==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 29-NOV-04 1WTY . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN TTHA0048; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS THERMOPHILUS; . AUTHOR Y.KITAMURA,S.YOKOYAMA,S.KURAMITSU,RIKEN STRUCTURAL . 459 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19991.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 376 81.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 11 2.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 56 12.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 295 64.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 0 0 0 3 0 3 4 2 3 1 2 0 0 0 0 0 0 0 0 0 1 1 1 1 1 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 2 A A 0 0 101 0, 0.0 2,-0.6 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 152.5 32.7 57.5 79.4 2 3 A S > - 0 0 68 433,-0.2 4,-1.8 1,-0.2 5,-0.1 -0.780 360.0-167.8 -92.4 119.2 35.9 58.0 81.3 3 4 A L H > S+ 0 0 14 -2,-0.6 4,-2.9 2,-0.2 5,-0.2 0.869 92.7 57.6 -68.4 -36.0 39.0 56.2 79.8 4 5 A A H > S+ 0 0 52 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.906 106.5 47.9 -60.1 -43.7 40.8 57.0 83.0 5 6 A R H > S+ 0 0 78 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.899 111.3 50.1 -65.6 -40.6 38.2 55.2 85.0 6 7 A A H X S+ 0 0 2 -4,-1.8 4,-2.0 1,-0.2 -2,-0.2 0.932 111.9 48.0 -63.6 -44.6 38.3 52.2 82.7 7 8 A V H X S+ 0 0 5 -4,-2.9 4,-2.6 1,-0.2 -2,-0.2 0.887 110.4 52.3 -62.9 -37.9 42.1 52.1 83.0 8 9 A E H X S+ 0 0 112 -4,-2.3 4,-2.7 2,-0.2 -2,-0.2 0.918 107.7 51.3 -64.5 -42.4 41.8 52.4 86.8 9 10 A R H X S+ 0 0 0 -4,-2.4 4,-1.4 2,-0.2 -1,-0.2 0.902 111.9 46.9 -60.5 -42.1 39.4 49.4 86.9 10 11 A L H X S+ 0 0 0 -4,-2.0 4,-1.6 1,-0.2 -1,-0.2 0.897 111.9 51.2 -66.5 -40.8 41.8 47.3 84.9 11 12 A K H X S+ 0 0 90 -4,-2.6 4,-1.3 1,-0.2 -2,-0.2 0.898 106.0 54.7 -63.7 -39.9 44.7 48.4 87.1 12 13 A A H < S+ 0 0 34 -4,-2.7 4,-0.3 1,-0.2 -1,-0.2 0.862 109.7 47.0 -63.3 -34.5 42.7 47.4 90.3 13 14 A A H < S+ 0 0 0 -4,-1.4 3,-0.5 1,-0.2 -1,-0.2 0.786 109.6 52.9 -77.7 -29.0 42.2 43.9 89.0 14 15 A L H < S+ 0 0 31 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.723 103.0 58.5 -79.0 -19.9 45.8 43.4 87.9 15 16 A E S < S+ 0 0 145 -4,-1.3 -1,-0.2 -5,-0.1 -2,-0.2 0.608 91.9 92.2 -82.9 -10.5 47.1 44.4 91.3 16 17 A R S S- 0 0 130 -3,-0.5 3,-0.1 -4,-0.3 -3,-0.0 -0.556 92.2 -90.5 -90.6 149.0 45.1 41.6 93.0 17 18 A P - 0 0 110 0, 0.0 2,-0.2 0, 0.0 5,-0.1 -0.276 56.5-108.8 -51.8 133.2 46.3 38.1 93.8 18 19 A K + 0 0 105 4,-0.1 2,-0.3 -4,-0.1 -4,-0.0 -0.423 53.0 144.4 -73.5 140.5 45.4 36.0 90.8 19 20 A D > - 0 0 76 -2,-0.2 4,-3.0 -3,-0.1 5,-0.2 -0.927 64.9 -85.2-161.0 161.5 42.7 33.4 90.8 20 21 A E H > S+ 0 0 71 -2,-0.3 4,-2.2 1,-0.2 5,-0.1 0.815 127.4 45.3 -43.5 -41.5 40.3 32.3 88.0 21 22 A F H > S+ 0 0 21 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.938 113.3 47.2 -72.4 -46.9 37.8 35.0 88.9 22 23 A I H > S+ 0 0 14 1,-0.2 4,-1.6 2,-0.2 -2,-0.2 0.911 112.8 53.9 -59.5 -39.6 40.3 37.8 89.2 23 24 A R H X S+ 0 0 8 -4,-3.0 4,-2.2 1,-0.2 3,-0.4 0.960 109.4 44.7 -58.5 -55.3 41.7 36.6 85.9 24 25 A D H X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.824 111.7 51.9 -63.9 -32.3 38.5 36.7 84.0 25 26 A S H X S+ 0 0 0 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.790 108.1 52.8 -75.0 -25.8 37.5 40.1 85.3 26 27 A A H X S+ 0 0 0 -4,-1.6 4,-2.1 -3,-0.4 -2,-0.2 0.928 110.4 47.2 -72.2 -43.2 40.9 41.5 84.2 27 28 A I H X S+ 0 0 0 -4,-2.2 4,-1.8 1,-0.2 -2,-0.2 0.919 112.2 51.1 -60.2 -41.7 40.2 40.1 80.7 28 29 A Q H X S+ 0 0 0 -4,-2.1 4,-1.5 1,-0.2 -1,-0.2 0.877 110.7 48.2 -63.4 -39.2 36.7 41.6 80.9 29 30 A R H X S+ 0 0 0 -4,-2.0 4,-1.7 1,-0.2 -1,-0.2 0.809 106.6 56.0 -72.6 -30.1 38.2 45.0 81.9 30 31 A F H X S+ 0 0 0 -4,-2.1 4,-2.5 1,-0.2 5,-0.2 0.889 104.7 58.1 -66.8 -36.7 40.8 44.8 79.1 31 32 A E H X S+ 0 0 4 -4,-1.8 4,-2.0 1,-0.2 -2,-0.2 0.935 111.8 33.8 -59.8 -55.3 37.8 44.4 76.7 