14.6 -18.9 90.6 1015 125 D T H > S+ 0 0 67 1,-0.2 4,-3.4 2,-0.2 5,-0.2 0.895 119.5 54.3 -61.8 -36.3 11.5 -18.9 88.4 1016 126 D P H > S+ 0 0 76 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.901 108.0 50.7 -63.6 -37.6 9.3 -20.3 91.2 1017 127 D Q H > S+ 0 0 42 2,-0.2 4,-1.6 1,-0.2 -2,-0.2 0.950 113.0 46.3 -63.1 -44.0 10.5 -17.5 93.4 1018 128 D I H X S+ 0 0 3 -4,-2.2 4,-2.2 1,-0.2 3,-0.4 0.961 111.8 50.1 -60.7 -51.5 9.5 -15.0 90.6 1019 129 D N H X S+ 0 0 78 -4,-3.4 4,-2.2 1,-0.2 -1,-0.2 0.879 110.0 50.9 -56.7 -39.8 6.1 -16.6 89.9 1020 130 D E H X S+ 0 0 122 -4,-2.3 4,-2.2 -5,-0.2 -1,-0.2 0.837 108.5 52.6 -69.3 -30.8 5.3 -16.6 93.6 1021 131 D A H X S+ 0 0 4 -4,-1.6 4,-2.5 -3,-0.4 -2,-0.2 0.941 111.6 43.3 -69.7 -49.1 6.2 -12.8 93.9 1022 132 D F H X S+ 0 0 17 -4,-2.2 4,-1.4 2,-0.2 -2,-0.2 0.908 114.0 52.1 -64.9 -37.4 4.0 -11.7 91.0 1023 133 D R H X S+ 0 0 168 -4,-2.2 4,-1.3 -5,-0.3 3,-0.5 0.940 110.4 49.0 -62.3 -44.3 1.2 -14.0 92.3 1024 134 D W H X S+ 0 0 27 -4,-2.2 4,-2.2 1,-0.2 3,-0.4 0.914 106.0 57.0 -59.4 -42.9 1.5 -12.4 95.7 1025 135 D S H < S+ 0 0 1 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.802 106.2 50.2 -60.1 -31.7 1.4 -8.9 94.1 1026 136 D E H < S+ 0 0 69 -4,-1.4 -1,-0.2 -3,-0.5 -2,-0.2 0.805 117.5 38.9 -75.4 -31.0 -2.0 -9.7 92.6 1027 137 D E H < S+ 0 0 129 -4,-1.3 2,-0.5 -3,-0.4 -2,-0.2 0.612 84.6 106.7 -96.0 -16.2 -3.5 -11.0 95.8 1028 138 D N X - 0 0 13 -4,-2.2 4,-2.1 -5,-0.2 5,-0.2 -0.538 56.9-156.2 -70.9 121.7 -2.0 -8.5 98.3 1029 139 D E H > S+ 0 0 115 -2,-0.5 4,-2.2 1,-0.2 -1,-0.2 0.830 88.2 49.8 -68.5 -34.9 -4.9 -6.3 99.3 1030 140 D N H > S+ 0 0 5 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.899 113.2 45.8 -72.2 -39.5 -2.8 -3.3 100.4 1031 141 D L H > S+ 0 0 0 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.916 116.1 46.0 -68.4 -41.7 -0.7 -3.3 97.2 1032 142 D Q H X S+ 0 0 13 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.908 111.6 54.0 -67.5 -36.3 -3.8 -3.6 95.1 1033 143 D R H X S+ 0 0 85 -4,-2.2 4,-2.5 2,-0.2 5,-0.2 0.950 108.2 46.2 -63.2 -49.8 -5.6 -1.0 97.1 1034 144 D K H X S+ 0 0 2 -4,-2.5 4,-2.0 1,-0.2 5,-0.2 0.902 112.7 52.2 -63.1 -37.2 -2.9 1.7 96.7 1035 145 D A H X S+ 0 0 0 -4,-2.1 4,-2.6 -5,-0.2 -1,-0.2 0.929 112.8 44.1 -63.6 -41.5 -2.7 0.9 92.9 1036 146 D K H X S+ 0 0 21 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.882 109.8 53.9 -71.7 -37.5 -6.4 1.3 92.5 1037 147 D I H X S+ 0 0 0 -4,-2.5 4,-1.1 2,-0.2 -1,-0.2 0.960 113.6 44.5 -59.9 -48.0 -6.7 4.5 94.6 1038 148 