==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 03-AUG-05 2AKC . COMPND 2 MOLECULE: CLASS A NONSPECIFIC ACID PHOSPHATASE PHON; . SOURCE 2 ORGANISM_SCIENTIFIC: SALMONELLA TYPHIMURIUM; . AUTHOR R.D.MAKDE,V.KUMAR . 875 4 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 35915.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 642 73.4 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 . 8 0.9 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 . 12 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 116 13.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 458 52.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 28 3.2 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 10 1 0 4 2 2 1 0 4 1 3 8 4 3 3 2 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 . 4 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 23 A M 0 0 219 0, 0.0 82,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 45.5 62.6 0.1 35.2 2 24 A Q - 0 0 146 2,-0.0 85,-0.1 0, 0.0 0, 0.0 -0.950 360.0-121.3-126.4 114.3 61.1 -1.8 38.1 3 25 A P - 0 0 41 0, 0.0 3,-0.1 0, 0.0 85,-0.1 -0.172 21.4-122.7 -52.3 138.3 58.2 -0.4 40.2 4 26 A F S S- 0 0 20 1,-0.1 2,-0.3 83,-0.1 195,-0.2 0.791 88.6 -4.9 -52.6 -35.4 58.8 -0.1 43.9 5 27 A H S S- 0 0 6 194,-0.1 -1,-0.1 192,-0.0 5,-0.0 -0.983 79.8 -95.6-157.4 160.9 55.8 -2.3 44.7 6 28 A S > - 0 0 37 -2,-0.3 3,-2.4 1,-0.1 4,-0.3 -0.366 41.0-103.0 -79.5 160.2 52.9 -4.1 43.0 7 29 A P G > S+ 0 0 62 0, 0.0 3,-1.0 0, 0.0 -1,-0.1 0.822 123.7 54.0 -49.0 -36.2 49.4 -2.7 42.7 8 30 A E G 3 S+ 0 0 156 1,-0.2 4,-0.1 4,-0.0 -2,-0.0 0.631 98.6 64.3 -76.2 -14.9 48.3 -5.0 45.5 9 31 A E G < S+ 0 0 112 -3,-2.4 2,-0.2 2,-0.1 -1,-0.2 0.364 82.9 93.6 -91.5 5.3 51.0 -3.6 47.8 10 32 A S S < S- 0 0 18 -3,-1.0 2,-0.2 -4,-0.3 180,-0.1 -0.652 91.1 -93.1 -95.2 155.4 49.6 -0.1 48.0 11 33 A V - 0 0 9 -2,-0.2 2,-0.8 1,-0.1 -2,-0.1 -0.513 47.3-106.0 -68.6 131.2 47.2 1.0 50.7 12 34 A N >> - 0 0 55 -2,-0.2 4,-1.4 1,-0.2 3,-1.2 -0.446 31.0-167.6 -63.8 99.7 43.6 0.5 49.6 13 35 A S H 3> S+ 0 0 0 -2,-0.8 4,-1.9 83,-0.4 -1,-0.2 0.741 84.0 63.4 -60.5 -27.4 42.2 4.0 48.9 14 36 A Q H 34 S+ 0 0 59 1,-0.2 -1,-0.3 2,-0.2 -2,-0.1 0.814 104.5 48.8 -68.4 -29.4 38.7 2.8 48.7 15 37 A F H <4 S+ 0 0 55 -3,-1.2 -2,-0.2 1,-0.1 -1,-0.2 0.947 119.5 31.2 -77.9 -47.3 38.9 1.8 52.4 16 38 A Y H < S+ 0 0 6 -4,-1.4 -2,-0.2 2,-0.1 -3,-0.1 0.680 102.2 79.9 -89.6 -18.0 40.4 5.0 53.9 17 39 A L S < S- 0 0 6 -4,-1.9 362,-0.1 -5,-0.2 165,-0.0 -0.647 81.7-120.0 -87.1 146.7 39.0 7.8 51.7 18 40 A P - 0 0 34 0, 0.0 -2,-0.1 0, 0.0 -1,-0.1 -0.409 42.5 -86.0 -77.6 164.5 35.4 8.9 52.3 19 41 A P - 0 0 87 0, 0.0 3,-0.1 0, 0.0 81,-0.0 -0.307 56.3 -89.1 -66.6 156.7 32.9 8.5 49.5 20 42 A P - 0 0 27 0, 0.0 8,-0.1 0, 0.0 159,-0.0 -0.340 55.0 -83.6 -66.9 147.9 32.8 11.4 47.0 21 43 A P - 0 0 27 0, 0.0 2,-0.2 0, 0.0 157,-0.0 -0.190 50.7-134.5 -51.4 136.9 30.4 14.3 47.6 22 44 A G > - 0 0 26 -3,-0.1 3,-2.7 1,-0.0 6,-0.3 -0.510 28.7 -86.1 -95.0 165.8 26.9 13.6 46.4 23 45 A N T 3 S+ 0 0 127 1,-0.3 -1,-0.0 -2,-0.2 0, 0.0 0.698 126.0 32.9 -38.4 -40.9 24.4 15.7 44.5 24 46 A D T 3 S+ 0 0 114 4,-0.1 -1,-0.3 5,-0.0 3,-0.0 0.338 92.1 116.9-105.4 9.4 22.9 17.5 47.5 25 47 A D S X> S- 0 0 77 -3,-2.7 4,-1.6 1,-0.1 3,-1.0 -0.509 70.8-126.5 -79.1 143.4 26.0 17.6 49.7 26 48 A P H 3> S+ 0 0 15 0, 0.0 4,-1.7 0, 0.0 5,-0.2 0.892 112.2 56.3 -51.9 -42.8 27.5 21.0 50.6 27 49 A A H 3> S+ 0 0 14 1,-0.2 4,-1.8 2,-0.2 151,-0.2 0.809 104.1 53.6 -62.4 -29.8 30.9 19.8 49.3 28 50 A F H <> S+ 0 0 16 -3,-1.0 4,-2.3 -6,-0.3 -1,-0.2 0.901 104.0 52.7 -74.5 -38.8 29.3 19.1 45.9 29 51 A R H X S+ 0 0 112 -4,-1.6 4,-2.1 1,-0.2 -2,-0.2 0.878 110.3 50.9 -61.8 -35.6 27.8 22.6 45.5 30 52 A Y H X S+ 0 0 45 -4,-1.7 4,-2.8 -5,-0.2 5,-0.2 0.912 105.9 55.5 -67.1 -41.3 31.3 23.9 46.2 31 53 A D H X S+ 0 0 2 -4,-1.8 4,-2.3 1,-0.2 -2,-0.2 0.924 108.8 46.8 -56.8 -46.4 32.6 21.5 43.5 32 54 A K H X S+ 0 0 73 -4,-2.3 4,-2.5 2,-0.2 5,-0.2 0.939 113.1 48.2 -61.3 -48.8 30.3 23.0 40.9 33 55 A E H X S+ 0 0 77 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.890 112.1 49.5 -59.3 -41.5 31.1 26.6 41.8 34 56 A A H X S+ 0 0 11 -4,-2.8 4,-1.2 2,-0.2 -1,-0.2 0.883 108.5 54.6 -65.9 -38.4 34.8 25.8 41.7 35 57 A Y H >X S+ 0 0 3 -4,-2.3 4,-2.0 -5,-0.2 3,-0.9 0.976 112.0 41.8 -59.8 -53.6 34.4 24.2 38.3 36 58 A F H 3X S+ 0 0 83 -4,-2.5 4,-2.0 1,-0.3 -1,-0.2 0.822 106.0 62.9 -64.4 -30.6 32.8 27.2 36.8 37 59 A K H 3X S+ 0 0 124 -4,-2.1 4,-0.5 -5,-0.2 -1,-0.3 0.830 112.0 39.2 -63.1 -28.4 35.2 29.6 38.5 38 60 A G H << S+ 0 0 4 -4,-1.2 3,-0.4 -3,-0.9 -2,-0.2 0.809 110.0 56.4 -89.3 -33.7 37.9 27.9 36.4 39 61 A Y H >< S+ 0 0 71 -4,-2.0 3,-1.3 1,-0.2 -2,-0.2 0.837 101.5 62.4 -65.7 -30.6 35.9 27.5 33.2 40 62 A A H 3< S+ 0 0 84 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.847 101.6 48.2 -64.4 -37.3 35.4 31.3 33.4 41 63 A I T >< S+ 0 0 68 -4,-0.5 3,-2.1 -3,-0.4 6,-0.4 0.139 78.6 148.8 -93.0 22.3 39.2 32.1 33.1 42 64 A K T < + 0 0 108 -3,-1.3 -3,-0.1 1,-0.3 130,-0.0 -0.334 66.6 25.4 -57.2 127.8 39.7 29.7 30.1 43 65 A G T 3 S+ 0 0 50 1,-0.4 -1,-0.3 -2,-0.1 -2,-0.1 0.300 95.8 116.5 100.6 -10.0 42.5 31.1 27.9 44 66 A S S <> S- 0 0 34 -3,-2.1 4,-2.1 1,-0.1 -1,-0.4 -0.305 81.6 -97.7 -84.8 172.7 44.2 33.1 30.6 45 67 A P H > S+ 0 0 108 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.923 123.4 51.1 -58.4 -47.0 47.8 32.5 31.9 46 68 A R H > S+ 0 0 59 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.904 111.9 49.5 -57.8 -39.4 46.8 30.5 34.9 47 69 A W H > S+ 0 0 21 -6,-0.4 4,-1.5 1,-0.2 -1,-0.2 0.872 109.1 51.8 -65.9 -37.5 44.7 28.4 32.6 48 70 A K H X S+ 0 0 136 -4,-2.1 4,-1.5 1,-0.2 -1,-0.2 0.820 106.7 53.4 -68.7 -30.9 47.7 28.0 30.3 49 71 A Q H X S+ 0 0 52 -4,-2.2 4,-2.9 1,-0.2 -1,-0.2 0.879 104.3 57.3 -69.4 -36.1 49.8 26.9 33.3 50 72 A A H X S+ 0 0 0 -4,-1.7 4,-1.4 1,-0.2 -2,-0.2 0.878 104.5 49.9 -61.2 -40.5 47.1 24.2 34.0 51 73 A A H X S+ 0 0 29 -4,-1.5 4,-0.6 2,-0.2 -1,-0.2 0.885 111.5 49.9 -66.1 -37.8 47.5 22.7 30.5 52 74 A E H >< S+ 0 0 91 -4,-1.5 3,-1.2 1,-0.2 -2,-0.2 0.938 110.5 48.7 -64.0 -46.7 51.2 22.6 31.1 53 75 A D H 3< S+ 0 0 0 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.747 99.3 70.6 -64.4 -23.8 50.7 20.9 34.4 54 76 A A H 3< S+ 0 0 0 -4,-1.4 2,-0.8 -5,-0.2 -1,-0.2 0.764 80.2 83.8 -65.5 -27.1 48.4 18.4 32.7 55 77 A D << + 0 0 45 -3,-1.2 -1,-0.1 -4,-0.6 -4,-0.0 -0.698 53.1 176.7 -82.7 110.6 51.2 16.8 30.9 56 78 A I + 0 0 26 -2,-0.8 -1,-0.1 4,-0.1 5,-0.1 0.257 30.8 131.2 -99.6 14.3 52.8 14.2 33.2 57 79 A S S > S- 0 0 44 1,-0.1 4,-1.8 4,-0.1 3,-0.4 -0.259 71.7-111.4 -58.7 157.7 55.4 12.8 30.8 58 80 A V H > S+ 0 0 17 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.891 115.7 57.9 -61.7 -41.1 58.9 12.6 32.5 59 81 A E H > S+ 0 0 117 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.852 110.2 44.1 -58.6 -36.0 60.3 15.4 30.3 60 82 A N H > S+ 0 0 16 -3,-0.4 4,-2.0 2,-0.2 -1,-0.2 0.847 111.3 51.8 -79.4 -33.3 57.6 17.8 31.4 61 83 A I H X S+ 0 0 0 -4,-1.8 4,-2.7 2,-0.2 -2,-0.2 0.909 111.7 48.5 -67.5 -40.2 57.8 16.9 35.1 62 84 A A H X S+ 0 0 4 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.923 109.0 52.3 -65.6 -44.8 61.5 17.5 35.0 63 85 A R H < S+ 0 0 119 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.911 114.9 43.0 -57.6 -43.3 61.2 20.8 33.2 64 86 A I H X S+ 0 0 13 -4,-2.0 4,-0.7 1,-0.2 -2,-0.2 0.903 120.2 