32 33 A F H X S+ 0 0 0 -4,-1.5 4,-2.5 2,-0.2 -1,-0.2 0.808 116.9 56.3 -74.8 -26.2 35.9 47.6 77.5 33 34 A T H X S+ 0 0 0 -4,-1.7 4,-2.6 2,-0.2 -2,-0.2 0.939 110.9 43.8 -68.5 -43.4 39.0 49.6 78.1 34 35 A F H X S+ 0 0 3 -4,-2.5 4,-2.5 2,-0.2 5,-0.3 0.929 113.3 52.2 -63.4 -45.3 40.3 48.7 74.6 35 36 A E H X S+ 0 0 27 -4,-2.0 4,-1.6 -5,-0.2 -2,-0.2 0.919 114.2 42.7 -54.3 -46.9 36.9 49.4 73.2 36 37 A L H X S+ 0 0 10 -4,-2.5 4,-1.6 1,-0.2 -1,-0.2 0.840 110.7 58.2 -70.5 -34.7 36.9 52.8 74.9 37 38 A A H X S+ 0 0 0 -4,-2.6 4,-1.7 2,-0.2 -2,-0.2 0.919 108.6 41.8 -65.2 -45.0 40.5 53.4 73.9 38 39 A W H X S+ 0 0 25 -4,-2.5 4,-2.9 2,-0.2 -1,-0.2 0.898 112.7 54.2 -72.4 -34.2 40.1 53.1 70.1 39 40 A K H X S+ 0 0 68 -4,-1.6 4,-2.1 -5,-0.3 -1,-0.2 0.856 109.0 50.8 -62.6 -32.7 36.8 55.0 70.3 40 41 A T H X S+ 0 0 37 -4,-1.6 4,-1.8 2,-0.2 -1,-0.2 0.850 109.4 49.3 -72.2 -34.0 38.9 57.7 72.0 41 42 A L H X S+ 0 0 2 -4,-1.7 4,-3.2 2,-0.2 5,-0.3 0.923 108.9 53.7 -70.3 -42.0 41.5 57.5 69.2 42 43 A K H X S+ 0 0 63 -4,-2.9 4,-2.5 1,-0.2 -2,-0.2 0.939 108.7 48.0 -56.4 -50.6 38.8 57.8 66.6 43 44 A T H X S+ 0 0 93 -4,-2.1 4,-1.5 1,-0.2 -1,-0.2 0.904 114.0 47.8 -58.5 -42.1 37.4 61.0 68.2 44 45 A F H X S+ 0 0 57 -4,-1.8 4,-1.5 2,-0.2 3,-0.3 0.950 111.4 48.2 -65.3 -50.2 40.9 62.5 68.4 45 46 A L H X>S+ 0 0 2 -4,-3.2 5,-2.5 1,-0.2 4,-0.6 0.911 110.2 53.2 -58.7 -40.5 41.8 61.7 64.8 46 47 A E H ><5S+ 0 0 68 -4,-2.5 3,-0.7 -5,-0.3 -1,-0.2 0.843 105.4 53.5 -64.7 -31.8 38.5 63.2 63.6 47 48 A L H 3<5S+ 0 0 94 -4,-1.5 -1,-0.3 -3,-0.3 -2,-0.2 0.809 105.3 55.7 -71.0 -27.8 39.2 66.4 65.5 48 49 A Q H 3<5S- 0 0 18 -4,-1.5 240,-2.4 -3,-0.3 -1,-0.2 0.617 126.0-103.5 -77.9 -11.7 42.6 66.5 63.7 49 50 A G T <<5S+ 0 0 0 -3,-0.7 2,-0.2 -4,-0.6 -3,-0.2 0.647 85.8 114.6 96.8 18.7 40.7 66.3 60.4 50 51 A L < - 0 0 27 -5,-2.5 -1,-0.4 -6,-0.2 2,-0.3 -0.732 56.6-127.4-116.5 166.8 41.5 62.6 59.7 51 52 A E + 0 0 87 -2,-0.2 2,-0.2 -3,-0.1 10,-0.0 -0.819 20.6 176.3-118.0 157.0 39.3 59.5 59.5 52 53 A A + 0 0 2 -2,-0.3 -6,-0.1 -10,-0.0 6,-0.0 -0.744 6.3 173.0-158.4 102.3 39.3 56.1 61.1 53 54 A R S S+ 0 0 38 -2,-0.2 3,-0.1 1,-0.1 -1,-0.0 0.361 70.9 37.2 -95.8 7.0 36.5 53.6 60.5 54 55 A S S > S- 0 0 23 116,-0.1 4,-3.1 1,-0.1 5,-0.2 -0.996 82.9-112.1-153.9 153.8 38.1 50.8 62.3 55 56 A P H > S+ 0 0 15 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.896 120.5 54.1 -51.9 -40.2 40.2 50.1 65.4 56 57 A R H > S+ 0 0 88 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.925 111.3 43.9 -58.9 -47.8 43.0 49.2 63.1 57 58 A A H > S+ 0 0 35 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.877 110.9 54.7 -66.3 -39.4 42.7 52.5 61.3 58 59 A A H X S+ 0 0 0 -4,-3.1 4,-1.9 2,-0.2 -2,-0.2 0.906 110.4 46.4 -61.7 -41.3 42.4 54.4 64.6 59 60 A I H X S+ 0 0 0 -4,-2.4 4,-1.5 -5,-0.2 -2,-0.2 0.924 113.5 46.8 -67.1 -46.9 45.7 52.9 65.9 60 61 A R H X S+ 0 0 140 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.855 112.0 51.9 -64.9 -35.3 47.6 53.5 62.7 61 62 A G H X S+ 0 0 10 -4,-2.3 4,-2.6 1,-0.2 6,-0.3 0.903 105.0 55.9 -67.3 -39.3 46.3 57.1 62.6 62 63 A A H X>S+ 0 0 0 -4,-1.9 6,-1.2 2,-0.2 5,-1.2 0.845 108.9 47.7 -61.5 -33.0 47.4 57.6 66.1 63 64 A F H ><5S+ 0 0 17 -4,-1.5 3,-1.1 4,-0.2 -2,-0.2 0.976 110.0 52.7 -69.2 -53.7 50.9 56.6 65.1 64 65 A Q H 3<5S+ 0 0 92 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.857 114.8 40.2 -47.5 -46.7 50.8 58.9 62.1 65 66 A V H 3<5S- 0 0 28 -4,-2.6 -1,-0.3 -5,-0.1 -2,-0.2 0.605 112.6-115.3 -83.6 -11.6 49.7 62.0 64.2 66 67 A G T <<5S+ 0 0 30 -3,-1.1 -3,-0.2 -4,-0.8 -2,-0.1 0.521 79.4 126.9 90.9 5.5 52.1 61.2 67.0 67 68 A L S > - 0 0 29 -2,-0.9 3,-2.3 1,-0.1 4,-0.5 -0.874 36.3-159.4-136.8 101.4 54.6 50.5 69.1 72 73 A P H 3> S+ 0 0 94 0, 0.0 4,-1.2 0, 0.0 3,-0.2 0.639 86.1 77.6 -55.6 -11.2 53.8 47.2 67.3 73 74 A F H 3> S+ 0 0 8 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.800 82.8 63.1 -71.0 -26.2 52.3 46.0 70.6 74 75 A W H <> S+ 0 0 3 -3,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.910 100.7 52.1 -62.9 -39.6 49.1 48.0 70.1 75 76 A L H X S+ 0 0 42 -4,-0.5 4,-1.3 1,-0.2 -1,-0.2 0.882 108.3 51.1 -64.1 -36.7 48.4 46.0 67.0 76 77 A E H X S+ 0 0 96 -4,-1.2 4,-2.5 1,-0.2 -1,-0.2 0.866 105.0 57.2 -66.2 -36.9 48.8 42.8 69.0 77 78 A X H X S+ 0 0 0 -4,-2.0 4,-2.6 1,-0.2 -2,-0.2 0.911 102.1 55.0 -59.9 -41.4 46.4 44.2 71.6 78 79 A L H X S+ 0 0 10 -4,-1.9 4,-1.5 1,-0.2 -1,-0.2 0.890 109.6 47.8 -58.3 -38.7 43.8 44.6 68.8 79 80 A E H X S+ 0 0 107 -4,-1.3 4,-1.3 2,-0.2 -2,-0.2 0.891 109.3 51.6 -70.7 -39.8 44.3 40.9 68.2 80 81 A L H X S+ 0 0 4 -4,-2.5 4,-1.4 1,-0.2 3,-0.2 0.893 105.4 57.6 -63.4 -38.1 44.0 40.0 71.9 81 82 A R H < S+ 0 0 10 -4,-2.6 3,-0.4 1,-0.2 4,-0.4 0.910 106.1 48.5 -57.2 -45.6 40.7 42.0 72.0 82 83 A N H >< S+ 0 0 92 -4,-1.5 3,-0.6 1,-0.2 -1,-0.2 0.793 108.7 55.6 -66.2 -28.3 39.3 39.8 69.2 83 84 A L H >< S+ 0 0 48 -4,-1.3 3,-2.9 -3,-0.2 -1,-0.2 0.762 84.9 79.1 -76.6 -27.9 40.4 36.6 71.1 84 85 A T G >< S+ 0 0 0 -4,-1.4 3,-1.2 -3,-0.4 -1,-0.2 0.760 83.7 67.6 -52.8 -25.3 38.6 37.4 74.3 85 86 A N G < S+ 0 0 26 -3,-0.6 -1,-0.3 -4,-0.4 3,-0.1 0.644 99.7 48.7 -71.4 -14.9 35.5 36.2 72.6 86 87 A H G X S+ 0 0 73 -3,-2.9 3,-1.3 1,-0.1 -1,-0.3 0.006 70.5 123.4-113.2 27.1 36.9 32.6 72.6 87 88 A T T < + 0 0 0 -3,-1.2 6,-0.2 1,-0.3 -1,-0.1 0.332 40.7 98.2 -72.9 8.5 38.0 32.4 76.2 88 89 A Y T 3 S+ 0 0 75 1,-0.2 2,-1.0 -3,-0.1 -1,-0.3 0.721 74.9 77.9 -65.1 -13.4 35.9 29.3 76.9 89 90 A D S X> S- 0 0 84 -3,-1.3 4,-1.5 1,-0.2 3,-1.4 -0.819 76.2-162.8 -95.0 95.8 39.3 27.9 76.2 90 91 A E H 3> S+ 0 0 55 -2,-1.0 4,-2.3 1,-0.3 5,-0.2 0.749 86.2 63.5 -53.3 -28.6 41.1 28.6 79.5 91 92 A A H 3> S+ 0 0 72 1,-0.2 4,-1.5 2,-0.2 -1,-0.3 0.893 106.6 45.2 -64.0 -37.3 44.5 28.1 77.9 92 93 A L H <> S+ 0 0 24 -3,-1.4 4,-2.1 2,-0.2 -2,-0.2 0.838 109.8 54.6 -71.9 -35.3 43.7 31.1 75.8 93 94 A A H X S+ 0 0 0 -4,-1.5 4,-2.3 1,-0.2 -2,-0.2 0.858 108.6 48.8 -66.9 -35.3 42.4 33.0 78.8 94 95 A E H X S+ 0 0 69 -4,-2.3 4,-1.7 2,-0.2 -1,-0.2 0.861 110.6 51.4 -71.6 -34.8 45.7 32.4 80.6 95 96 A R H < S+ 0 0 135 -4,-1.5 4,-0.3 -5,-0.2 -2,-0.2 0.861 112.4 45.6 -70.3 -35.1 47.6 33.6 77.5 96 97 A I H >X S+ 0 0 0 -4,-2.1 3,-2.0 1,-0.2 4,-0.5 0.947 109.5 54.3 -71.5 -49.1 45.6 36.8 77.3 97 98 A Y H >< S+ 0 0 33 -4,-2.3 3,-1.4 1,-0.3 -2,-0.2 0.868 101.3 59.2 -52.6 -41.4 45.9 37.5 81.0 98 99 A A T 3< S+ 0 0 61 -4,-1.7 -1,-0.3 1,-0.3 4,-0.2 0.634 104.7 51.7 -65.9 -12.8 49.7 37.3 80.9 99 100 A E T <> S+ 0 0 48 -3,-2.0 4,-1.9 -4,-0.3 -1,-0.3 0.507 86.9 86.2 -99.4 -7.2 49.7 40.2 78.3 100 101 A L H S+ 0 0 65 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.943 111.0 45.8 -56.4 -39.3 50.2 44.2 82.4 102 103 A K H > S+ 0 0 77 -4,-0.2 4,-1.5 1,-0.2 -2,-0.2 0.911 111.0 52.2 -65.5 -42.5 51.8 45.2 79.1 103 104 A A H X S+ 0 0 0 -4,-1.9 4,-2.2 1,-0.2 -1,-0.2 0.909 105.9 55.0 -59.8 -42.9 48.4 46.4 77.8 104 105 A L H X S+ 0 0 18 -4,-3.3 4,-3.0 1,-0.2 -1,-0.2 0.897 103.3 55.5 -57.5 -43.6 47.9 48.5 80.9 105 106 A E H X S+ 0 0 108 -4,-1.7 4,-2.1 -5,-0.2 -1,-0.2 0.894 108.0 49.1 -57.6 -41.2 51.2 50.3 80.2 106 107 A R H X S+ 0 0 43 -4,-1.5 4,-2.3 2,-0.2 -1,-0.2 0.917 110.6 49.1 -66.6 -42.3 49.9 51.3 76.8 107 108 A F H X S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.944 111.2 50.3 -62.2 -46.1 46.6 52.6 78.1 108 109 A Q H X S+ 0 0 68 -4,-3.0 4,-2.0 1,-0.2 -1,-0.2 0.894 110.0 49.9 -58.9 -41.0 48.4 54.6 80.7 109 110 A E H X S+ 0 0 56 -4,-2.1 4,-2.5 -5,-0.2 -1,-0.2 0.893 109.0 52.7 -64.5 -38.9 50.7 56.1 78.1 110 111 A L H X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.931 107.1 52.4 -62.8 -43.2 47.7 57.0 75.9 111 112 A L H X S+ 0 0 31 -4,-2.4 4,-0.8 1,-0.2 -1,-0.2 0.901 110.2 48.3 -57.8 -43.8 46.1 58.8 78.9 112 113 A R H >< S+ 0 0 127 -4,-2.0 3,-0.8 1,-0.2 -1,-0.2 0.940 112.8 47.5 -61.7 -49.6 49.3 60.8 79.4 113 114 A R H >< S+ 0 0 56 -4,-2.5 3,-0.6 1,-0.2 -2,-0.2 0.863 104.1 62.2 -60.1 -40.1 49.5 61.7 75.7 114 115 A L H 3< S+ 0 0 52 -4,-2.6 2,-0.5 1,-0.3 -1,-0.2 0.740 98.4 56.1 -62.2 -25.3 45.8 62.7 75.5 115 116 A E T << 0 0 156 -4,-0.8 -1,-0.3 -3,-0.8 -2,-0.1 -0.440 360.0 360.0-108.5 60.8 46.1 65.5 78.0 116 117 A E < 0 0 175 -3,-0.6 -1,-0.2 -2,-0.5 -2,-0.0 -0.311 360.0 360.0-137.8 360.0 48.9 67.6 76.4 117 !