D I H >X S+ 0 0 0 -4,-2.0 4,-1.7 -5,-0.2 3,-0.7 0.945 113.8 48.5 -61.9 -48.9 -4.1 6.0 92.4 1039 149 D M H 3X S+ 0 0 26 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.803 99.7 66.9 -62.6 -29.4 -5.6 4.8 89.1 1040 150 D S H 3< S+ 0 0 14 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.904 106.6 42.7 -61.7 -34.9 -9.0 6.0 90.1 1041 151 D Y H X< S+ 0 0 15 -4,-1.1 3,-1.3 -3,-0.7 5,-0.3 0.902 110.7 54.3 -76.7 -37.7 -7.6 9.5 89.9 1042 152 D Y H 3< S+ 0 0 5 -4,-1.7 -2,-0.2 1,-0.3 -1,-0.2 0.861 113.2 43.2 -62.3 -35.5 -5.7 8.9 86.6 1043 153 D N T 3< S+ 0 0 105 -4,-2.4 -1,-0.3 -5,-0.1 -2,-0.2 0.389 103.8 90.7 -91.3 7.1 -8.8 7.7 85.0 1044 154 D G S < S- 0 0 29 -3,-1.3 -3,-0.1 -5,-0.2 6,-0.0 -0.163 83.5-115.0 -90.6-173.3 -10.9 10.5 86.5 1045 155 D D S S+ 0 0 155 -2,-0.0 -3,-0.1 1,-0.0 -4,-0.1 0.281 81.5 98.1-111.9 14.3 -11.6 14.0 85.1 1046 156 D D > - 0 0 35 -5,-0.3 4,-1.4 1,-0.2 3,-0.2 -0.885 52.2-165.8-105.1 109.2 -9.8 16.3 87.5 1047 157 D P H > S+ 0 0 51 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.853 88.1 52.3 -59.3 -39.7 -6.3 17.3 86.1 1048 158 D L H > S+ 0 0 20 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.875 106.2 52.3 -67.4 -39.5 -5.1 18.6 89.5 1049 159 D K H > S+ 0 0 35 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.828 104.5 58.8 -65.1 -32.7 -6.0 15.4 91.3 1050 160 D K H X S+ 0 0 28 -4,-1.4 4,-2.4 1,-0.2 -1,-0.2 0.935 107.5 45.7 -59.9 -43.6 -4.0 13.5 88.7 1051 161 D K H X S+ 0 0 10 -4,-1.6 4,-2.5 2,-0.2 -2,-0.2 0.866 111.9 51.4 -69.8 -35.2 -0.9 15.5 89.6 1052 162 D V H X S+ 0 0 0 -4,-2.0 4,-2.5 2,-0.2 5,-0.2 0.964 112.1 45.8 -65.2 -49.0 -1.5 15.0 93.3 1053 163 D A H X S+ 0 0 0 -4,-2.9 4,-1.9 1,-0.2 -2,-0.2 0.907 113.5 50.6 -59.4 -41.7 -1.9 11.2 92.9 1054 164 D S H X S+ 0 0 0 -4,-2.4 4,-2.6 -5,-0.2 -1,-0.2 0.907 110.9 47.8 -64.8 -41.8 1.2 11.1 90.7 1055 165 D T H X S+ 0 0 0 -4,-2.5 4,-2.7 1,-0.2 5,-0.3 0.911 110.8 50.1 -69.2 -37.8 3.3 13.1 93.1 1056 166 D L H X>S+ 0 0 0 -4,-2.5 5,-2.6 2,-0.2 4,-1.3 0.847 112.9 48.8 -68.9 -30.9 2.3 10.9 96.1 1057 167 D L H <>S+ 0 0 0 -4,-1.9 5,-1.2 -5,-0.2 -2,-0.2 0.956 117.3 40.0 -68.7 -48.3 3.2 7.8 94.0 1058 168 D E H <5S+ 0 0 0 -4,-2.6 -2,-0.2 1,-0.2 -3,-0.2 0.845 127.5 30.8 -68.2 -39.4 6.6 9.2 93.0 1059 169 D S H <5S+ 0 0 7 -4,-2.7 102,-0.3 -5,-0.2 -1,-0.2 0.497 135.9 14.4-101.8 -9.7 7.6 10.8 96.3 1060 170 D F T ><5S+ 0 0 0 -4,-1.3 3,-1.4 -5,-0.3 4,-0.4 0.597 115.1 55.9-129.0 -59.0 5.8 8.6 98.9 1061 171 D L T 3 > S+ 0 0 7 -3,-1.4 4,-1.5 1,-0.3 -1,-0.2 0.758 