39.0 -72.2 -41.3 58.7 22.0 35.9 65 87 A F H X S+ 0 0 1 -4,-2.7 4,-3.2 1,-0.2 5,-0.4 0.674 94.8 78.3 -87.8 -14.9 60.5 20.7 38.9 66 88 A S H X>S+ 0 0 16 -4,-2.3 4,-2.0 1,-0.2 5,-1.3 0.936 99.8 44.4 -57.3 -47.3 64.2 21.5 38.0 67 89 A P H 45S+ 0 0 78 0, 0.0 -1,-0.2 0, 0.0 -2,-0.2 0.909 115.8 48.1 -63.8 -40.5 63.7 25.1 38.9 68 90 A V H <5S+ 0 0 20 -4,-0.7 -2,-0.2 1,-0.2 90,-0.2 0.939 117.6 38.5 -66.8 -48.1 61.8 24.3 42.1 69 91 A V H <5S- 0 0 0 -4,-3.2 -1,-0.2 2,-0.2 -3,-0.2 0.762 107.7-126.9 -74.9 -25.0 64.3 21.7 43.4 70 92 A G T <5S+ 0 0 14 -4,-2.0 148,-1.6 -5,-0.4 2,-0.3 0.779 71.7 94.4 85.9 27.6 67.2 23.8 42.2 71 93 A A B - 0 0 24 -2,-0.5 4,-2.1 1,-0.1 8,-0.3 -0.974 62.7-113.7-145.4 158.1 68.1 14.9 32.9 75 97 A P T 4 S+ 0 0 77 0, 0.0 8,-0.1 0, 0.0 7,-0.1 0.773 118.5 44.1 -64.3 -20.6 68.5 11.3 31.9 76 98 A K T 4 S+ 0 0 183 2,-0.1 -3,-0.0 3,-0.1 0, 0.0 0.854 121.1 31.8 -91.9 -40.3 72.2 12.0 31.5 77 99 A D T 4 S+ 0 0 72 1,-0.2 -1,-0.1 2,-0.1 -4,-0.1 0.839 135.8 22.8 -87.1 -35.5 73.1 14.1 34.6 78 100 A T X + 0 0 0 -4,-2.1 4,-2.1 1,-0.1 -1,-0.2 -0.560 67.4 160.1-131.3 68.8 70.6 12.5 37.0 79 101 A P H > S+ 0 0 61 0, 0.0 4,-2.0 0, 0.0 5,-0.2 0.894 77.3 50.3 -58.2 -42.6 69.7 9.1 35.7 80 102 A E H > S+ 0 0 52 1,-0.2 4,-2.5 2,-0.2 127,-0.2 0.903 110.9 47.8 -64.4 -41.8 68.4 7.8 39.1 81 103 A T H > S+ 0 0 0 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.869 108.2 58.1 -65.5 -35.1 66.2 10.8 39.6 82 104 A W H X S+ 0 0 37 -4,-2.1 4,-1.2 -8,-0.3 -2,-0.2 0.916 110.3 41.3 -61.5 -44.4 64.9 10.3 36.1 83 105 A N H X S+ 0 0 73 -4,-2.0 4,-2.9 1,-0.2 5,-0.2 0.892 110.0 59.2 -71.1 -38.0 63.8 6.8 37.0 84 106 A M H X S+ 0 0 1 -4,-2.5 4,-2.7 1,-0.2 -2,-0.2 0.911 103.5 52.5 -55.3 -44.2 62.4 8.0 40.4 85 107 A L H X S+ 0 0 0 -4,-2.4 4,-0.8 1,-0.2 -1,-0.2 0.880 113.7 42.0 -59.0 -42.8 60.1 10.4 38.6 86 108 A Q H X S+ 0 0 87 -4,-1.2 4,-1.2 2,-0.2 -1,-0.2 0.865 114.0 51.5 -73.6 -38.5 58.7 7.7 36.3 87 109 A N H X S+ 0 0 23 -4,-2.9 4,-2.1 1,-0.2 3,-0.3 0.905 106.5 53.6 -66.3 -43.0 58.4 5.1 39.1 88 110 A L H X>S+ 0 0 0 -4,-2.7 4,-2.1 -5,-0.2 5,-0.7 0.791 103.4 58.4 -63.4 -26.9 56.5 7.4 41.4 89 111 A L H X>S+ 0 0 30 -4,-0.8 5,-1.1 3,-0.2 4,-0.9 0.881 108.3 46.2 -69.9 -37.0 54.0 8.0 38.6 90 112 A K H X>S+ 0 0 109 -4,-1.2 5,-2.8 -3,-0.3 4,-0.7 0.968 121.9 32.5 -68.5 -56.2 53.2 4.3 38.5 91 113 A V H <>S+ 0 0 0 -4,-2.1 5,-1.9 3,-0.2 -2,-0.2 0.837 131.8 30.8 -74.0 -33.1 52.9 3.6 42.3 92 114 A G H <5S+ 0 0 0 -4,-2.1 -3,-0.2 -5,-0.3 -2,-0.2 0.833 125.0 38.0 -96.0 -37.7 51.5 7.0 43.3 93 115 A G H <X S+ 0 0 1 -3,-0.6 4,-2.2 2,-0.1 3,-0.3 0.592 91.1 93.8-104.6 -14.8 44.4 5.6 43.4 98 120 A A H X S+ 0 0 48 -4,-1.6 4,-2.8 -3,-0.5 5,-0.3 0.859 80.2 49.5 -47.1 -57.0 43.0 2.6 41.5 99 121 A S H > S+ 0 0 40 -4,-0.5 4,-1.6 1,-0.2 -1,-0.2 0.886 115.8 42.0 -59.1 -42.2 40.7 1.0 44.0 100 122 A A H > S+ 0 0 0 -3,-0.3 4,-1.6 -4,-0.2 5,-0.3 0.894 114.9 53.5 -70.6 -38.6 38.8 4.2 44.9 101 123 A K H X S+ 0 0 13 -4,-2.2 4,-2.1 1,-0.2 5,-0.3 0.956 113.4 39.6 -58.9 -54.7 38.8 5.2 41.3 102 124 A K H < S+ 0 0 163 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.808 112.2 57.1 -68.0 -31.8 37.2 2.0 39.9 103 125 A Y H < S+ 0 0 155 -4,-1.6 -1,-0.2 -5,-0.3 -2,-0.2 0.853 120.3 25.9 -70.6 -36.2 34.8 1.6 42.8 104 126 A Y H < S- 0 0 64 -4,-1.6 -2,-0.2 28,-0.3 3,-0.2 0.697 78.0-162.7-100.1 -23.6 33.0 5.0 42.4 105 127 A M < - 0 0 85 -4,-2.1 2,-0.1 -5,-0.3 -3,-0.1 0.884 23.5-160.2 37.8 50.5 33.6 5.6 38.7 106 128 A R - 0 0 25 -5,-0.3 25,-2.0 26,-0.2 -1,-0.2 -0.393 16.0-114.0 -65.3 132.5 32.8 9.3 39.5 107 129 A T - 0 0 77 -3,-0.2 -1,-0.1 -2,-0.1 20,-0.1 -0.439 29.9-120.8 -69.5 134.9 31.8 11.3 36.5 108 130 A R >> - 0 0 8 -2,-0.2 4,-1.9 19,-0.2 3,-1.0 -0.510 18.9-118.0 -77.9 143.5 34.2 14.1 35.6 109 131 A P H 3> S+ 0 0 0 0, 0.0 4,-2.1 0, 0.0 65,-0.1 0.822 112.5 51.9 -49.0 -41.7 33.0 17.7 35.5 110 132 A F H 3>>S+ 0 0 0 63,-1.0 5,-1.7 1,-0.2 4,-0.7 0.831 109.8 50.8 -68.6 -28.4 33.6 18.3 31.8 111 133 A V H <45S+ 0 0 41 -3,-1.0 3,-0.3 2,-0.2 -1,-0.2 0.880 111.5 48.2 -72.3 -39.0 31.7 15.1 31.0 112 134 A L H <5S+ 0 0 86 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.844 120.6 34.9 -70.3 -36.2 28.8 16.3 33.1 113 135 A F H <5S- 0 0 48 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.361 103.8-122.2-102.5 4.7 28.6 19.8 31.6 114 136 A N T <5 + 0 0 72 -4,-0.7 2,-0.3 -3,-0.3 -3,-0.2 0.941 65.4 130.0 54.6 56.2 29.6 19.0 28.0 115 137 A H < - 0 0 46 -5,-1.7 2,-0.2 58,-0.1 -1,-0.2 -0.810 56.9-109.4-129.9 169.9 32.6 21.3 27.9 116 138 A S - 0 0 44 -2,-0.3 2,-0.1 1,-0.1 -5,-0.0 -0.665 30.0-129.9 -99.9 160.3 36.2 20.9 26.7 117 139 A T - 0 0 5 -2,-0.2 56,-0.2 1,-0.0 55,-0.1 -0.356 31.5 -94.8 -99.9-177.0 39.2 20.8 29.1 118 140 A a S S+ 0 0 13 54,-1.4 55,-0.1 1,-0.3 -64,-0.1 0.494 121.7 35.8 -76.9 -2.8 42.5 22.6 29.0 119 141 A R >> - 0 0 55 53,-0.3 3,-1.5 1,-0.1 4,-0.7 -0.519 65.0-176.9-153.2 79.2 44.0 19.6 27.3 120 142 A P H >> S+ 0 0 67 0, 0.0 3,-0.6 0, 0.0 4,-0.5 0.753 77.0 74.6 -44.5 -36.6 41.7 17.8 24.8 121 143 A E H >4 S+ 0 0 132 1,-0.2 3,-0.6 2,-0.1 4,-0.3 0.898 99.3 43.6 -47.5 -48.7 44.3 15.2 24.0 122 144 A D H X> S+ 0 0 33 -3,-1.5 4,-2.4 1,-0.2 3,-1.4 0.748 88.7 90.5 -71.2 -28.0 43.6 13.5 27.4 123 145 A E H < S+ 0 0 16 -4,-2.4 3,-2.4 1,-0.2 -2,-0.2 0.888 96.3 71.2 -57.9 -40.3 39.8 10.6 31.2 127 149 A R H 3< S+ 0 0 97 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.820 104.8 36.9 -42.4 -47.3 36.3 9.6 29.9 128 150 A K T << S+ 0 0 142 -3,-0.8 2,-0.5 -4,-0.6 -1,-0.3 0.233 101.6 92.5 -95.9 12.9 36.7 6.0 31.1 129 151 A D S < S- 0 0 61 -3,-2.4 -21,-0.1 -4,-0.2 -27,-0.1 -0.924 83.2-109.4-114.8 128.5 38.7 6.8 34.3 130 152 A G - 0 0 2 -2,-0.5 -23,-0.1 1,-0.1 -28,-0.1 -0.275 22.3-147.8 -53.0 131.1 37.1 7.3 37.7 131 153 A S + 0 0 0 -25,-2.0 -1,-0.1 -30,-0.1 45,-0.1 0.803 63.1 104.0 -71.8 -32.0 37.4 10.9 38.7 132 154 A Y S S+ 0 0 6 -31,-0.2 -28,-0.3 -32,-0.2 -26,-0.2 -0.882 82.4 18.2-107.9 118.7 37.7 10.4 42.4 133 155 A P S S- 0 0 0 0, 0.0 2,-0.4 0, 0.0 47,-0.2 0.614 91.4-118.7 -92.5 173.2 40.5 10.7 43.5 134 156 A S > - 0 0 0 45,-1.5 4,-1.8 1,-0.1 5,-0.2 -0.542 14.7-160.3 -74.6 124.3 42.8 12.7 41.2 135 157 A G H > S+ 0 0 12 -2,-0.4 4,-2.2 2,-0.2 5,-0.2 0.881 91.2 54.3 -71.5 -40.3 45.8 10.8 39.9 136 158 A H H > S+ 0 0 22 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.891 110.4 49.7 -59.8 -38.3 47.8 13.9 38.9 137 159 A T H > S+ 0 0 0 2,-0.2 4,-2.3 1,-0.2 5,-0.3 0.934 108.6 47.8 -67.0 -51.7 47.4 15.2 42.4 138 160 A A H X S+ 0 0 0 -4,-1.8 4,-2.9 1,-0.2 5,-0.2 0.952 114.5 51.1 -55.1 -47.2 48.5 12.1 44.3 139 161 A Y H X S+ 0 0 1 -4,-2.2 4,-3.2 1,-0.2 -2,-0.2 0.905 111.7 43.0 -55.9 -50.6 51.5 12.0 42.0 140 162 A S H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.802 114.6 51.1 -69.5 -30.0 52.6 15.7 42.5 141 163 A T H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.950 114.3 43.9 -69.8 -49.3 52.0 15.5 46.3 142 164 A L H X S+ 0 0 0 -4,-2.9 4,-2.6 -5,-0.3 5,-0.2 0.956 114.5 49.8 -58.4 -51.8 54.1 12.3 46.4 143 165 A L H X S+ 0 0 1 -4,-3.2 4,-2.7 1,-0.2 5,-0.3 0.930 109.8 51.4 -52.2 -51.6 56.7 13.8 44.1 144 166 A A H X S+ 0 0 1 -4,-2.4 4,-1.6 1,-0.2 -1,-0.2 0.879 111.9 46.4 -54.3 -43.5 56.9 17.0 46.2 145 167 A L H X S+ 0 0 4 -4,-2.1 4,-1.4 2,-0.2 -1,-0.2 0.903 112.5 48.9 -68.3 -44.2 57.4 15.0 49.5 146 168 A V H X S+ 0 0 1 -4,-2.6 4,-1.3 1,-0.2 3,-0.3 0.928 113.0 46.9 -63.3 -45.7 60.1 12.7 