* 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 0.0 118 3 B S > 0 0 101 0, 0.0 4,-1.4 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 123.8 17.0 57.6 55.0 119 4 B L H > + 0 0 14 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.838 360.0 58.0 -68.0 -32.8 18.9 55.2 52.7 120 5 B A H > S+ 0 0 50 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.943 107.1 45.4 -63.0 -48.2 16.0 55.2 50.3 121 6 B R H > S+ 0 0 87 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.805 111.9 54.2 -65.8 -28.9 16.1 58.9 49.9 122 7 B A H X S+ 0 0 1 -4,-1.4 4,-2.2 2,-0.2 3,-0.4 0.970 109.3 45.7 -67.6 -53.6 19.9 58.8 49.5 123 8 B V H X S+ 0 0 7 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.867 109.0 58.8 -56.4 -35.3 19.6 56.2 46.7 124 9 B E H X S+ 0 0 111 -4,-2.1 4,-2.2 -5,-0.2 -1,-0.2 0.902 106.3 46.5 -61.6 -42.1 16.9 58.4 45.2 125 10 B R H X S+ 0 0 2 -4,-1.7 4,-1.5 -3,-0.4 -1,-0.2 0.869 110.0 53.2 -68.7 -38.1 19.3 61.4 44.9 126 11 B L H X S+ 0 0 0 -4,-2.2 4,-1.7 1,-0.2 -1,-0.2 0.896 110.4 48.3 -64.4 -38.5 22.0 59.2 43.4 127 12 B K H X S+ 0 0 85 -4,-2.2 4,-1.0 1,-0.2 -2,-0.2 0.934 105.6 57.2 -68.2 -44.0 19.6 58.0 40.8 128 13 B A H X S+ 0 0 26 -4,-2.2 4,-0.5 1,-0.2 3,-0.3 0.860 109.5 46.8 -54.4 -36.3 18.4 61.5 40.0 129 14 B A H >< S+ 0 0 0 -4,-1.5 3,-0.7 1,-0.2 -1,-0.2 0.881 108.7 52.5 -74.5 -39.2 22.0 62.5 39.2 130 15 B L H 3< S+ 0 0 33 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.553 103.9 58.5 -75.9 -6.6 22.8 59.5 37.0 131 16 B E H 3< S+ 0 0 121 -4,-1.0 -1,-0.2 -3,-0.3 -2,-0.2 0.673 88.9 91.1 -93.3 -19.0 19.7 60.1 34.8 132 17 B R S << S- 0 0 109 -3,-0.7 3,-0.1 -4,-0.5 -3,-0.0 -0.414 95.1 -92.2 -74.5 148.3 20.9 63.6 33.9 133 18 B P - 0 0 91 0, 0.0 2,-0.4 0, 0.0 5,-0.1 -0.337 54.6 -97.6 -59.3 144.5 23.1 64.0 30.8 134 19 B K + 0 0 95 4,-0.1 2,-0.3 -4,-0.1 -4,-0.0 -0.511 60.7 139.0 -75.9 122.2 26.8 63.8 31.7 135 20 B D > - 0 0 79 -2,-0.4 4,-2.9 -3,-0.1 3,-0.4 -0.915 66.3 -92.6-146.2 161.3 28.8 67.0 32.2 136 21 B E H > S+ 0 0 72 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.781 123.4 50.6 -51.6 -33.5 31.4 67.6 34.9 137 22 B F H > S+ 0 0 22 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.890 113.3 44.2 -74.4 -39.0 29.0 69.2 37.3 138 23 B I H > S+ 0 0 12 -3,-0.4 4,-2.3 2,-0.2 -2,-0.2 0.908 113.6 54.5 -68.3 -38.5 26.6 66.3 37.1 139 24 B R H X S+ 0 0 7 -4,-2.9 4,-1.9 1,-0.2 -2,-0.2 0.940 110.3 43.2 -59.0 -51.2 29.5 64.0 37.3 140 25 B D H X S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.860 111.5 54.0 -68.1 -32.6 30.9 65.4 40.5 141 26 B S H X S+ 0 0 0 -4,-1.9 4,-2.7 2,-0.2 -1,-0.2 0.916 107.9 51.3 -67.0 -39.3 27.4 65.6 42.1 142 27 B A H X S+ 0 0 0 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.910 110.3 48.8 -62.3 -41.6 26.9 61.9 41.4 143 28 B I H X S+ 0 0 0 -4,-1.9 4,-1.6 2,-0.2 -1,-0.2 0.902 110.7 51.1 -63.9 -41.1 30.2 61.1 43.0 144 29 B Q H X S+ 0 0 0 -4,-2.4 4,-1.6 1,-0.2 5,-0.2 0.931 110.8 48.4 -62.0 -43.5 29.2 63.2 46.0 145 30 B R H X S+ 0 0 0 -4,-2.7 4,-1.7 1,-0.2 -1,-0.2 0.803 106.5 56.6 -68.3 -28.1 25.9 61.3 46.2 146 31 B F H X S+ 0 0 0 -4,-1.8 4,-2.3 -5,-0.2 -1,-0.2 0.851 104.7 55.6 -69.6 -34.0 27.8 58.0 46.0 147 32 B E H X S+ 0 0 0 -4,-1.6 4,-2.1 -3,-0.2 -2,-0.2 0.984 113.1 35.5 -63.4 -60.5 29.8 59.0 49.0 148 33 B F H X S+ 0 0 0 -4,-1.6 4,-3.2 1,-0.2 5,-0.3 0.868 117.2 54.9 -65.9 -31.8 27.1 59.7 51.5 149 34 B T H X S+ 0 0 0 -4,-1.7 4,-1.8 -5,-0.2 -1,-0.2 0.912 110.7 44.6 -66.7 -40.6 24.9 56.9 50.1 150 35 B F H X S+ 0 0 3 -4,-2.3 4,-2.7 2,-0.2 5,-0.2 0.848 113.9 52.0 -69.8 -32.9 27.7 54.4 