78.0 65.2 -72.4 -24.0 9.7 4.3 99.5 1064 174 D S H 34 S+ 0 0 2 -4,-0.4 4,-0.4 -3,-0.4 -1,-0.3 0.801 115.5 39.1 -63.9 -21.7 8.4 1.5 101.6 1065 175 D G H <4 S+ 0 0 1 -3,-1.1 3,-0.4 -4,-0.3 -2,-0.2 0.798 107.5 59.0 -95.1 -32.6 10.2 -0.6 98.9 1066 176 D F H X S+ 0 0 0 -4,-1.6 4,-1.5 1,-0.2 5,-0.2 0.744 94.0 72.0 -67.9 -22.0 13.3 1.6 98.4 1067 177 D Y H X S+ 0 0 7 -4,-1.5 4,-2.7 1,-0.2 -1,-0.2 0.945 89.9 57.4 -56.8 -52.1 14.1 1.1 102.1 1068 178 D L H > S+ 0 0 0 -3,-0.4 4,-2.6 -4,-0.4 5,-0.2 0.872 108.4 42.0 -50.9 -49.6 15.1 -2.6 101.6 1069 179 D P H > S+ 0 0 0 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.847 114.0 51.9 -71.9 -29.8 17.9 -2.1 99.1 1070 180 D M H X S+ 0 0 0 -4,-1.5 4,-1.4 2,-0.2 -2,-0.2 0.902 113.2 46.2 -70.8 -36.7 19.3 0.9 100.8 1071 181 D Y H X S+ 0 0 60 -4,-2.7 4,-1.0 -5,-0.2 3,-0.4 0.971 113.3 46.9 -68.2 -51.8 19.5 -1.0 104.0 1072 182 D L H ><>S+ 0 0 0 -4,-2.6 5,-2.6 1,-0.3 3,-0.9 0.891 109.6 55.0 -55.9 -40.8 21.0 -4.2 102.5 1073 183 D S H ><5S+ 0 0 19 -4,-2.1 3,-1.9 1,-0.3 -1,-0.3 0.861 102.0 55.9 -63.2 -35.6 23.5 -2.2 100.7 1074 184 D S H 3<5S+ 0 0 43 -4,-1.4 -1,-0.3 -3,-0.4 -2,-0.2 0.746 107.6 51.0 -66.8 -21.7 24.7 -0.5 103.9 1075 185 D R T <<5S- 0 0 142 -4,-1.0 -1,-0.3 -3,-0.9 -2,-0.2 0.195 125.0-107.3 -96.1 11.8 25.2 -4.1 105.1 1076 186 D A T < 5S+ 0 0 74 -3,-1.9 2,-0.4 1,-0.2 -3,-0.2 0.762 81.3 125.5 66.7 28.5 27.3 -4.9 102.0 1077 187 D K S S+ 0 0 0 -2,-0.4 4,-2.1 -137,-0.3 -5,-0.2 0.877 76.7 159.5 50.9 46.0 23.0 -6.5 96.9 1079 189 D T H > + 0 0 54 -3,-0.2 4,-0.9 2,-0.2 -1,-0.1 0.805 69.8 47.1 -69.7 -29.7 25.3 -3.5 96.3 1080 190 D N H > S+ 0 0 24 2,-0.2 4,-1.2 1,-0.2 3,-0.3 0.890 110.4 52.6 -77.6 -38.0 25.0 -3.6 92.6 1081 191 D T H >> S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 3,-0.6 0.907 105.6 56.2 -58.5 -42.1 21.2 -3.9 92.8 1082 192 D A H 3X S+ 0 0 0 -4,-2.1 4,-2.5 1,-0.3 -1,-0.2 0.839 99.5 60.0 -61.2 -32.2 21.3 -0.9 95.0 1083 193 D D H 3X S+ 0 0 61 -4,-0.9 4,-1.6 -3,-0.3 -1,-0.3 0.875 104.7 48.3 -63.1 -37.2 23.1 1.0 92.2 1084 194 D I H X S+ 0 0 0 -4,-2.3 4,-2.9 2,-0.2 3,-0.7 0.927 112.8 48.5 -70.0 -41.9 15.7 4.9 89.8 1089 199 D I H 3X S+ 0 0 20 -4,-3.0 4,-2.6 1,-0.3 5,-0.3 0.900 103.4 60.1 -65.0 -40.9 15.7 7.3 92.7 1090 200 D R H 3X S+ 0 0 97 -4,-2.5 4,-0.5 1,-0.2 -1,-0.3 0.793 113.5 39.8 -58.2 -28.3 17.7 9.9 90.8 1091 201 D D H < S+ 0 0 17 -4,-2.0 3,-1.6 1,-0.2 4,-0.2 0.945 112.8 47.0 -72.1 -48.5 -2.2 25.0 88.4 1107 217 D V H >< S+ 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