48.1 147 169 A L H X S+ 0 0 1 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.850 108.4 56.2 -65.7 -32.3 62.0 15.6 46.6 148 170 A S H < S+ 0 0 9 -4,-1.6 -1,-0.2 -5,-0.3 -2,-0.2 0.818 106.2 51.6 -66.7 -30.1 61.7 17.5 49.9 149 171 A Q H < S+ 0 0 6 -4,-1.4 -1,-0.2 -3,-0.3 -2,-0.2 0.797 112.9 45.0 -75.0 -29.8 63.3 14.4 51.5 150 172 A A H < S+ 0 0 0 -4,-1.3 -2,-0.2 1,-0.2 -1,-0.2 0.786 133.3 15.8 -84.2 -29.7 66.2 14.6 49.0 151 173 A R >< + 0 0 35 -4,-2.4 3,-1.9 -5,-0.1 -1,-0.2 -0.591 65.8 174.0-146.5 78.4 66.7 18.4 49.2 152 174 A P G > S+ 0 0 33 0, 0.0 3,-1.7 0, 0.0 4,-0.3 0.652 72.4 77.2 -61.5 -16.7 65.0 19.8 52.4 153 175 A E G 3 S+ 0 0 106 1,-0.3 3,-0.1 2,-0.1 -5,-0.1 0.713 101.5 43.0 -66.9 -16.8 66.5 23.2 51.8 154 176 A R G <> S+ 0 0 73 -3,-1.9 4,-2.4 -7,-0.2 -1,-0.3 0.109 78.6 119.4-113.2 19.7 63.7 23.5 49.1 155 177 A A H <> S+ 0 0 4 -3,-1.7 4,-2.7 1,-0.2 5,-0.2 0.904 74.9 46.3 -52.8 -50.1 60.9 22.0 51.1 156 178 A Q H > S+ 0 0 54 -4,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.906 113.0 48.3 -63.1 -44.6 58.6 25.1 51.1 157 179 A E H > S+ 0 0 42 2,-0.2 4,-2.8 1,-0.2 5,-0.3 0.942 114.9 47.0 -59.2 -48.5 59.0 25.8 47.3 158 180 A L H X S+ 0 0 0 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.913 110.7 51.1 -60.0 -45.6 58.3 22.1 46.6 159 181 A A H X S+ 0 0 2 -4,-2.7 4,-1.5 -5,-0.2 -1,-0.2 0.856 113.0 46.4 -63.4 -35.1 55.3 22.0 48.9 160 182 A R H X S+ 0 0 101 -4,-2.1 4,-2.4 2,-0.2 5,-0.2 0.956 113.7 46.0 -72.1 -49.2 53.8 25.1 47.2 161 183 A R H X S+ 0 0 35 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.891 110.6 55.0 -59.8 -39.4 54.4 23.9 43.7 162 184 A G H X S+ 0 0 0 -4,-2.7 4,-1.2 -5,-0.3 -1,-0.2 0.919 108.9 48.2 -58.9 -43.6 53.0 20.5 44.6 163 185 A W H >X S+ 0 0 33 -4,-1.5 4,-1.7 1,-0.2 3,-0.5 0.932 112.0 47.7 -61.9 -49.6 49.8 22.1 45.8 164 186 A E H 3X S+ 0 0 62 -4,-2.4 4,-1.7 1,-0.2 -1,-0.2 0.849 104.4 60.9 -61.4 -36.9 49.4 24.3 42.7 165 187 A F H 3X S+ 0 0 1 -4,-2.4 4,-0.6 1,-0.2 -1,-0.2 0.867 106.4 47.6 -58.7 -36.6 50.0 21.3 40.4 166 188 A G H XX S+ 0 0 0 -4,-1.2 3,-0.9 -3,-0.5 4,-0.6 0.884 107.5 55.2 -72.1 -39.0 46.9 19.7 42.0 167 189 A Q H >X S+ 0 0 37 -4,-1.7 4,-2.2 1,-0.2 3,-0.8 0.777 94.0 69.2 -66.1 -25.3 44.9 22.9 41.6 168 190 A S H 3X S+ 0 0 0 -4,-1.7 4,-2.8 1,-0.2 6,-0.2 0.862 92.0 60.9 -60.1 -33.6 45.6 22.9 37.9 169 191 A R H <<>S+ 0 0 4 -3,-0.9 6,-1.9 -4,-0.6 5,-0.9 0.832 107.4 43.9 -62.7 -32.8 43.4 19.8 37.6 170 192 A V H X<5S+ 0 0 8 -3,-0.8 3,-1.0 -4,-0.6 -2,-0.2 0.931 115.3 46.4 -75.7 -49.5 40.4 21.8 38.9 171 193 A I H 3<5S+ 0 0 28 -4,-2.2 -2,-0.2 1,-0.3 -3,-0.2 0.845 108.8 58.2 -60.9 -33.9 41.1 24.8 36.8 172 194 A a T 3<5S- 0 0 1 -4,-2.8 -54,-1.4 -5,-0.2 -53,-0.3 0.683 109.9-122.2 -71.1 -20.4 41.6 22.6 33.8 173 195 A G T < 5S+ 0 0 3 -3,-1.0 -63,-1.0 -4,-0.5 -3,-0.2 0.395 84.6 110.9 91.8 -1.7 38.1 21.1 34.2 174 196 A A S > - 0 0 5 -2,-0.3 4,-1.3 -45,-0.1 3,-1.1 -0.662 39.9-111.2 -92.6 156.4 36.2 18.4 40.9 177 199 A Q H 3> S+ 0 0 10 1,-0.3 4,-2.5 -2,-0.3 3,-0.3 0.886 117.7 60.0 -56.7 -39.8 37.9 20.1 43.9 178 200 A S H 3> S+ 0 0 15 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.780 100.3 54.5 -60.9 -27.8 37.0 17.2 46.1 179 201 A D H <> S+ 0 0 0 -3,-1.1 4,-2.4 2,-0.2 -45,-1.5 0.883 109.9 48.1 -71.2 -38.9 39.0 14.8 43.9 180 202 A V H X S+ 0 0 0 -4,-1.3 4,-1.6 -3,-0.3 -2,-0.2 0.926 109.8 50.0 -67.4 -45.0 42.0 17.0 44.4 181 203 A D H X S+ 0 0 34 -4,-2.5 4,-1.0 1,-0.2 -1,-0.2 0.907 114.2 46.5 -60.3 -40.5 41.7 17.3 48.1 182 204 A A H X S+ 0 0 1 -4,-1.7 4,-1.9 1,-0.2 3,-0.5 0.895 105.9 59.9 -67.9 -40.6 41.4 13.5 48.3 183 205 A G H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.826 99.5 56.4 -58.2 -33.8 44.4 13.0 46.0 184 206 A R H X S+ 0 0 15 -4,-1.6 4,-1.8 2,-0.2 -1,-0.2 0.881 106.3 49.1 -68.1 -35.2 46.7 14.9 48.4 185 207 A Y H X S+ 0 0 6 -4,-1.0 4,-2.7 -3,-0.5 -1,-0.2 0.896 110.1 51.8 -69.5 -39.5 45.9 12.5 51.2 186 208 A V H X S+ 0 0 0 -4,-1.9 4,-2.7 1,-0.2 5,-0.3 0.906 107.0 54.1 -62.4 -41.5 46.5 9.5 48.9 187 209 A G H X S+ 0 0 0 -4,-2.1 4,-1.7 2,-0.2 -1,-0.2 0.907 111.1 44.8 -59.3 -43.5 49.9 11.0 48.0 188 210 A A H X S+ 0 0 2 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.941 112.6 50.7 -66.4 -48.6 50.9 11.3 51.7 189 211 A V H X S+ 0 0 6 -4,-2.7 4,-1.9 1,-0.2 -2,-0.2 0.930 112.7 46.0 -55.4 -49.0 49.7 7.8 52.5 190 212 A E H X S+ 0 0 3 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.868 108.8 57.9 -62.3 -35.4 51.6 6.3 49.6 191 213 A F H X S+ 0 0 0 -4,-1.7 4,-1.1 -5,-0.3 -1,-0.2 0.900 105.9 49.1 -60.8 -40.6 54.6 8.4 50.7 192 214 A A H X S+ 0 0 2 -4,-2.1 4,-0.5 1,-0.2 3,-0.3 0.910 110.0 51.3 -65.1 -42.6 54.4 6.7 54.1 193 215 A R H >< S+ 0 0 41 -4,-1.9 3,-1.0 1,-0.2 -2,-0.2 0.870 103.5 57.7 -63.2 -40.7 54.3 3.2 52.5 194 216 A L H >< S+ 0 0 0 -4,-2.3 3,-2.3 1,-0.2 7,-0.3 0.851 92.6 69.7 -59.5 -35.8 57.3 3.8 50.3 195 217 A Q H 3< S+ 0 0 7 -4,-1.1 -1,-0.2 -3,-0.3 -2,-0.2 0.821 98.2 51.0 -52.4 -33.7 59.5 4.5 53.3 196 218 A T T << S+ 0 0 53 -3,-1.0 -1,-0.3 -4,-0.5 -2,-0.2 0.387 89.6 92.9 -88.2 4.0 59.3 0.9 54.3 197 219 A I X> - 0 0 26 -3,-2.3 4,-1.9 -4,-0.2 3,-1.2 -0.870 64.3-152.2-104.2 113.6 60.3 -0.5 50.9 198 220 A P H 3> S+ 0 0 103 0, 0.0 4,-2.8 0, 0.0 5,-0.3 0.854 95.0 59.0 -46.7 -45.8 64.1 -1.1 50.5 199 221 A A H 3> S+ 0 0 52 -195,-0.2 4,-1.5 1,-0.2 5,-0.1 0.868 109.1 46.7 -55.2 -36.7 64.1 -0.6 46.8 200 222 A F H <> S+ 0 0 0 -3,-1.2 4,-3.3 -6,-0.2 5,-0.2 0.960 110.7 49.1 -69.9 -53.7 62.8 2.9 47.5 201 223 A Q H X S+ 0 0 69 -4,-1.9 4,-2.1 -7,-0.3 -2,-0.2 0.909 112.7 49.2 -52.0 -46.0 65.3 3.8 50.2 202 224 A K H X S+ 0 0 163 -4,-2.8 4,-1.2 1,-0.2 -1,-0.2 0.871 113.4 46.8 -61.8 -38.9 68.1 2.6 48.0 203 225 A S H X S+ 0 0 7 -4,-1.5 4,-2.2 -5,-0.3 -2,-0.2 0.882 109.2 54.2 -71.7 -38.6 66.8 4.7 45.1 204 226 A L H X S+ 0 0 0 -4,-3.3 4,-3.0 1,-0.2 5,-0.2 0.882 101.8 58.7 -64.0 -37.3 66.3 7.7 47.4 205 227 A A H X S+ 0 0 51 -4,-2.1 4,-1.7 -5,-0.2 -1,-0.2 0.925 109.8 43.3 -57.9 -44.8 69.9 7.6 48.5 206 228 A K H X S+ 0 0 91 -4,-1.2 4,-2.4 2,-0.2 -1,-0.2 0.883 111.8 53.5 -67.8 -39.6 71.1 8.0 44.9 207 229 A V H X S+ 0 0 0 -4,-2.2 4,-2.8 1,-0.2 5,-0.2 0.938 108.2 50.5 -61.3 -45.5 68.5 10.7 44.2 208 230 A R H X S+ 0 0 99 -4,-3.0 4,-1.0 1,-0.2 -1,-0.2 0.896 110.6 49.9 -59.6 -39.9 69.8 12.7 47.2 209 231 A E H < S+ 0 0 130 -4,-1.7 4,-0.3 -5,-0.2 -1,-0.2 0.873 113.2 45.6 -67.2 -38.8 73.3 12.3 45.9 210 232 A E H >< S+ 0 0 12 -4,-2.4 3,-1.0 1,-0.2 -2,-0.2 0.934 113.3 48.0 -70.8 -45.7 72.4 13.5 42.4 211 233 A L H 3< S+ 0 0 0 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.648 115.8 44.5 -71.6 -15.4 70.3 16.5 43.4 212 234 A N T 3< S+ 0 0 58 -4,-1.0 2,-0.4 -5,-0.2 -1,-0.2 0.364 83.4 119.6-107.7 2.5 72.9 17.7 45.9 213 235 A D X> - 0 0 63 -3,-1.0 3,-2.7 -4,-0.3 4,-0.7 -0.561 64.0-140.0 -71.2 123.7 75.8 17.2 43.5 214 236 A K G >4 S+ 0 0 175 -2,-0.4 3,-0.7 1,-0.3 -1,-0.2 0.832 102.8 61.5 -53.2 -35.4 77.5 20.6 42.9 215 237 A N G 34 S+ 0 0 138 1,-0.2 -1,-0.3 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41.4-102.4 -82.3 164.0 63.5 23.4 66.6 226 29 B P G > S+ 0 0 61 0, 0.0 3,-1.8 0, 0.0 -1,-0.1 0.880 121.6 59.1 -52.2 -41.9 60.5 25.7 65.6 227 30 B E G 3 S+ 0 0 148 1,-0.3 4,-0.1 4,-0.0 0, 0.0 0.684 97.1 62.5 -62.4 -20.7 62.7 27.3 62.9 228 31 B E G < S+ 0 0 104 -3,-1.8 -1,-0.3 2,-0.1 2,-0.2 0.423 78.8 100.1 -88.2 0.7 63.2 23.9 61.3 229 32 B S S < S- 0 0 14 -3,-1.8 2,-0.3 -4,-0.2 