50.6 151 36 B E H X S+ 0 0 10 -4,-2.1 4,-1.8 2,-0.2 -2,-0.2 0.963 112.7 42.2 -66.9 -51.2 28.3 55.9 54.0 152 37 B L H X S+ 0 0 21 -4,-3.2 4,-1.4 1,-0.2 -1,-0.2 0.840 114.4 58.4 -63.9 -29.1 24.6 55.6 55.0 153 38 B A H X S+ 0 0 0 -4,-1.8 4,-1.8 -5,-0.3 -2,-0.2 0.960 106.1 41.2 -66.6 -55.8 24.7 52.2 53.4 154 39 B W H X S+ 0 0 19 -4,-2.7 4,-2.1 1,-0.2 -1,-0.2 0.834 114.3 53.4 -65.8 -30.2 27.5 50.5 55.4 155 40 B K H X S+ 0 0 62 -4,-1.8 4,-2.4 -5,-0.2 -1,-0.2 0.853 105.7 55.3 -70.6 -31.7 26.2 52.0 58.6 156 41 B T H X S+ 0 0 35 -4,-1.4 4,-1.9 -5,-0.2 -2,-0.2 0.912 108.2 47.7 -64.5 -42.8 22.8 50.5 57.7 157 42 B L H X S+ 0 0 0 -4,-1.8 4,-3.2 2,-0.2 5,-0.3 0.927 109.4 53.7 -63.1 -45.6 24.4 47.1 57.4 158 43 B K H X S+ 0 0 61 -4,-2.1 4,-2.5 1,-0.2 5,-0.3 0.939 107.6 49.7 -54.6 -51.0 26.2 47.5 60.7 159 44 B T H X S+ 0 0 96 -4,-2.4 4,-1.5 1,-0.2 -1,-0.2 0.906 113.6 47.8 -55.2 -42.4 22.9 48.3 62.5 160 45 B F H X S+ 0 0 65 -4,-1.9 4,-1.1 2,-0.2 3,-0.3 0.961 111.4 47.8 -63.6 -54.7 21.4 45.2 60.9 161 46 B L H <>S+ 0 0 1 -4,-3.2 5,-2.9 1,-0.2 3,-0.4 0.854 109.3 53.5 -56.2 -39.1 24.2 42.8 61.8 162 47 B E H ><5S+ 0 0 68 -4,-2.5 3,-1.2 -5,-0.3 -1,-0.2 0.890 105.5 54.4 -66.2 -35.2 24.4 44.0 65.4 163 48 B L H 3<5S+ 0 0 91 -4,-1.5 -1,-0.3 -5,-0.3 -2,-0.2 0.765 105.8 53.1 -68.2 -22.8 20.7 43.3 65.7 164 49 B Q T 3<5S- 0 0 14 -4,-1.1 239,-2.0 -3,-0.4 240,-0.3 0.506 128.1-102.6 -87.5 -4.4 21.5 39.7 64.5 165 50 B G T < 5S+ 0 0 0 -3,-1.2 2,-0.3 -4,-0.4 -3,-0.2 0.695 83.0 121.9 91.8 23.0 24.0 39.5 67.2 166 51 B L < - 0 0 28 -5,-2.9 2,-0.4 -6,-0.1 -1,-0.3 -0.773 59.4-117.2-115.7 161.0 27.1 40.1 65.1 167 52 B E - 0 0 67 -2,-0.3 2,-0.4 -3,-0.1 10,-0.0 -0.816 19.6-174.1-102.5 137.9 29.9 42.7 65.2 168 53 B A + 0 0 3 -2,-0.4 -6,-0.1 1,-0.1 6,-0.1 -0.840 14.4 163.1-130.0 91.1 30.6 45.1 62.4 169 54 B R + 0 0 121 -2,-0.4 -1,-0.1 1,-0.1 -11,-0.0 0.931 64.3 15.2 -73.6 -51.5 33.7 47.1 63.3 170 55 B S S > S- 0 0 27 -116,-0.1 4,-2.7 1,-0.1 3,-0.4 -0.775 82.6 -99.7-125.3 168.1 34.6 48.5 59.9 171 56 B P H > S+ 0 0 10 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.890 125.6 50.5 -53.0 -40.2 33.0 49.1 56.5 172 57 B R H > S+ 0 0 119 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.850 109.9 50.9 -67.2 -33.1 34.7 46.0 55.2 173 58 B A H > S+ 0 0 11 -3,-0.4 4,-2.6 2,-0.2 -1,-0.2 0.938 109.7 48.8 -68.6 -47.8 33.4 44.0 58.2 174 59 B A H X S+ 0 0 0 -4,-2.7 4,-2.0 2,-0.2 -2,-0.2 0.886 113.1 47.7 -59.7 -42.0 29.8 45.1 57.6 175 60 B I H X S+ 0 0 0 -4,-2.1 4,-1.4 -5,-0.2 -1,-0.2 0.943 114.1 46.0 -65.4 -46.7 30.0 44.2 53.9 176 61 B R H X S+ 0 0 114 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.859 112.4 52.7 -64.4 -33.7 31.6 40.8 54.7 177 62 B G H X S+ 0 0 2 -4,-2.6 4,-2.3 1,-0.2 6,-0.3 0.864 104.1 54.3 -70.2 -36.9 29.0 40.3 57.4 178 63 B A H <>S+ 0 0 0 -4,-2.0 5,-2.4 2,-0.2 6,-1.6 0.847 108.4 53.6 -65.1 -31.3 26.1 41.0 55.1 179 64 B F H ><5S+ 0 0 16 -4,-1.4 3,-1.5 3,-0.2 -2,-0.2 0.986 112.5 38.4 -66.3 -60.6 27.5 38.3 52.8 180 65 B Q H 3<5S+ 0 0 106 -4,-2.0 -2,-0.2 1,-0.3 -1,-0.2 0.853 115.2 53.9 -60.4 -36.8 27.7 35.5 55.4 181 66 B V T 3<5S- 0 0 20 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.486 113.7-117.9 -78.2 -1.8 24.5 36.4 57.0 182 67 B G T < 5S+ 0 0 34 -3,-1.5 -3,-0.2 -4,-0.2 -2,-0.1 0.717 82.6 118.9 73.7 20.8 22.7 36.3 53.7 183 68 B L S - 0 0 32 -2,-1.7 3,-2.1 1,-0.1 4,-0.4 -0.941 36.1-158.2-120.7 110.1 29.2 40.1 45.1 188 73 B P T >> S+ 0 0 100 0, 0.0 4,-1.2 0, 0.0 3,-0.9 0.714 86.7 78.8 -58.0 -19.8 32.9 41.1 45.0 189 74 B F H 3> S+ 0 0 14 1,-0.3 4,-2.3 2,-0.2 5,-0.2 0.802 79.9 67.4 -61.9 -26.7 31.7 44.4 43.5 190 75 B W H <> S+ 0 0 2 -3,-2.1 4,-1.2 1,-0.2 -1,-0.3 0.904 100.2 48.4 -60.0 -39.3 30.8 45.6 47.0 191 76 B L H <> S+ 0 0 25 -3,-0.9 4,-1.8 -4,-0.4 -1,-0.2 0.838 109.1 53.6 -68.5 -33.2 34.5 45.6 48.0 192 77 B E H X S+ 0 0 84 -4,-1.2 4,-2.0 1,-0.2 -2,-0.2 0.870 105.5 53.3 -68.0 -36.1 35.3 47.5 44.8 193 78 B