180,-0.1 -0.553 90.6-100.4 -78.8 151.9 59.5 23.4 60.5 230 33 B V - 0 0 8 -2,-0.2 2,-1.0 175,-0.1 -2,-0.1 -0.626 45.9-100.3 -75.0 132.7 58.7 24.2 56.9 231 34 B N >> - 0 0 66 -2,-0.3 3,-1.7 1,-0.2 4,-1.2 -0.337 36.7-168.0 -56.6 94.7 57.2 27.7 56.8 232 35 B S H 3> S+ 0 0 1 -2,-1.0 4,-1.5 83,-0.3 -1,-0.2 0.736 83.7 64.7 -58.9 -21.9 53.5 26.8 56.5 233 36 B Q H 34 S+ 0 0 51 1,-0.2 -1,-0.3 2,-0.2 -2,-0.1 0.805 102.3 50.3 -71.8 -26.8 52.7 30.4 55.7 234 37 B F H <4 S+ 0 0 49 -3,-1.7 -2,-0.2 1,-0.1 -1,-0.2 0.910 117.2 32.4 -79.0 -43.9 54.7 30.1 52.5 235 38 B Y H < S+ 0 0 4 -4,-1.2 -2,-0.2 2,-0.1 -3,-0.1 0.668 100.5 84.0 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K H X S+ 0 0 127 -4,-1.2 4,-0.8 2,-0.2 -1,-0.2 0.863 108.8 46.1 -72.2 -35.4 25.8 20.0 59.2 257 60 B G H >< S+ 0 0 5 -4,-1.5 3,-0.7 -3,-0.3 -2,-0.2 0.911 108.9 55.1 -71.2 -39.9 28.0 19.1 62.1 258 61 B Y H >< S+ 0 0 85 -4,-1.9 3,-1.2 1,-0.2 -1,-0.2 0.809 99.5 63.2 -62.4 -30.6 25.9 21.2 64.4 259 62 B A H 3< S+ 0 0 81 -4,-1.3 -1,-0.2 1,-0.3 -2,-0.2 0.831 97.9 53.4 -64.9 -35.4 22.8 19.2 63.4 260 63 B I T X< S+ 0 0 65 -4,-0.8 3,-2.0 -3,-0.7 6,-0.4 0.051 76.9 150.4 -90.3 26.8 24.1 15.8 64.7 261 64 B K T < + 0 0 94 -3,-1.2 -3,-0.1 1,-0.3 4,-0.0 -0.390 68.6 19.5 -60.5 129.3 24.8 17.3 68.2 262 65 B G T 3 S+ 0 0 63 1,-0.3 -1,-0.3 -2,-0.1 -2,-0.1 0.519 98.4 121.2 88.0 4.9 24.4 14.6 70.8 263 66 B S S <> S- 0 0 34 -3,-2.0 4,-1.6 1,-0.1 -1,-0.3 -0.404 79.2 -98.4 -93.9 174.7 24.8 11.7 68.3 264 67 B P H >> S+ 0 0 100 0, 0.0 4,-2.1 0, 0.0 3,-0.8 0.964 124.2 48.3 -56.9 -54.4 27.5 8.9 68.4 265 68 B R H 3> S+ 0 0 48 1,-0.3 4,-1.9 2,-0.2 5,-0.1 0.871 111.2 52.8 -54.3 -38.1 29.7 10.6 65.8 266 69 B W H 3> S+ 0 0 52 -6,-0.4 4,-1.2 1,-0.2 -1,-0.3 0.796 106.6 51.1 -68.9 -30.9 29.4 13.8 67.8 267 70 B K H < S+ 0 0 70 -4,-1.6 3,-1.2 1,-0.2 -2,-0.2 0.882 109.9 55.4 -71.8 -38.8 36.7 12.5 72.7 272 75 B D H 3< S+ 0 0 0 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.704 94.3 73.2 -65.2 -19.3 38.9 13.3 69.7 273 76 B A T 3< S+ 0 0 1 -4,-0.8 2,-0.7 -5,-0.2 -1,-0.2 0.799 81.1 79.5 -66.3 -29.2 39.1 16.9 71.0 274 77 B D < + 0 0 39 -3,-1.2 -1,-0.1 -4,-0.4 -4,-0.0 -0.728 52.9 179.0 -88.3 113.8 41.4 15.8 73.8 275 78 B I + 0 0 27 -2,-0.7 -1,-0.1 4,-0.1 2,-0.1 0.204 31.1 136.5 -98.3 15.2 45.0 15.5 72.7 276 79 B S >> - 0 0 41 1,-0.1 4,-2.3 4,-0.0 3,-0.7 -0.428 67.9-117.2 -60.8 134.5 46.5 14.5 76.1 277 80 B V H 3> S+ 0 0 18 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.838 113.4 58.7 -42.2 -43.3 48.9 11.7 75.4 278 81 B E H 3> S+ 0 0 120 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.941 110.3 40.6 -52.8 -54.7 46.8 9.3 77.6 279 82 B N H <> S+ 0 0 14 -3,-0.7 4,-2.2 1,-0.2 -1,-0.2 0.845 113.1 55.1 -65.0 -35.7 43.7 9.8 75.4 280 83 B I H X S+ 0 0 1 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.858 110.0 46.5 -66.5 -35.1 45.7 9.7 72.2 281 84 B A H X S+ 0 0 4 -4,-2.5 4,-2.3 -5,-0.3 11,-0.2 0.918 110.5 52.5 -71.9 -43.6 47.1 6.3 73.2 282 85 B R H < S+ 0 0 134 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.900 113.1 45.7 -58.1 -42.1 43.7 5.0 74.2 283 86 B I H X S+ 0 0 15 -4,-2.2 4,-0.6 1,-0.2 -2,-0.2 0.948 119.8 35.1 -68.9 -51.4 42.3 6.0 70.8 284 87 B F H X S+ 0 0 1 -4,-2.1 4,-3.1 1,-0.2 5,-0.4 0.663 95.3 84.2 -82.0 -16.6 45.1 4.7 68.5 285 88 B S H X>S+ 0 0 14 -4,-2.3 5,-2.2 1,-0.2 4,-1.3 0.938 96.5 42.1 -50.2 -53.4 46.0 1.6 70.4 286 89 B P H 45S+ 0 0 72 0, 0.0 -1,-0.2 0, 0.0 -2,-0.2 0.902 115.2 51.4 -62.0 -40.4 43.2 -0.5 68.9 287 90 B V H <5S+ 0 0 22 -4,-0.6 -2,-0.2 1,-0.2 90,-0.2 0.936 114.7 39.7 -63.7 -48.0 43.8 1.0 65.4 288 91 B V H <5S- 0 0 0 -4,-3.1 -1,-0.2 2,-0.2 -3,-0.2 0.671 112.1-124.5 -76.6 -13.3 47.6 0.2 65.4 289 92 B G T <5S+ 0 0 3 -4,-1.3 148,-1.8 -5,-0.4 2,-0.3 0.881 73.6 93.7 74.6 39.4 46.8 -3.1 67.0 290 93 B A B - 0 0 23 -2,-0.5 4,-2.8 1,-0.1 8,-0.3 -0.983 61.4-107.2-158.0 160.3 51.7 2.8 77.5 294 97 B P T 4 S+ 0 0 74 0, 0.0 7,-0.1 0, 0.0 -1,-0.1 0.928 119.5 39.0 -56.6 -48.0 54.5 4.4 79.4 295 98 B K T 4 S+ 0 0 178 1,-0.2 -3,-0.0 2,-0.1 0, 0.0 0.934 124.7 35.3 -69.9 -50.0 55.7 1.1 80.9 296 99 B D T 4 S+ 0 0 68 1,-0.2 -1,-0.2 2,-0.1 139,-0.1 0.787 131.6 25.6 -78.8 -29.8 55.1 -1.2 77.9 297 100 B T X + 0 0 0 -4,-2.8 4,-2.4 1,-0.1 -1,-0.2 -0.568 65.9 163.5-136.6 73.7 56.1 1.3 75.1 298 101 B P H > S+ 0 0 62 0, 0.0 4,-2.0 0, 0.0 5,-0.2 0.937 78.9 42.7 -55.2 -56.7 58.5 4.0 76.4 299 102 B E H > S+ 0 0 44 1,-0.2 4,-2.7 2,-0.2 127,-0.1 0.915 114.9 50.6 -60.7 -42.9 59.8 5.3 73.1 300 103 B T H > S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.911 107.5 54.4 -60.7 -42.8 56.3 5.2 71.5 301 104 B W H X S+ 0 0 35 -4,-2.4 4,-1.3 -8,-0.3 -1,-0.2 0.912 112.6 42.5 -58.5 -43.8 54.9 7.2 74.4 302 105 B N H X S+ 0 0 66 -4,-2.0 4,-2.7 1,-0.2 -1,-0.2 0.871 109.9 58.4 -70.7 -35.9 57.6 9.9 73.9 303 106 B M H X S+ 0 0 1 -4,-2.7 4,-2.7 1,-0.2 5,-0.2 0.925 102.6 54.2 -58.2 -45.2 57.1 9.8 70.2 304 107 B L H X S+ 0 0 2 -4,-2.6 4,-1.0 1,-0.2 -1,-0.2 0.897 113.9 40.2 -55.8 -44.2 53.4 10.6 70.6 305 108 B Q H X S+ 0 0 75 -4,-1.3 4,-1.4 2,-0.2 -1,-0.2 0.874 113.4 53.6 -73.8 -39.4 54.2 13.7 72.7 306 109 B N H X S+ 0 0 9 -4,-2.7 4,-2.1 1,-0.2 3,-0.3 0.917 107.4 51.1 -62.4 -44.5 57.1 14.8 70.5 307 110 B L H X>S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 5,-0.9 0.809 104.1 57.7 -65.1 -30.0 55.0 14.7 67.4 308 111 B L H X>S+ 0 0 29 -4,-1.0 5,-1.0 -5,-0.2 4,-0.6 0.887 108.4 49.0 -66.6 -35.4 52.3 16.9 69.0 309 112 B K H X>S+ 0 0 100 -4,-1.4 5,-2.6 -3,-0.3 4,-0.6 0.951 120.4 31.4 -68.8 -53.3 55.0 19.5 69.5 310 113 B V H <>S+ 0 0 0 -4,-2.1 5,-1.9 3,-0.2 -2,-0.2 0.863 133.6 30.0 -76.7 -34.8 56.6 19.6 66.0 311 114 B G H <5S+ 0 0 0 -4,-2.5 -3,-0.2 -5,-0.3 5,-0.2 0.901 123.4 41.2 -91.3 -49.4 53.4 18.8 64.1 312 115 B G H <X S+ 0 0 1 -3,-0.6 4,-2.4 -5,-0.2 -1,-0.2 0.561 92.2 94.8-102.9 -11.3 51.3 25.2 62.0 317 120 B A H X S+ 0 0 49 -4,-1.6 4,-2.4 1,-0.2 5,-0.3 0.872 81.0 46.5 -50.3 -57.4 52.6 28.2 63.9 318 121 B S H > S+ 0 0 43 -4,-0.5 4,-2.4 1,-0.2 -1,-0.2 0.926 116.6 44.6 -58.6 -45.9 53.6 30.7 61.2 319 122 B A H > S+ 0 0 0 -4,-0.2 4,-1.9 2,-0.2 5,-0.4 0.922 111.9 53.7 -64.4 -43.8 50.3 30.3 59.2 320 123 B K H X S+ 0 0 15 -4,-2.4 4,-2.5 1,-0.2 5,-0.3 0.947 114.5 39.3 -55.3 -53.0 48.2 30.5 62.4 321 124 B K H < S+ 0 0 169 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.904 110.7 60.4 -65.7 -41.3 49.7 33.8 63.6 322 125 B Y H < S+ 0 0 147 -4,-2.4 -1,-0.2 -5,-0.3 -2,-0.2 0.872 121.6 20.8 -55.4 -42.9 49.8 35.2 60.1 323 126 B Y H < S- 0 0 63 -4,-1.9 -1,-0.2 28,-0.3 -2,-0.2 0.724 76.6-162.2-100.6 -26.0 46.1 35.0 59.5 324 127 B M < - 0 0 99 -4,-2.5 -3,-0.1 -5,-0.4 -4,-0.1 0.864 25.0-164.1 41.7 44.4 44.6 34.8 63.0 325 128 B R - 0 0 28 -5,-0.3 25,-2.0 26,-0.2 2,-0.2 -0.250 16.7-114.0 -60.3 142.5 41.4 33.5 61.5 326 129 B T - 0 0 73 23,-0.1 -1,-0.1 -3,-0.1 20,-0.1 -0.538 28.6-118.8 -79.6 144.2 38.3 33.5 63.6 327 130 B R >> - 0 0 7 -2,-0.2 4,-2.2 1,-0.1 3,-0.8 -0.522 17.7-120.9 -83.1 148.1 36.8 30.2 64.7 328 131 B P H 3> S+ 0 0 0 0, 0.0 4,-2.7 0, 0.0 5,-0.3 0.905 110.7 55.2 -54.6 -47.4 33.2 29.2 63.7 329 132 B F H 34>S+ 0 0 0 63,-1.4 5,-2.6 1,-0.2 4,-0.1 0.785 111.0 47.8 -60.3 -25.2 31.9 28.8 67.2 330 133 B V H X45S+ 0 0 48 -3,-0.8 3,-0.5 3,-0.2 -1,-0.2 0.907 110.7 51.4 -78.1 -44.3 33.1 32.3 67.9 331 134 B L H 3<5S+ 0 0 89 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.1 0.935 120.2 32.5 -57.2 -51.8 31.5 33.7 64.7 332 135 B F T 3<5S- 0 0 58 -4,-2.7 -1,-0.2 -5,-0.1 -2,-0.2 0.405 108.3-123.3 -89.1 3.1 28.1 32.2 65.3 333 136 B N T < 5 + 0 0 132 -3,-0.5 2,-0.2 -5,-0.3 -3,-0.2 0.954 62.7 141.4 52.9 57.3 28.4 32.6 69.1 334 137 B H < - 0 0 58 -5,-2.6 2,-0.4 -6,-0.1 -1,-0.2 -0.696 53.6-103.6-121.3 173.6 27.8 28.9 69.7 335 138 B S - 0 0 54 -2,-0.2 2,-0.1 1,-0.1 -5,-0.0 -0.799 30.9-139.7-101.6 142.0 29.2 26.2 72.1 336 139 B T - 0 0 6 -2,-0.4 56,-0.2 1,-0.1 55,-0.1 -0.174 31.2 -98.4 -86.4-174.0 31.6 23.5 70.9 337 140 B b S S+ 0 0 10 54,-1.4 55,-0.1 1,-0.3 -64,-0.1 0.533 120.1 42.2 -84.8 -6.7 31.7 19.8 71.7 338 141 B R > + 0 0 64 53,-0.3 3,-1.7 1,-0.1 4,-0.3 -0.567 68.6 179.5-142.0 72.0 34.4 20.4 74.4 339 142 B P G > S+ 0 0 74 0, 0.0 3,-1.1 0, 0.0 4,-0.3 0.698 74.2 67.5 -43.4 -36.4 33.4 23.7 76.3 340 143 B E G > S+ 0 0 151 1,-0.2 3,-0.5 2,-0.1 4,-0.3 0.851 99.2 50.1 -58.9 -38.6 36.5 23.5 78.6 341 144 B D G X> S+ 0 0 51 -3,-1.7 4,-2.3 1,-0.2 3,-0.6 0.518 84.9 94.7 -80.8 -5.4 38.9 24.2 75.8 342 145 B E H <> S+ 0 0 27 -3,-1.1 4,-2.2 -4,-0.3 -1,-0.2 0.840 77.2 54.4 -58.8 -39.7 37.1 27.2 74.5 343 146 B N H <4 S+ 0 0 125 -3,-0.5 4,-0.4 -4,-0.3 -1,-0.2 0.863 113.3 45.9 -65.1 -29.8 38.9 30.0 76.3 344 147 B T H X4 S+ 0 0 102 -3,-0.6 3,-1.3 -4,-0.3 4,-0.4 0.932 110.2 51.9 -74.6 -47.1 42.2 28.6 74.8 345 148 B L H >< S+ 0 0 17 -4,-2.3 3,-2.2 1,-0.3 -2,-0.2 0.891 99.7 64.1 -55.5 -44.6 40.8 28.2 71.3 346 149 B R T 3< S+ 0 0 119 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.733 104.1 47.8 -52.1 -28.2 39.6 31.8 71.2 347 150 B K T < S+ 0 0 175 -3,-1.3 2,-0.5 -4,-0.4 -1,-0.3 0.513 100.2 82.1 -92.5 -7.1 43.2 32.9 71.5 348 151 B D S < S- 0 0 63 -3,-2.2 -21,-0.1 -4,-0.4 -27,-0.0 -0.876 85.7-111.5-110.0 128.7 44.5 30.6 68.8 349 152 B G - 0 0 1 -2,-0.5 -23,-0.1 1,-0.1 -28,-0.1 -0.220 22.2-142.6 -51.3 136.2 44.4 31.3 65.0 350 153 B S + 0 0 0 -25,-2.0 -1,-0.1 -30,-0.1 45,-0.1 0.811 64.1 103.1 -73.5 -34.0 41.9 28.9 63.3 351 154 B Y S S+ 0 0 7 -31,-0.2 -28,-0.3 -32,-0.2 -26,-0.2 -0.878 82.8 17.5-108.6 120.8 43.9 28.2 60.1 352 155 B P S S- 0 0 0 0, 0.0 2,-0.4 0, 0.0 47,-0.2 0.614 89.1-121.0 -93.2 176.8 45.3 25.7 59.9 353 156 B S > - 0 0 0 45,-1.9 4,-1.8 1,-0.1 5,-0.1 -0.612 15.3-164.0 -79.4 126.0 44.1 23.0 62.4 354 157 B G H > S+ 0 0 11 -2,-0.4 4,-2.6 2,-0.2 5,-0.2 0.885 90.1 54.7 -75.1 -42.3 46.8 21.7 64.8 355 158 B H H > S+ 0 0 26 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.923 111.5 47.8 -55.9 -43.8 44.8 18.6 65.9 356 159 B T H > S+ 0 0 0 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.931 110.8 48.7 -63.0 -48.8 44.4 17.7 62.2 357 160 B A H X S+ 0 0 0 -4,-1.8 4,-2.3 1,-0.2 -1,-0.2 0.880 114.7 47.4 -59.7 -39.7 48.1 18.2 61.4 358 161 B Y H X S+ 0 0 2 -4,-2.6 4,-3.3 2,-0.2 -2,-0.2 0.959 112.8 45.9 -67.4 -52.4 49.0 16.1 64.4 359 162 B S H X S+ 0 0 0 -4,-2.8 4,-2.8 2,-0.2 -2,-0.2 0.902 114.6 48.6 -59.1 -43.0 46.6 13.2 63.7 360 163 B T H X S+ 0 0 0 -4,-2.7 4,-2.3 2,-0.2 -1,-0.2 0.968 114.3 45.1 -60.8 -53.7 47.7 13.1 60.1 361 164 B L H X S+ 0 0 0 -4,-2.3 4,-2.5 -5,-0.3 -2,-0.2 0.922 114.7 50.0 -54.3 -46.2 51.4 13.1 61.0 362 165 B L H X S+ 0 0 1 -4,-3.3 4,-2.5 1,-0.2 5,-0.3 0.896 107.6 52.2 -61.0 -44.4 50.7 10.5 63.7 363 166 B A H X S+ 0 0 0 -4,-2.8 4,-1.8 1,-0.2 -1,-0.2 0.933 112.4 47.0 -58.6 -46.0 48.8 8.2 61.3 364 167 B L H X S+ 0 0 3 -4,-2.3 4,-1.4 2,-0.2 -2,-0.2 0.900 111.2 49.5 -64.1 -44.5 51.7 8.4 58.9 365 168 B V H X S+ 0 0 0 -4,-2.5 4,-1.0 1,-0.2 3,-0.2 0.916 113.1 46.5 -63.8 -41.7 54.4 7.7 61.5 366 169 B L H X S+ 0 0 1 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.836 109.3 55.7 -68.8 -31.2 52.5 4.7 62.9 367 170 B S H < S+ 0 0 10 -4,-1.8 -1,-0.2 -5,-0.3 -2,-0.2 0.770 104.9 52.6 -70.4 -26.8 51.9 3.4 59.4 368 171 B Q H < S+ 0 0 7 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6,-2.0 -4,-0.5 5,-1.0 0.823 107.6 46.0 -66.9 -30.8 37.2 19.3 64.5 389 192 B V H X<5S+ 0 0 6 -3,-0.9 3,-1.0 -4,-0.6 -2,-0.2 0.948 116.3 44.0 -74.3 -49.9 34.6 20.4 61.9 390 193 B I H 3<5S+ 0 0 25 -4,-2.3 -2,-0.2 1,-0.2 -3,-0.2 0.806 109.5 57.6 -64.2 -31.2 31.8 18.5 63.7 391 194 B b T 3<5S- 0 0 5 -4,-2.4 -54,-1.4 -5,-0.2 -53,-0.3 0.651 110.8-121.0 -75.6 -15.5 33.0 19.8 67.1 392 195 B G T < 5S+ 0 0 6 -3,-1.0 -63,-1.4 -4,-0.5 -3,-0.2 0.441 85.2 108.9 89.8 1.9 32.6 23.4 65.9 393 196 B A S > - 0 0 5 -2,-0.3 4,-1.4 1,-0.1 3,-1.2 -0.585 38.9-113.0 -85.8 152.9 36.2 25.4 59.4 396 199 B Q H 3> S+ 0 0 10 1,-0.3 4,-2.4 -146,-0.2 3,-0.4 0.900 119.2 58.0 -53.9 -39.7 36.4 22.5 56.9 397 200 B S H 3> S+ 0 0 14 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.790 99.6 56.6 -64.1 -25.7 39.1 24.5 55.1 398 201 B D H <> S+ 0 0 0 -3,-1.2 -45,-1.9 2,-0.2 4,-1.6 0.877 110.3 45.8 -69.9 -37.7 41.3 24.6 58.3 399 202 B V H X S+ 0 0 0 -4,-1.4 4,-2.0 -3,-0.4 -2,-0.2 0.913 108.6 53.6 -71.6 -45.0 41.2 20.8 58.4 400 203 B D H X S+ 0 0 37 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1,-0.2 -2,-0.2 0.531 115.9 48.2 -80.6 -7.1 54.7 -2.0 68.4 431 234 B N H < S+ 0 0 61 -4,-0.7 -1,-0.2 -3,-0.3 -2,-0.2 0.489 83.4 117.6-107.0 -8.7 55.8 -5.2 66.6 432 235 B D >< - 0 0 68 -4,-0.8 3,-1.1 -3,-0.4 4,-0.2 -0.370 68.6-132.8 -62.0 133.2 56.7 -7.0 69.9 433 236 B K G > S+ 0 0 165 1,-0.3 3,-1.1 2,-0.2 -1,-0.1 0.825 103.5 59.1 -57.3 -35.5 54.5 -10.1 70.5 434 237 B N G 3 S+ 0 0 142 1,-0.2 -1,-0.3 -138,-0.0 -2,-0.1 0.756 106.2 47.7 -68.7 -24.0 53.9 -9.1 74.1 435 238 B N G < S+ 0 0 14 -3,-1.1 -144,-1.8 -6,-0.2 -1,-0.2 0.311 81.5 127.8 -99.9 9.1 52.3 -5.8 73.1 436 239 B L B < -B 290 0B 78 -3,-1.1 2,-0.4 -4,-0.2 -146,-0.3 -0.401 37.9-170.0 -67.0 139.9 50.0 -7.2 70.4 437 240 B L 0 0 65 -148,-1.8 -2,-0.0 -152,-0.1 -3,-0.0 -0.993 360.0 360.0-136.4 142.2 46.4 -6.2 70.8 438 241 B S 0 0 160 -2,-0.4 -2,-0.0 -148,-0.0 -148,-0.0 -0.581 360.0 360.0-101.8 360.0 43.1 -7.4 69.0 439 !* 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 0.0 440 23 C M 0 0 136 0, 0.0 83,-0.0 0, 0.0 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64 C K T < + 0 0 97 -3,-0.9 -3,-0.1 1,-0.3 4,-0.0 -0.265 66.2 17.7 -56.7 139.5 34.5 -13.7 -22.0 482 65 C G T 3 S+ 0 0 50 1,-0.2 -1,-0.3 2,-0.1 -2,-0.1 0.287 99.1 124.0 80.7 -12.4 31.6 -14.9 -24.2 483 66 C S S <> S- 0 0 32 -3,-2.0 4,-1.8 1,-0.1 -1,-0.2 -0.145 79.9 -97.7 -74.1 173.9 30.0 -16.8 -21.2 484 67 C P H > S+ 0 0 110 0, 0.0 4,-2.0 0, 0.0 5,-0.2 0.912 124.8 50.6 -59.9 -44.0 26.4 -16.2 -20.0 485 68 C R H > S+ 0 0 57 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.879 107.9 54.3 -62.9 -36.2 27.5 -13.8 -17.2 486 69 C W H > S+ 0 0 28 -6,-0.4 4,-1.4 1,-0.2 -1,-0.2 0.875 107.5 49.8 -64.7 -37.5 29.5 -11.8 -19.8 487 70 C K H X S+ 0 0 137 -4,-1.8 4,-1.7 1,-0.2 -1,-0.2 0.881 109.1 52.1 -68.7 -35.9 26.4 -11.5 -22.0 488 71 C Q H X S+ 0 0 59 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.856 106.0 54.6 -67.2 -33.3 24.4 -10.3 -18.9 489 72 C A H X S+ 0 0 0 -4,-1.9 4,-1.3 1,-0.2 -1,-0.2 0.845 105.7 53.8 -67.0 -33.1 27.2 -7.7 -18.3 490 73 C A H < S+ 0 0 28 -4,-1.4 4,-0.4 2,-0.2 -2,-0.2 0.879 109.8 46.1 -67.6 -41.5 26.6 -6.5 -21.9 491 74 C E H >< S+ 0 0 112 -4,-1.7 3,-1.4 1,-0.2 -2,-0.2 0.919 110.6 53.2 -67.2 -44.3 22.9 -6.0 -21.3 492 75 C D H 3< S+ 0 0 0 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.803 97.0 68.0 -60.7 -29.9 23.5 -4.2 -18.0 493 76 C A T 3< S+ 0 0 1 -4,-1.3 2,-0.9 -5,-0.1 -1,-0.3 0.708 81.9 85.0 -64.0 -21.9 25.9 -1.8 -19.8 494 77 C D < + 