X H X S+ 0 0 0 -4,-2.3 4,-1.9 1,-0.2 -1,-0.2 0.833 104.8 57.1 -66.5 -30.3 32.7 50.1 45.8 194 79 B L H X S+ 0 0 8 -4,-1.2 4,-1.8 2,-0.2 -2,-0.2 0.940 107.7 45.5 -66.0 -47.9 34.5 50.4 49.1 195 80 B E H X S+ 0 0 84 -4,-1.8 4,-1.0 1,-0.2 -2,-0.2 0.863 110.1 53.7 -65.7 -33.3 37.8 51.3 47.5 196 81 B L H >X S+ 0 0 2 -4,-2.0 4,-0.7 1,-0.2 3,-0.7 0.907 106.0 55.6 -65.9 -37.2 36.1 53.8 45.2 197 82 B R H >< S+ 0 0 6 -4,-1.9 3,-0.9 1,-0.3 -2,-0.2 0.919 106.7 49.1 -58.5 -45.0 34.6 55.3 48.3 198 83 B N H 3< S+ 0 0 52 -4,-1.8 3,-0.3 1,-0.2 -1,-0.3 0.669 109.2 52.7 -71.1 -16.1 38.1 55.8 49.7 199 84 B L H X< S+ 0 0 48 -4,-1.0 3,-1.9 -3,-0.7 -1,-0.2 0.523 80.3 97.5 -96.3 -4.6 39.4 57.4 46.5 200 85 B T G X< S+ 0 0 1 -3,-0.9 3,-0.6 -4,-0.7 -1,-0.2 0.686 79.8 51.7 -59.3 -23.4 36.7 60.0 46.3 201 86 B N G 3 S+ 0 0 21 -3,-0.3 -1,-0.3 1,-0.2 67,-0.2 0.360 99.2 64.8 -97.1 8.9 38.7 62.9 47.9 202 87 B H G X + 0 0 62 -3,-1.9 3,-1.9 1,-0.1 -1,-0.2 0.206 67.3 114.5-106.3 8.2 41.6 62.3 45.6 203 88 B T T < + 0 0 0 -3,-0.6 -1,-0.1 1,-0.3 6,-0.1 0.191 38.9 97.9 -68.5 20.0 39.4 63.4 42.7 204 89 B Y T 3 S+ 0 0 57 1,-0.2 2,-1.2 60,-0.1 -1,-0.3 0.715 73.6 79.7 -73.2 -16.9 41.5 66.5 42.1 205 90 B D S X> S- 0 0 85 -3,-1.9 4,-1.8 1,-0.2 3,-1.1 -0.766 76.8-164.1 -87.1 96.3 42.6 63.9 39.6 206 91 B E H 3> S+ 0 0 59 -2,-1.2 4,-1.9 1,-0.3 -1,-0.2 0.716 85.5 61.5 -57.2 -24.1 39.9 64.3 37.0 207 92 B A H 3> S+ 0 0 74 2,-0.2 4,-1.6 1,-0.2 -1,-0.3 0.876 106.0 47.3 -70.5 -35.1 40.8 61.0 35.3 208 93 B L H <> S+ 0 0 20 -3,-1.1 4,-2.3 2,-0.2 5,-0.2 0.927 107.8 55.4 -67.7 -46.9 40.0 59.3 38.6 209 94 B A H X S+ 0 0 0 -4,-1.8 4,-2.3 1,-0.2 -2,-0.2 0.896 109.0 48.1 -51.2 -46.4 36.7 61.2 38.9 210 95 B E H X S+ 0 0 73 -4,-1.9 4,-2.0 1,-0.2 -1,-0.2 0.873 110.2 51.9 -63.6 -39.7 35.7 59.9 35.5 211 96 B R H < S+ 0 0 128 -4,-1.6 4,-0.3 2,-0.2 -2,-0.2 0.845 110.5 47.5 -68.9 -33.3 36.7 56.4 36.4 212 97 B I H >X S+ 0 0 0 -4,-2.3 3,-1.7 1,-0.2 4,-0.5 0.936 110.9 51.7 -71.3 -46.4 34.6 56.4 39.6 213 98 B Y H >< S+ 0 0 30 -4,-2.3 3,-1.4 1,-0.3 -2,-0.2 0.861 100.3 62.0 -57.1 -41.2 31.6 57.9 37.7 214 99 B A T 3< S+ 0 0 66 -4,-2.0 -1,-0.3 1,-0.3 4,-0.2 0.681 106.8 48.3 -60.2 -16.5 31.8 55.1 35.1 215 100 B E T <> S+ 0 0 40 -3,-1.7 4,-1.6 -4,-0.3 3,-0.3 0.543 87.0 87.3-102.5 -7.9 31.1 52.7 38.0 216 101 B L H S+ 0 0 65 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.921 110.6 45.7 -61.9 -37.8 25.4 52.9 37.5 218 103 B K H > S+ 0 0 80 -3,-0.3 4,-1.5 -4,-0.2 -2,-0.2 0.850 111.3 52.1 -69.1 -36.2 26.6 49.5 38.8 219 104 B A H X S+ 0 0 0 -4,-1.6 4,-2.2 2,-0.2 3,-0.3 0.947 105.2 55.8 -64.7 -47.7 26.9 50.8 42.3 220 105 B L H X S+ 0 0 17 -4,-3.0 4,-3.0 1,-0.2 5,-0.3 0.905 101.9 56.5 -50.1 -48.5 23.3 52.1 42.2 221 106 B E H X S+ 0 0 107 -4,-1.6 4,-2.5 1,-0.2 -1,-0.2 0.932 108.0 49.0 -50.6 -47.7 22.0 48.6 41.2 222 107 B R H X S+ 0 0 45 -4,-1.5 4,-2.3 -3,-0.3 -1,-0.2 0.915 110.0 49.8 -60.7 -44.8 23.7 47.3 44.4 223 108 B F H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 -1,-0.2 0.953 112.8 46.2 -60.2 -48.6 22.1 50.0 46.6 224 109 B Q H X S+ 0 0 61 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43.0 99.3 -70.1 15.7 25.3 65.0 53.6 320 89 C Y T 3 S+ 0 0 65 1,-0.2 2,-0.7 -172,-0.1 -1,-0.3 0.538 75.6 75.3 -73.7 -2.6 22.8 62.2 53.4 321 90 C D S X> S- 0 0 73 -3,-1.3 3,-1.4 1,-0.1 4,-1.2 -0.924 80.4-157.8-107.5 102.0 21.1 64.9 55.4 322 91 C E H 3> S+ 0 0 66 -2,-0.7 4,-1.7 1,-0.3 -1,-0.1 0.744 87.8 64.6 -55.7 -26.1 20.2 67.5 52.8 323 92 C A H 3> S+ 0 0 41 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.865 101.6 50.4 -65.8 -35.7 20.0 70.3 55.4 324 93 C L H <> S+ 0 0 18 -3,-1.4 4,-2.9 2,-0.2 5,-0.2 0.875 104.2 58.1 -69.5 -36.5 23.7 69.8 56.0 325 94 C A H X S+ 0 0 0 -4,-1.2 4,-2.7 1,-0.2 -2,-0.2 0.914 107.2 48.4 -59.4 -42.2 24.4 70.1 52.3 326 95 C E H X S+ 0 0 69 -4,-1.7 4,-2.1 2,-0.2 -1,-0.2 0.891 111.3 49.1 -65.9 -40.5 22.7 73.5 52.3 327 96 C R H X S+ 0 0 156 -4,-1.7 4,-0.9 2,-0.2 -2,-0.2 0.961 114.5 45.3 -62.3 -52.0 24.7 74.7 55.4 328 97 C I H >X S+ 0 0 0 -4,-2.9 3,-1.1 1,-0.2 4,-0.7 0.931 111.9 51.6 -56.5 -48.6 28.0 73.5 53.9 329 98 C Y H >< S+ 0 0 33 -4,-2.7 3,-1.2 1,-0.3 -1,-0.2 0.890 104.0 57.3 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D R H <> S+ 0 0 80 -3,-0.9 4,-1.8 2,-0.2 -1,-0.2 0.929 111.1 51.6 -65.7 -44.7 32.4 23.3 80.8 353 7 D A H >X S+ 0 0 1 -4,-2.0 4,-2.0 1,-0.2 3,-0.6 0.962 109.8 49.6 -54.3 -54.0 31.7 26.9 79.8 354 8 D V H 3X S+ 0 0 9 -4,-2.7 4,-2.5 1,-0.3 -1,-0.2 0.878 107.4 54.7 -54.3 -41.7 28.3 26.8 81.6 355 9 D E H 3X S+ 0 0 111 -4,-2.1 4,-2.0 1,-0.2 -1,-0.3 0.860 107.0 51.2 -61.7 -35.2 30.0 25.3 84.7 356 10 D R H X S+ 0 0 33 -4,-2.0 4,-0.9 1,-0.2 3,-0.6 0.919 108.2 49.1 -64.6 -42.7 30.9 29.0 89.6 360 14 D A H >< S+ 0 0 0 -4,-2.0 3,-0.9 1,-0.2 -1,-0.2 0.930 110.8 49.9 -61.7 -44.4 31.2 32.8 89.2 361 15 D L H 3< S+ 0 0 32 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.646 103.1 63.6 -68.9 -14.2 27.5 33.3 90.1 362 16 D E H << S+ 0 0 115 -4,-0.8 -1,-0.2 -3,-0.6 -2,-0.2 0.759 89.2 84.1 -79.8 -28.3 28.0 31.1 93.1 363 17 D R S << S- 0 0 112 -3,-0.9 2,-0.2 -4,-0.9 3,-0.0 -0.344 95.0 -90.4 -77.5 156.3 30.5 33.5 94.7 364 18 D P - 0 0 95 0, 0.0 2,-0.2 0, 0.0 5,-0.2 -0.499 55.4 -99.8 -68.3 130.5 29.5 36.5 96.9 365 19 D K + 0 0 117 -2,-0.2 2,-0.3 -4,-0.1 -4,-0.0 -0.316 58.8 142.7 -61.4 118.6 29.1 39.6 94.7 366 20 D D > - 0 0 78 -2,-0.2 4,-2.7 -3,-0.0 3,-0.4 -0.886 66.6 -91.6-140.9 164.4 31.9 42.1 94.5 367 21 D E H > S+ 0 0 69 -2,-0.3 4,-1.9 1,-0.2 5,-0.1 0.736 124.9 51.4 -54.8 -25.4 33.0 44.0 91.4 368 22 D F H > S+ 0 0 20 2,-0.2 4,-2.1 3,-0.2 -1,-0.2 0.872 111.7 44.4 -79.9 -40.0 35.5 41.4 90.4 369 23 D I H > S+ 0 0 15 -3,-0.4 4,-2.6 2,-0.2 5,-0.2 0.916 114.3 52.5 -67.5 -42.7 33.1 38.4 90.7 370 24 D R H X S+ 0 0 8 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.950 112.5 42.9 -56.0 -53.8 30.5 40.5 88.8 371 25 D D H X S+ 0 0 0 -4,-1.9 4,-2.3 1,-0.2 -1,-0.2 0.862 113.7 52.0 -63.8 -36.0 32.9 41.3 86.0 372 26 D S H X S+ 0 0 0 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.880 108.5 51.4 -69.7 -33.7 34.2 37.7 85.9 373 27 D A H X S+ 0 0 0 -4,-2.6 4,-1.7 1,-0.2 -2,-0.2 0.911 110.8 48.8 -67.8 -39.8 30.6 36.5 85.6 374 28 D I H X S+ 0 0 0 -4,-2.1 4,-1.5 2,-0.2 -2,-0.2 0.891 109.4 50.8 -65.7 -41.4 29.9 38.8 82.7 375 29 D Q H X S+ 0 0 0 -4,-2.3 4,-1.7 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113.4 57.2 -68.0 -22.0 24.7 29.9 69.6 386 40 D K H X S+ 0 0 75 -4,-1.4 4,-2.1 -5,-0.3 -1,-0.2 0.866 107.3 47.4 -71.8 -37.9 27.6 28.3 67.8 387 41 D T H X S+ 0 0 32 -4,-1.6 4,-1.2 1,-0.2 -2,-0.2 0.717 108.0 55.2 -75.6 -23.1 26.4 24.9 69.1 388 42 D L H X S+ 0 0 2 -4,-1.4 4,-2.3 2,-0.2 -1,-0.2 0.775 108.6 49.9 -77.7 -26.6 22.9 25.7 68.0 389 43 D K H X S+ 0 0 58 -4,-1.1 4,-2.7 2,-0.2 5,-0.2 0.945 107.9 51.3 -73.4 -50.2 24.3 26.3 64.5 390 44 D T H < S+ 0 0 90 -4,-2.1 4,-0.5 1,-0.2 -2,-0.2 0.839 115.8 44.3 -54.0 -36.0 26.2 23.0 64.5 391 45 D F H >X S+ 0 0 69 -4,-1.2 4,-1.1 2,-0.2 3,-0.5 0.895 113.4 47.2 -78.4 -43.3 22.9 21.4 65.5 392 46 D L H 3<>S+ 0 0 1 -4,-2.3 5,-2.2 1,-0.2 -2,-0.2 0.816 104.0 61.9 -69.4 -30.9 20.6 23.2 63.1 393 47 D E T ><5S+ 0 0 100 -4,-2.7 3,-1.0 3,-0.2 -1,-0.2 0.783 98.0 60.4 -66.0 -25.2 22.9 22.6 60.1 394 48 D L T <45S+ 0 0 138 -3,-0.5 2,-0.5 -4,-0.5 -1,-0.2 0.979 103.9 46.2 -65.3 -55.9 22.4 18.9 60.6 395 49 D Q T 3<5S- 0 0 137 -4,-1.1 -1,-0.3 1,-0.1 -2,-0.2 0.034 130.0 -96.0 -78.3 33.0 18.6 19.1 60.1 396 50 D G T < 5S+ 0 0 65 -3,-1.0 2,-0.4 -2,-0.5 -3,-0.2 0.878 79.5 138.8 58.0 45.9 19.3 21.2 57.0 397 51 D L < - 0 0 41 -5,-2.2 2,-0.2 -8,-0.2 -1,-0.2 -0.976 46.3-132.7-126.1 136.1 18.8 24.7 58.6 398 52 D E + 0 0 127 -2,-0.4 10,-0.1 1,-0.1 3,-0.0 -0.571 30.6 159.8 -84.1 143.8 20.9 27.8 58.1 399 53 D A + 0 0 2 -2,-0.2 5,-0.2 8,-0.0 -1,-0.1 0.608 11.3 152.1-123.3 -72.4 22.1 29.9 61.0 400 54 D R S S+ 0 0 