0 0 40 -3,-1.4 -1,-0.1 -4,-0.4 -4,-0.0 -0.732 53.1 175.6 -85.5 105.6 23.0 -0.3 -21.7 495 78 C I + 0 0 27 -2,-0.9 -1,-0.1 4,-0.1 -2,-0.1 0.216 28.9 133.4 -98.3 18.2 21.5 2.3 -19.4 496 79 C S S > S- 0 0 43 1,-0.1 4,-2.5 4,-0.1 3,-0.5 -0.381 70.6-114.3 -63.6 145.1 18.9 3.7 -21.8 497 80 C V H > S+ 0 0 16 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.870 115.8 57.5 -50.1 -39.5 15.5 4.0 -20.1 498 81 C E H > S+ 0 0 102 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.925 110.5 41.5 -58.5 -48.0 14.1 1.3 -22.3 499 82 C N H > S+ 0 0 8 -3,-0.5 4,-2.3 2,-0.2 -1,-0.2 0.899 114.9 50.1 -69.2 -39.9 16.7 -1.2 -21.3 500 83 C I H X S+ 0 0 0 -4,-2.5 4,-2.8 2,-0.2 5,-0.3 0.930 110.0 50.8 -63.5 -45.0 16.6 -0.3 -17.6 501 84 C A H X S+ 0 0 4 -4,-2.9 4,-1.8 -5,-0.3 -1,-0.2 0.894 111.5 49.2 -59.3 -39.4 12.8 -0.6 -17.6 502 85 C R H < S+ 0 0 157 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.876 112.1 47.9 -68.3 -37.7 13.1 -4.0 -19.2 503 86 C I H X S+ 0 0 17 -4,-2.3 4,-0.5 1,-0.2 -2,-0.2 0.923 120.6 33.7 -71.2 -42.7 15.7 -5.2 -16.7 504 87 C F H X S+ 0 0 1 -4,-2.8 4,-3.4 1,-0.2 5,-0.4 0.660 95.0 83.3 -90.4 -15.0 13.9 -4.1 -13.5 505 88 C S H X>S+ 0 0 20 -4,-1.8 4,-1.5 -5,-0.3 5,-1.4 0.901 98.6 43.3 -54.2 -42.8 10.3 -4.6 -14.5 506 89 C P H 45S+ 0 0 77 0, 0.0 -1,-0.2 0, 0.0 -2,-0.2 0.883 114.7 50.2 -70.8 -35.6 10.6 -8.3 -13.6 507 90 C V H <5S+ 0 0 21 -4,-0.5 -2,-0.2 1,-0.2 90,-0.2 0.906 115.6 40.6 -68.9 -42.3 12.5 -7.5 -10.4 508 91 C V H <5S- 0 0 0 -4,-3.4 -1,-0.2 2,-0.2 -3,-0.2 0.768 106.8-129.7 -78.0 -25.0 10.0 -4.9 -9.2 509 92 C G T <5S+ 0 0 15 -4,-1.5 148,-1.7 -5,-0.4 2,-0.3 0.794 73.7 93.4 81.9 28.8 7.1 -7.1 -10.4 510 93 C A B - 0 0 24 -2,-0.5 4,-2.4 1,-0.1 8,-0.3 -0.982 61.4-109.4-154.0 160.7 6.3 1.9 -19.6 514 97 C P T 4 S+ 0 0 74 0, 0.0 7,-0.1 0, 0.0 -1,-0.1 0.879 118.4 44.5 -59.1 -38.5 5.7 5.5 -20.7 515 98 C K T 4 S+ 0 0 179 2,-0.1 -3,-0.0 1,-0.1 6,-0.0 0.968 123.0 29.7 -70.9 -57.6 2.0 4.8 -21.0 516 99 C D T 4 S+ 0 0 46 1,-0.2 3,-0.1 2,-0.1 -1,-0.1 0.810 134.3 25.8 -77.6 -33.8 1.2 2.8 -17.9 517 100 C T X + 0 0 0 -4,-2.4 4,-2.3 1,-0.1 -1,-0.2 -0.490 66.8 159.9-131.3 65.1 3.8 4.3 -15.5 518 101 C P H > S+ 0 0 63 0, 0.0 4,-1.3 0, 0.0 -1,-0.1 0.821 77.9 48.3 -55.8 -35.4 4.6 7.8 -16.8 519 102 C E H > S+ 0 0 48 2,-0.2 4,-2.1 1,-0.2 127,-0.2 0.881 112.2 47.7 -75.6 -36.3 6.0 9.0 -13.4 520 103 C T H > S+ 0 0 0 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.832 107.4 58.3 -70.4 -32.4 8.2 5.9 -13.0 521 104 C W H X S+ 0 0 37 -4,-2.3 4,-0.7 -8,-0.3 -1,-0.2 0.876 111.5 40.4 -64.8 -38.6 9.4 6.3 -16.5 522 105 C N H X S+ 0 0 56 -4,-1.3 4,-2.5 -5,-0.2 3,-0.4 0.853 109.5 60.0 -77.5 -35.2 10.6 9.9 -15.7 523 106 C M H X S+ 0 0 1 -4,-2.1 4,-2.4 1,-0.2 5,-0.2 0.906 102.4 54.2 -56.7 -43.6 11.9 8.8 -12.3 524 107 C L H X S+ 0 0 2 -4,-2.1 4,-0.6 1,-0.2 -1,-0.2 0.808 113.0 41.2 -61.3 -34.8 14.3 6.3 -14.1 525 108 C Q H X S+ 0 0 70 -4,-0.7 4,-1.0 -3,-0.4 -1,-0.2 0.793 113.4 53.2 -84.0 -32.0 15.8 9.0 -16.3 526 109 C N H X S+ 0 0 12 -4,-2.5 4,-2.2 1,-0.2 3,-0.3 0.887 106.4 51.5 -71.2 -39.7 16.0 11.6 -13.6 527 110 C L H X>S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 5,-0.9 0.810 104.8 59.0 -66.6 -28.2 17.9 9.3 -11.2 528 111 C L H <>S+ 0 0 33 -4,-0.6 5,-0.8 -5,-0.2 4,-0.4 0.843 108.7 44.9 -68.3 -34.1 20.4 8.7 -14.0 529 112 C K H X>S+ 0 0 106 -4,-1.0 5,-2.4 -3,-0.3 4,-0.7 0.934 123.2 32.3 -75.0 -50.5 21.1 12.4 -14.2 530 113 C V H <>S+ 0 0 0 -4,-2.2 5,-1.9 3,-0.2 -2,-0.2 0.868 132.3 30.0 -78.1 -38.0 21.4 13.0 -10.4 531 114 C G T <5S+ 0 0 0 -4,-2.6 -3,-0.2 -5,-0.3 -2,-0.1 0.806 124.9 42.4 -92.4 -33.7 22.9 9.7 -9.3 532 115 C G T 4 S+ 0 0 1 -3,-0.2 4,-2.1 2,-0.1 -1,-0.2 0.562 92.1 96.4-104.2 -14.1 29.9 11.1 -9.3 537 120 C A H X S+ 0 0 30 -4,-1.5 4,-2.5 -3,-0.3 5,-0.3 0.870 80.0 44.6 -44.1 -65.9 31.2 14.1 -11.1 538 121 C S H > S+ 0 0 47 -4,-0.5 4,-1.8 1,-0.2 -1,-0.2 0.854 116.4 45.2 -56.4 -41.7 33.7 15.8 -8.8 539 122 C A H > S+ 0 0 0 -3,-0.2 4,-1.7 2,-0.2 5,-0.3 0.898 112.6 53.7 -70.1 -37.7 35.5 12.6 -7.8 540 123 C K H X S+ 0 0 13 -4,-2.1 4,-2.0 1,-0.2 5,-0.3 0.949 114.8 38.0 -59.4 -51.7 35.6 11.5 -11.4 541 124 C K H < S+ 0 0 156 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.788 110.7 60.6 -73.7 -27.6 37.2 14.6 -12.8 542 125 C Y H < S+ 0 0 155 -4,-1.8 -1,-0.2 -5,-0.3 -2,-0.2 0.911 120.7 22.4 -67.1 -42.8 39.5 15.1 -9.8 543 126 C Y H < S- 0 0 64 -4,-1.7 -2,-0.2 28,-0.3 -1,-0.2 0.688 78.5-161.0 -98.0 -22.5 41.4 11.8 -10.2 544 127 C M < - 0 0 94 -4,-2.0 2,-0.1 -5,-0.3 -3,-0.1 0.887 23.7-161.0 37.5 52.0 40.7 11.1 -13.9 545 128 C R - 0 0 25 -5,-0.3 25,-2.2 26,-0.2 -1,-0.2 -0.410 17.4-112.2 -65.6 135.0 41.6 7.5 -13.1 546 129 C T - 0 0 75 -3,-0.2 -1,-0.1 23,-0.1 20,-0.1 -0.434 30.8-120.5 -69.8 137.9 42.5 5.4 -16.1 547 130 C R > - 0 0 8 -2,-0.1 4,-2.3 18,-0.1 3,-0.5 -0.462 19.3-118.2 -77.2 150.8 40.1 2.7 -17.0 548 131 C P H > S+ 0 0 0 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.905 111.4 52.2 -56.6 -45.9 41.3 -0.9 -17.0 549 132 C F H 4>S+ 0 0 0 63,-1.1 5,-2.0 1,-0.2 4,-0.3 0.809 111.3 49.9 -64.0 -25.4 40.6 -1.7 -20.7 550 133 C V H >45S+ 0 0 37 -3,-0.5 3,-1.0 3,-0.2 -1,-0.2 0.944 110.9 47.5 -75.2 -48.7 42.5 1.4 -21.6 551 134 C L H 3<5S+ 0 0 84 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.879 121.2 37.0 -59.3 -40.3 45.5 0.5 -19.4 552 135 C F T 3<5S- 0 0 46 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.326 104.6-123.6 -98.2 8.2 45.6 -3.1 -20.8 553 136 C N T < 5 + 0 0 135 -3,-1.0 2,-0.3 -4,-0.3 -3,-0.2 0.915 65.1 132.0 50.8 51.9 44.7 -2.3 -24.4 554 137 C H < - 0 0 58 -5,-2.0 -1,-0.2 -6,-0.1 2,-0.2 -0.884 54.7-118.8-127.1 159.0 41.7 -4.7 -24.4 555 138 C S - 0 0 55 -2,-0.3 2,-0.1 1,-0.1 -5,-0.0 -0.548 30.0-126.2 -94.3 165.2 38.1 -4.1 -25.7 556 139 C T - 0 0 6 -2,-0.2 56,-0.2 1,-0.0 -1,-0.1 -0.395 28.2 -93.6-105.7-176.6 35.1 -4.4 -23.4 557 140 C c S S+ 0 0 13 54,-1.3 55,-0.1 1,-0.3 54,-0.1 0.614 123.1 39.6 -70.8 -13.6 31.7 -6.2 -23.3 558 141 C R S >> S- 0 0 56 53,-0.2 3,-1.5 1,-0.1 4,-0.6 -0.598 71.4-177.4-138.3 74.1 30.1 -3.2 -25.0 559 142 C P G >4 S+ 0 0 69 0, 0.0 3,-0.6 0, 0.0 4,-0.3 0.708 75.8 62.1 -41.9 -37.8 32.5 -1.9 -27.7 560 143 C E G >4 S+ 0 0 126 1,-0.2 3,-0.6 2,-0.1 4,-0.3 0.840 99.3 54.8 -65.8 -32.1 30.4 1.1 -28.9 561 144 C D G X> S+ 0 0 38 -3,-1.5 4,-1.9 1,-0.2 3,-1.1 0.724 86.9 88.1 -71.2 -22.2 30.5 2.8 -25.4 562 145 C E H S+ 0 0 99 -3,-1.1 3,-1.4 -4,-0.3 4,-0.5 0.912 110.5 53.8 -75.1 -44.1 33.0 7.9 -24.6 565 148 C L H >< S+ 0 0 16 -4,-1.9 3,-1.3 1,-0.3 -2,-0.2 0.828 94.0 69.9 -60.8 -35.8 34.5 6.0 -21.6 566 149 C R T 3< S+ 0 0 128 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.1 0.713 105.5 41.7 -55.9 -22.4 38.1 6.8 -22.6 567 150 C K T <4 S+ 0 0 167 -3,-1.4 2,-0.5 -4,-0.3 -1,-0.3 0.548 100.6 89.3-100.7 -11.8 37.5 10.4 -21.7 568 151 C D S << S- 0 0 58 -3,-1.3 -21,-0.1 -4,-0.5 -27,-0.0 -0.778 84.7-110.9 -97.5 126.2 35.5 9.7 -18.6 569 152 C G - 0 0 2 -2,-0.5 -23,-0.1 1,-0.1 -28,-0.1 -0.250 21.5-144.6 -52.2 131.2 37.2 9.3 -15.2 570 153 C S + 0 0 0 -25,-2.2 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0.848 109.2 55.3 -71.1 -31.4 37.6 4.7 20.1 712 75 D D T 3< S+ 0 0 1 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.645 94.7 70.4 -73.1 -16.7 35.4 3.7 17.1 713 76 D A T 34 S+ 0 0 3 -4,-0.5 2,-0.8 -3,-0.4 -1,-0.2 0.794 78.9 83.0 -72.4 -29.0 35.1 0.2 18.5 714 77 D D << + 0 0 20 -3,-0.7 -1,-0.1 -4,-0.6 -4,-0.0 -0.679 53.5 178.2 -81.4 107.7 32.9 1.2 21.4 715 78 D I + 0 0 27 -2,-0.8 -1,-0.1 4,-0.1 33,-0.1 0.226 31.8 133.3 -94.7 14.3 29.3 1.4 20.1 716 79 D S S > S- 0 0 37 1,-0.1 4,-2.1 4,-0.1 3,-0.3 -0.325 70.4-113.8 -58.9 149.9 27.8 2.4 23.5 717 80 D V H > S+ 0 0 16 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.884 114.1 58.1 -56.7 -41.4 25.4 5.3 22.9 718 81 D E H > S+ 0 0 120 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.926 110.8 43.0 -54.4 -46.6 27.5 7.7 25.0 719 82 D N H > S+ 0 0 8 -3,-0.3 4,-2.7 2,-0.2 -1,-0.2 0.894 112.9 50.8 -68.1 -42.2 30.5 7.1 22.7 720 83 D I H X S+ 0 0 1 -4,-2.1 4,-2.6 2,-0.2 5,-0.2 0.932 112.3 47.5 -61.6 -45.9 28.5 7.3 19.4 721 84 D A H X S+ 0 0 2 -4,-2.9 4,-2.0 1,-0.2 11,-0.2 0.889 111.3 52.0 -62.5 -38.9 27.0 10.6 20.5 722 85 D R H < S+ 0 0 51 -4,-2.0 -2,-0.2 -5,-0.3 -1,-0.2 0.933 112.6 45.2 -62.3 -46.1 30.4 11.8 21.5 723 86 D I H < S+ 0 0 14 -4,-2.7 4,-0.5 1,-0.2 -2,-0.2 0.890 120.0 37.9 -66.3 -41.8 31.8 10.9 18.1 724 87 D F H X S+ 0 0 0 -4,-2.6 4,-3.0 -5,-0.2 5,-0.3 0.651 93.6 82.4 -89.3 -15.7 29.0 12.3 15.9 725 88 D S H X>S+ 0 0 11 -4,-2.0 5,-2.5 1,-0.2 4,-1.2 0.943 99.7 39.0 -53.2 -52.9 28.1 15.5 17.9 726 89 D P H 45S+ 0 0 77 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.815 115.7 53.0 -69.3 -28.8 30.9 17.5 16.3 727 90 D V H 45S+ 0 0 23 -4,-0.5 -2,-0.2 1,-0.2 90,-0.2 0.916 116.8 36.8 -72.8 -42.3 30.4 15.9 12.9 728 91 D V H <5S- 0 0 0 -4,-3.0 -1,-0.2 2,-0.2 -3,-0.2 0.647 112.0-124.7 -82.6 -12.9 26.6 16.7 12.8 729 92 D G T <5S+ 0 0 5 -4,-1.2 148,-1.6 -5,-0.3 2,-0.3 0.874 72.8 97.2 74.2 39.1 27.3 20.0 14.5 730 93 D A B - 0 0 12 -2,-0.6 4,-2.6 1,-0.1 8,-0.3 -0.984 63.1-104.0-159.2 160.8 22.6 14.0 25.0 734 97 D P T 4 S+ 0 0 66 0, 0.0 7,-0.1 0, 0.0 -1,-0.1 0.924 118.2 36.5 -53.2 -53.3 19.6 12.4 26.9 735 98 D K T 4 S+ 0 0 197 2,-0.1 -3,-0.0 1,-0.1 0, 0.0 0.820 123.5 40.2 -74.7 -33.4 18.3 15.7 28.4 736 99 D D T 4 S+ 0 0 82 1,-0.2 -1,-0.1 2,-0.1 -4,-0.1 0.880 133.0 16.5 -85.2 -39.3 19.0 18.0 25.4 737 100 D T X + 0 0 0 -4,-2.6 4,-2.0 1,-0.1 -1,-0.2 -0.557 68.7 164.8-133.2 69.3 18.0 15.7 22.5 738 101 D P H > S+ 0 0 62 0, 0.0 4,-1.9 0, 0.0 5,-0.2 0.857 77.3 48.7 -55.1 -40.6 15.9 12.8 23.9 739 102 D E H > S+ 0 0 42 2,-0.2 4,-2.3 1,-0.2 127,-0.2 0.897 110.7 50.4 -69.1 -38.2 14.5 11.7 20.6 740 103 D T H > S+ 0 0 0 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.862 108.6 54.2 -64.6 -36.9 17.9 11.7 18.9 741 104 D W H X S+ 0 0 34 -4,-2.0 4,-1.4 -8,-0.3 -1,-0.2 0.917 110.1 44.9 -63.1 -46.4 19.2 9.6 21.8 742 105 D N H X S+ 0 0 64 -4,-1.9 4,-2.9 1,-0.2 -2,-0.2 0.885 110.6 56.8 -64.8 -38.1 16.5 7.0 21.3 743 106 D M H X S+ 0 0 2 -4,-2.3 4,-2.7 1,-0.2 5,-0.2 0.920 103.0 52.9 -59.3 -46.8 17.2 7.1 17.6 744 107 D L H X S+ 0 0 1 -4,-2.3 4,-1.0 1,-0.2 -1,-0.2 0.873 115.4 40.9 -57.1 -40.4 20.9 6.2 18.1 745 108 D Q H X S+ 0 0 79 -4,-1.4 4,-1.5 2,-0.2 -2,-0.2 0.865 113.9 51.9 -76.6 -38.8 19.9 3.2 20.2 746 109 D N H X S+ 0 0 9 -4,-2.9 4,-2.2 1,-0.2 5,-0.2 0.882 108.9 50.7 -66.2 -38.9 17.0 2.2 17.9 747 110 D L H X>S+ 0 0 0 -4,-2.7 4,-2.7 1,-0.2 5,-0.9 0.847 104.9 57.5 -68.1 -34.0 19.2 2.2 14.8 748 111 D L H X>S+ 0 0 34 -4,-1.0 4,-1.2 -5,-0.2 5,-1.1 0.921 110.0 45.0 -61.5 -43.7 21.9 0.1 16.5 749 112 D K H X>S+ 0 0 88 -4,-1.5 5,-2.6 3,-0.2 4,-0.5 0.926 119.7 37.6 -68.1 -46.8 19.3 -2.6 17.1 750 113 D V H <>S+ 0 0 0 -4,-2.2 5,-1.7 3,-0.2 -2,-0.2 0.898 133.4 22.4 -75.4 -38.9 17.6 -2.6 13.6 751 114 D G H <5S+ 0 0 0 -4,-2.7 -3,-0.2 -5,-0.2 -2,-0.2 0.772 124.9 48.2 -99.0 -32.0 20.7 -2.0 11.5 752 115 D G H <X S+ 0 0 0 -3,-0.9 4,-1.9 2,-0.1 3,-0.3 0.643 91.7 93.1-104.6 -17.9 23.0 -8.4 9.5 757 120 D A H X S+ 0 0 50 -4,-1.9 4,-2.5 1,-0.2 5,-0.3 0.838 81.7 47.9 -42.3 -61.5 21.7 -11.4 11.4 758 121 D S H > S+ 0 0 41 -4,-0.5 4,-2.2 1,-0.2 -1,-0.2 0.898 116.4 43.2 -55.7 -45.8 20.7 -13.8 8.7 759 122 D A H > S+ 0 0 0 -3,-0.3 4,-1.4 2,-0.2 5,-0.3 0.807 112.2 55.6 -71.8 -28.4 24.0 -13.5 6.8 760 123 D K H X S+ 0 0 13 -4,-1.9 4,-2.3 2,-0.2 31,-0.2 0.952 113.4 38.9 -66.9 -50.1 26.0 -13.6 10.0 761 124 D K H < S+ 0 0 169 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.898 112.0 58.2 -66.0 -42.7 24.5 -16.9 11.1 762 125 D Y H < S+ 0 0 146 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.848 122.6 21.4 -58.7 -38.6 24.5 -18.4 7.6 763 126 D Y H < S- 0 0 60 -4,-1.4 -1,-0.2 28,-0.3 -2,-0.2 0.725 75.6-165.1-103.0 -28.1 28.3 -18.1 7.0 764 127 D M < - 0 0 102 -4,-2.3 -3,-0.1 -5,-0.3 -4,-0.1 0.846 23.9-164.7 40.4 43.7 29.7 -17.8 10.6 765 128 D R - 0 0 28 -5,-0.2 25,-1.9 26,-0.2 2,-0.3 -0.219 17.3-114.1 -58.0 144.8 32.9 -16.5 9.0 766 129 D T - 0 0 77 23,-0.1 -1,-0.1 -3,-0.1 20,-0.1 -0.608 29.7-117.9 -83.5 142.1 36.0 -16.5 11.3 767 130 D R >> - 0 0 6 -2,-0.3 4,-1.9 19,-0.1 3,-0.5 -0.426 19.1-116.9 -79.0 152.1 37.5 -13.1 12.2 768 131 D P H 3> S+ 0 0 0 0, 0.0 4,-2.4 0, 0.0 5,-0.3 0.905 111.3 50.0 -53.3 -52.4 41.1 -12.1 11.3 769 132 D F H 34>S+ 0 0 1 63,-1.3 5,-2.3 1,-0.2 4,-0.3 0.771 109.8 53.0 -62.8 -26.4 42.6 -11.8 14.8 770 133 D V H <45S+ 0 0 40 -3,-0.5 3,-0.5 3,-0.2 -1,-0.2 0.933 110.4 47.1 -72.4 -45.3 41.2 -15.2 15.6 771 134 D L H <5S+ 0 0 98 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.1 0.897 120.9 35.4 -62.3 -45.2 42.9 -16.8 12.6 772 135 D F T <5S- 0 0 55 -4,-2.4 -1,-0.2 2,-0.1 -2,-0.2 0.402 107.4-125.8 -91.2 1.1 46.3 -15.2 13.1 773 136 D N T 5 + 0 0 131 -3,-0.5 2,-0.2 -4,-0.3 -3,-0.2 0.937 61.9 137.8 53.5 53.7 45.9 -15.5 16.9 774 137 D H < - 0 0 61 -5,-2.3 2,-0.4 -6,-0.1 -1,-0.2 -0.719 55.2-110.2-119.6 171.0 46.5 -11.7 17.5 775 138 D S - 0 0 60 -2,-0.2 -5,-0.0 1,-0.1 2,-0.0 -0.826 31.3-136.4-103.9 145.8 44.9 -9.2 19.8 776 139 D T - 0 0 3 -2,-0.4 56,-0.2 2,-0.1 -1,-0.1 -0.040 33.3 -89.7 -84.6-166.7 42.8 -6.4 18.3 777 140 D d S S+ 0 0 8 54,-1.2 55,-0.1 1,-0.2 -64,-0.1 0.447 121.9 42.3 -86.6 -2.0 42.7 -2.7 19.1 778 141 D R > - 0 0 37 53,-0.2 3,-2.0 1,-0.1 4,-0.3 -0.554 65.7-180.0-146.0 73.7 40.0 -3.3 21.8 779 142 D P G > S+ 0 0 72 0, 0.0 3,-1.1 0, 0.0 4,-0.4 0.693 74.8 69.6 -47.7 -28.7 40.8 -6.5 23.9 780 143 D E G 3 S+ 0 0 127 1,-0.2 4,-0.3 2,-0.1 3,-0.2 0.760 100.5 46.3 -67.0 -24.9 37.7 -6.1 26.1 781 144 D D G <> S+ 0 0 64 -3,-2.0 4,-2.3 1,-0.2 -1,-0.2 0.420 85.9 93.2 -97.9 2.5 35.3 -7.0 23.2 782 145 D E H <> S+ 0 0 29 -3,-1.1 4,-2.0 -4,-0.3 -1,-0.2 0.859 80.5 54.9 -64.6 -37.2 37.3 -10.0 22.0 783 146 D N H 4 S+ 0 0 132 -4,-0.4 4,-0.4 -3,-0.2 -1,-0.2 0.919 114.0 41.5 -62.9 -42.7 35.4 -12.6 24.0 784 147 D T H >4 S+ 0 0 88 -4,-0.3 3,-0.8 1,-0.2 -2,-0.2 0.869 112.4 53.8 -72.4 -38.3 32.1 -11.4 22.5 785 148 D L H >< S+ 0 0 20 -4,-2.3 3,-2.0 1,-0.2 -2,-0.2 0.851 96.8 67.0 -64.9 -35.9 33.4 -11.0 19.0 786 149 D R T 3< S+ 0 0 132 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.752 102.3 47.0 -57.2 -27.0 34.7 -14.6 18.8 787 150 D K T < S+ 0 0 159 -3,-0.8 2,-0.4 -4,-0.4 -1,-0.3 0.187 98.4 85.8-103.2 18.4 31.2 -16.0 19.0 788 151 D D S < S- 0 0 60 -3,-2.0 -21,-0.1 -23,-0.1 -27,-0.0 -0.971 86.3-105.2-125.0 130.0 29.7 -13.7 16.3 789 152 D G - 0 0 2 -2,-0.4 -23,-0.1 1,-0.1 -28,-0.1 -0.238 25.0-146.2 -50.6 130.5 29.8 -14.3 12.5 790 153 D S + 0 0 0 -25,-1.9 45,-0.2 -30,-0.1 -1,-0.1 0.724 63.5 103.6 -74.0 -23.6 32.3 -11.9 10.9 791 154 D Y S S+ 0 0 7 -31,-0.2 -28,-0.3 -32,-0.2 -26,-0.2 -0.925 82.7 15.8-117.2 118.5 30.4 -11.3 7.7 792 155 D P S S- 0 0 0 0, 0.0 2,-0.3 0, 0.0 47,-0.2 0.592 90.1-119.2 -92.9 174.3 29.0 -8.7 7.4 793 156 D S > - 0 0 0 45,-1.7 4,-2.0 1,-0.1 5,-0.2 -0.543 13.9-160.6 -75.3 125.9 30.2 -6.1 9.9 794 157 D G H > S+ 0 0 12 -2,-0.3 4,-2.6 2,-0.2 5,-0.2 0.902 91.8 53.6 -71.8 -43.0 27.6 -4.8 12.3 795 158 D H H > S+ 0 0 26 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.916 111.5 47.3 -56.9 -45.3 29.5 -1.6 13.3 796 159 D T H > S+ 0 0 0 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.942 112.7 46.7 -62.4 -50.5 29.9 -0.7 9.6 797 160 D A H X S+ 0 0 0 -4,-2.0 4,-2.2 1,-0.2 -1,-0.2 0.895 116.1 46.9 -59.3 -41.7 26.2 -1.3 8.7 798 161 D Y H X S+ 0 0 2 -4,-2.6 4,-3.0 2,-0.2 -2,-0.2 0.934 112.8 47.0 -67.2 -47.6 25.2 0.7 11.8 799 162 D S H X S+ 0 0 0 -4,-3.0 4,-2.3 -5,-0.2 -2,-0.2 0.836 112.6 50.4 -65.8 -32.1 27.6 3.6 11.1 800 163 D T H X S+ 0 0 0 -4,-2.5 4,-2.1 -5,-0.2 -1,-0.2 0.951 113.4 45.9 -67.9 -47.8 26.5 3.7 7.5 801 164 D L H X S+ 0 0 0 -4,-2.2 4,-2.6 -5,-0.2 -2,-0.2 0.924 114.1 48.5 -58.4 -47.7 22.9 3.8 8.5 802 165 D L H X S+ 0 0 1 -4,-3.0 4,-2.5 1,-0.2 5,-0.3 0.917 109.0 52.3 -60.0 -47.1 23.5 6.4 11.2 803 166 D A H X S+ 0 0 0 -4,-2.3 4,-1.5 1,-0.2 -1,-0.2 0.895 112.9 46.1 -58.4 -39.9 25.5 8.6 8.8 804 167 D L H X S+ 0 0 5 -4,-2.1 4,-1.1 2,-0.2 -2,-0.2 0.903 110.9 50.5 -70.8 -42.7 22.6 8.5 6.3 805 168 D V H X S+ 0 0 0 -4,-2.6 4,-1.0 1,-0.2 3,-0.3 0.912 113.4 45.5 -63.1 -41.5 19.9 9.2 8.9 806 169 D L H X S+ 0 0 2 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.830 109.1 56.4 -70.8 -31.0 21.7 12.2 10.3 807 170 D S H < S+ 0 0 9 -4,-1.5 -1,-0.2 -5,-0.3 7,-0.2 0.723 106.3 51.6 -70.6 -21.8 22.4 13.4 6.7 808 171 D Q H < S+ 0 0 5 -4,-1.1 -1,-0.2 -3,-0.3 -2,-0.2 0.740 114.3 42.0 -85.8 -24.3 18.7 13.3 6.1 809 172 D A H < S+ 0 0 1 -4,-1.0 -2,-0.2 1,-0.2 -3,-0.1 0.696 130.5 25.2 -93.4 -22.3 18.0 15.4 9.3 810 173 D R S >< S+ 0 0 23 -4,-1.9 3,-2.2 -5,-0.1 -1,-0.2 -0.565 71.2 177.0-143.6 70.4 20.9 17.9 8.7 811 174 D P G > S+ 0 0 35 0, 0.0 3,-1.6 0, 0.0 4,-0.2 0.725 74.0 65.5 -45.6 -36.9 21.6 17.9 4.9 812 175 D E G 3 S+ 0 0 110 1,-0.3 3,-0.2 2,-0.1 4,-0.1 0.591 100.6 51.0 -70.2 -10.2 24.3 20.6 5.1 813 176 D R G <> S+ 0 0 71 -3,-2.2 4,-2.5 -7,-0.2 3,-0.5 0.279 78.4 114.2-105.7 7.5 26.5 18.3 7.1 814 177 D A H <> S+ 0 0 4 -3,-1.6 4,-2.6 1,-0.2 5,-0.2 0.849 72.5 48.5 -44.7 -50.4 26.1 15.5 4.5 815 178 D Q H > S+ 0 0 59 -4,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.866 113.2 45.3 -66.7 -37.3 29.7 15.4 3.3 816 179 D E H > S+ 0 0 45 -3,-0.5 4,-2.8 2,-0.2 -1,-0.2 0.873 114.3 50.8 -71.9 -37.2 31.3 15.3 6.7 817 180 D L H X S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.932 109.8 48.6 -64.7 -45.4 28.8 12.6 7.8 818 181 D A H X S+ 0 0 3 -4,-2.6 4,-1.8 -5,-0.2 -1,-0.2 0.902 113.8 48.5 -61.4 -41.0 29.4 10.4 4.7 819 182 D R H X S+ 0 0 121 -4,-1.7 4,-2.1 -5,-0.2 5,-0.2 0.948 112.2 46.2 -65.2 -50.0 33.2 10.8 5.4 820 183 D R H X S+ 0 0 42 -4,-2.8 4,-2.2 1,-0.2 -2,-0.2 0.861 110.5 54.8 -63.5 -34.2 33.0 9.9 9.1 821 184 D G H X S+ 0 0 0 -4,-2.4 4,-1.4 -5,-0.2 -1,-0.2 0.902 107.5 49.6 -65.3 -40.6 30.7 7.0 8.3 822 185 D W H X S+ 0 0 25 -4,-1.8 4,-2.0 1,-0.2 3,-0.3 0.940 113.0 45.6 -63.7 -47.2 33.2 5.5 5.9 823 186 D E H X S+ 0 0 62 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.860 104.3 62.5 -65.8 -35.7 36.1 5.8 8.3 824 187 D F H X S+ 0 0 0 -4,-2.2 4,-0.6 1,-0.2 -1,-0.2 0.905 108.1 44.9 -55.9 -39.3 34.1 4.3 11.1 825 188 D G H >X S+ 0 0 0 -4,-1.4 3,-1.4 -3,-0.3 4,-0.7 0.925 108.6 53.7 -70.6 -46.0 33.8 1.2 9.0 826 189 D Q H >X S+ 0 0 33 -4,-2.0 4,-2.4 1,-0.3 3,-0.6 0.778 95.6 71.0 -60.2 -26.4 37.5 1.1 8.0 827 190 D S H 3X S+ 0 0 0 -4,-2.0 4,-3.0 1,-0.2 -1,-0.3 0.892 91.7 58.0 -57.4 -37.5 38.3 1.3 11.7 828 191 D R H <<>S+ 0 0 6 -3,-1.4 6,-1.9 -4,-0.6 5,-1.2 0.835 108.2 46.2 -61.7 -32.9 37.0 -2.3 12.0 829 192 D V H X<5S+ 0 0 7 -4,-0.7 3,-0.8 -3,-0.6 -2,-0.2 0.934 115.5 44.3 -73.3 -49.2 39.6 -3.4 9.4 830 193 D I H 3<5S+ 0 0 26 -4,-2.4 -2,-0.2 1,-0.2 -3,-0.2 0.851 109.8 57.4 -64.0 -34.2 42.5 -1.5 11.0 831 194 D d T 3<5S- 0 0 4 -4,-3.0 -54,-1.2 -5,-0.2 -53,-0.2 0.684 110.7-123.0 -70.2 -19.5 41.4 -2.7 14.5 832 195 D G T < 5S+ 0 0 6 -3,-0.8 -63,-1.3 -4,-0.5 -3,-0.2 0.509 84.0 109.7 88.5 5.5 41.7 -6.3 13.3 833 196 D A S > - 0 0 5 -2,-0.3 3,-1.5 -45,-0.2 4,-1.3 -0.631 36.3-115.5 -88.0 151.1 38.1 -8.4 7.0 836 199 D Q H >> S+ 0 0 10 -146,-0.3 4,-2.4 1,-0.3 3,-0.8 0.929 118.6 57.7 -52.5 -43.8 37.9 -5.6 4.4 837 200 D S H 3> S+ 0 0 15 1,-0.3 4,-1.5 -151,-0.2 -1,-0.3 0.777 100.6 56.5 -60.8 -22.9 35.3 -7.7 2.6 838 201 D D H <> S+ 0 0 0 -3,-1.5 -45,-1.7 2,-0.2 4,-1.5 0.844 109.5 46.3 -74.2 -33.9 33.1 -7.7 5.7 839 202 D V H < S+ 0 0 25 -4,-1.6 3,-1.4 1,-0.2 -2,-0.2 0.884 103.4 56.7 -65.1 -40.2 13.4 0.1 4.4 853 216 D L H >< S+ 0 0 0 -4,-2.4 3,-2.4 1,-0.3 7,-0.3 0.855 94.3 68.2 -61.6 -33.2 13.2 2.5 7.4 854 217 D Q T 3< S+ 0 0 10 -4,-1.3 -1,-0.3 1,-0.3 -2,-0.2 0.784 97.2 54.2 -56.6 -26.6 11.8 5.2 5.0 855 218 D T T < S+ 0 0 45 -3,-1.4 -1,-0.3 -4,-0.5 -2,-0.2 0.369 90.5 92.4 -91.1 5.7 8.7 3.0 4.6 856 219 D I X> - 0 0 23 -3,-2.4 4,-2.0 1,-0.1 3,-0.7 -0.887 62.7-153.5-108.2 119.6 8.0 2.8 8.4 857 220 D P H 3> S+ 0 0 85 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.907 95.9 56.8 -51.8 -48.9 5.7 5.3 10.1 858 221 D A H 3> S+ 0 0 46 1,-0.2 4,-1.5 -195,-0.2 5,-0.1 0.848 108.7 48.3 -54.0 -36.3 7.4 5.0 13.5 859 222 D F H <> S+ 0 0 0 -3,-0.7 4,-2.9 -6,-0.2 -1,-0.2 0.919 109.8 50.2 -70.5 -45.8 10.7 5.9 11.9 860 223 D Q H X S+ 0 0 72 -4,-2.0 4,-2.0 -7,-0.3 -2,-0.2 0.870 109.8 52.0 -60.4 -38.4 9.3 9.0 10.1 861 224 D K H X S+ 0 0 143 -4,-2.5 4,-1.2 -5,-0.2 -1,-0.2 0.891 112.6 45.1 -66.0 -38.8 7.7 10.2 13.3 862 225 D S H X S+ 0 0 5 -4,-1.5 4,-2.6 -5,-0.2 3,-0.3 0.930 109.8 53.9 -70.7 -45.5 11.1 9.9 15.1 863 226 D L H X S+ 0 0 0 -4,-2.9 4,-3.3 1,-0.2 5,-0.2 0.901 103.1 58.1 -55.0 -45.2 13.1 11.5 12.3 864 227 D A H X S+ 0 0 48 -4,-2.0 4,-1.7 1,-0.2 -1,-0.2 0.910 111.5 40.8 -53.2 -45.9 10.8 14.6 12.4 865 228 D K H X S+ 0 0 114 -4,-1.2 4,-2.5 -3,-0.3 -1,-0.2 0.872 112.9 54.6 -72.1 -36.4 11.6 15.2 16.0 866 229 D V H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.907 106.8 52.0 -62.5 -39.8 15.2 14.3 15.5 867 230 D R H X S+ 0 0 105 -4,-3.3 4,-0.6 1,-0.2 -1,-0.2 0.930 110.1 49.0 -61.2 -44.7 15.3 17.0 12.8 868 231 D E H >< S+ 0 0 138 -4,-1.7 3,-0.7 -5,-0.2 4,-0.4 0.918 111.5 48.5 -60.9 -46.4 13.8 19.5 15.2 869 232 D E H >< S+ 0 0 25 -4,-2.5 3,-1.0 1,-0.2 -2,-0.2 0.918 111.8 47.1 -62.5 -46.6 16.3 18.7 18.0 870 233 D L H 3< S+ 0 0 0 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.507 114.0 48.6 -76.5 -4.2 19.4 18.9 15.9 871 234 D N T << S+ 0 0 67 -3,-0.7 2,-0.5 -4,-0.6 -1,-0.2 0.359 81.3 115.4-112.3 0.9 18.4 22.2 14.3 872 235 D D X> - 0 0 63 -3,-1.0 3,-2.7 -4,-0.4 4,-0.6 -0.620 67.8-136.9 -75.1 121.7 17.5 23.9 17.5 873 236 D K G >4 S+ 0 0 170 -2,-0.5 3,-1.2 1,-0.3 -1,-0.2 0.826 101.6 64.5 -46.0 -40.0 19.8 26.9 18.0 874 237 D N G 34 S+ 0 0 144 1,-0.2 -1,-0.3 -138,-0.0 -2,-0.1 0.443 107.6 42.0 -68.8 2.1 20.2 25.9 21.7 875 238 D N G <4 S+ 0 0 12 -3,-2.7 -144,-3.1 -6,-0.1 -1,-0.2 0.403 85.7 118.8-125.9 -3.3 21.9 22.7 20.7 876 239 D L B << -D 730 0D 66 -3,-1.2 -146,-0.3 -4,-0.6 2,-0.3 -0.159 43.0-164.0 -62.5 160.1 24.2 23.8 17.8 877 240 D L 0 0 75 -148,-1.6 -1,-0.1 -152,-0.1 -2,-0.1 -0.858 360.0 360.0-139.9 175.2 28.0 23.3 18.0 878 241 D S 0 0 159 -2,-0.3 -148,-0.0 -148,-0.0 -2,-0.0 -0.332 360.0 360.0-100.7 360.0 31.2 24.5 16.4