97 4,-0.1 3,-0.1 -14,-0.1 -218,-0.1 0.402 73.0 53.1 48.7 -2.6 25.0 32.3 60.3 401 55 D S S > S- 0 0 1 -16,-0.1 4,-3.0 1,-0.1 5,-0.2 -0.984 82.9-123.9-156.0 145.5 23.8 34.6 63.0 402 56 D P H > S+ 0 0 0 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.864 113.8 50.8 -59.3 -36.2 22.8 34.2 66.7 403 57 D R H > S+ 0 0 51 -239,-2.0 4,-2.5 2,-0.2 5,-0.1 0.926 113.6 45.1 -67.2 -42.0 19.3 35.6 66.1 404 58 D A H > S+ 0 0 17 -240,-0.3 4,-2.0 -5,-0.2 -1,-0.2 0.899 113.3 50.7 -66.2 -41.5 18.8 33.2 63.2 405 59 D A H X S+ 0 0 0 -4,-3.0 4,-1.8 2,-0.2 -1,-0.2 0.869 112.7 45.5 -65.3 -38.4 20.2 30.3 65.3 406 60 D I H X S+ 0 0 0 -4,-2.2 4,-1.3 -5,-0.2 -2,-0.2 0.916 112.0 51.8 -71.2 -42.1 17.9 31.1 68.2 407 61 D R H X S+ 0 0 122 -4,-2.5 4,-1.3 1,-0.2 -2,-0.2 0.841 110.8 49.2 -62.0 -33.5 14.9 31.5 65.9 408 62 D G H X S+ 0 0 9 -4,-2.0 4,-2.6 1,-0.2 6,-0.3 0.874 103.2 58.8 -73.8 -38.1 15.7 28.1 64.4 409 63 D A H <>S+ 0 0 0 -4,-1.8 6,-1.3 1,-0.2 5,-0.6 0.833 107.0 50.0 -59.8 -30.8 16.1 26.4 67.7 410 64 D F H ><5S+ 0 0 23 -4,-1.3 3,-0.8 4,-0.2 -1,-0.2 0.860 111.1 48.0 -75.5 -37.4 12.5 27.5 68.4 411 65 D Q H 3<5S+ 0 0 154 -4,-1.3 2,-0.7 1,-0.2 -2,-0.2 0.967 106.7 53.7 -67.5 -54.7 11.2 26.1 65.0 412 66 D V T 3<5S- 0 0 35 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.1 0.091 113.3-118.4 -70.5 28.4 12.8 22.7 65.3 413 67 D G T < 5S+ 0 0 56 -3,-0.8 -3,-0.2 -2,-0.7 -1,-0.2 0.529 81.3 124.8 47.6 6.5 11.1 22.4 68.6 414 68 D L S - 0 0 33 -2,-1.8 3,-2.1 1,-0.1 4,-0.4 -0.891 31.3-163.9-119.1 102.3 11.4 31.8 75.2 419 73 D P T >> S+ 0 0 94 0, 0.0 4,-1.4 0, 0.0 3,-0.6 0.643 81.0 81.3 -57.5 -13.3 11.8 35.5 74.4 420 74 D F H 3> S+ 0 0 5 1,-0.2 4,-2.8 2,-0.2 5,-0.1 0.790 81.2 65.7 -65.2 -23.7 14.5 35.7 77.0 421 75 D W H <> S+ 0 0 7 -3,-2.1 4,-1.6 2,-0.2 -1,-0.2 0.911 103.0 44.4 -64.1 -39.3 16.9 34.2 74.5 422 76 D L H <> S+ 0 0 50 -3,-0.6 4,-1.5 -4,-0.4 -1,-0.2 0.815 111.4 54.4 -73.1 -28.0 16.6 37.3 72.4 423 77 D E H X S+ 0 0 108 -4,-1.4 4,-2.2 1,-0.2 -2,-0.2 0.914 106.8 51.9 -68.2 -40.4 17.0 39.4 75.5 424 78 D X H X S+ 0 0 0 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.864 103.5 57.5 -63.4 -35.6 20.2 37.5 76.2 425 79 D L H X S+ 0 0 1 -4,-1.6 4,-1.5 1,-0.2 -1,-0.2 0.897 107.1 48.6 -61.6 -41.2 21.4 38.3 72.7 426 80 D E H X S+ 0 0 97 -4,-1.5 4,-2.4 2,-0.2 -2,-0.2 0.933 108.4 53.8 -64.9 -44.5 21.0 42.0 73.5 427 81 D L H X S+ 0 0 18 -4,-2.2 4,-1.3 1,-0.3 -2,-0.2 0.919 105.8 52.2 -56.4 -46.0 22.9 41.6 76.8 428 82 D R H < S+ 0 0 16 -4,-2.3 3,-0.3 1,-0.2 -1,-0.3 0.877 110.1 50.6 -59.3 -34.9 25.8 40.0 75.0 429 83 D N H >< S+ 0 0 18 -4,-1.5 3,-1.1 1,-0.2 -1,-0.2 0.893 107.6 52.7 -68.6 -37.7 25.7 43.1 72.7 430 84 D L H >< S+ 0 0 51 -4,-2.4 3,-1.8 1,-0.2 -1,-0.2 0.684 86.7 82.4 -71.5 -18.1 25.7 45.4 75.7 431 85 D T G >< S+ 0 0 4 -4,-1.3 3,-0.6 -3,-0.3 -1,-0.2 0.596 80.2 68.4 -65.1 -6.9 28.8 43.8 77.2 432 86 D N G < S+ 0 0 20 -3,-1.1 -1,-0.3 1,-0.2 -2,-0.2 0.780 100.8 46.4 -79.7 -27.5 30.9 45.9 74.9 433 87 D H G X + 0 0 70 -3,-1.8 3,-1.7 -4,-0.2 -1,-0.2 0.069 68.7 124.9-103.2 24.3 29.9 49.1 76.8 434 88 D T T < + 0 0 0 -3,-0.6 -1,-0.2 1,-0.3 6,-0.2 0.333 46.7 94.7 -69.1 13.6 30.5 47.8 80.3 435 89 D Y T 3 S+ 0 0 47 -3,-0.2 2,-0.8 -403,-0.1 -1,-0.3 0.562 74.6 78.1 -74.8 -5.4 32.8 50.8 80.9 436 90 D D S X> S- 0 0 70 -3,-1.7 4,-1.6 1,-0.2 3,-0.5 -0.911 75.6-164.9-101.0 103.2 29.4 51.9 82.2 437 91 D E H 3> S+ 0 0 58 -2,-0.8 4,-2.2 1,-0.2 5,-0.2 0.834 85.1 59.8 -62.8 -33.9 29.3 50.2 85.6 438 92 D A H 3> S+ 0 0 57 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.873 107.4 48.7 -61.8 -34.7 25.6 50.7 86.1 439 93 D L H <> S+ 0 0 10 -3,-0.5 4,-2.3 2,-0.2 -1,-0.2 0.867 106.9 55.1 -70.3 -38.0 25.1 48.8 82.9 440 94 D A H X S+ 0 0 0 -4,-1.6 4,-2.4 1,-0.2 -2,-0.2 0.871 108.4 49.0 -63.3 -37.5 27.4 46.0 84.2 441 95 D E H X S+ 0 0 63 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.905 109.4 52.4 -67.8 -41.7 25.2 45.7 87.2 442 96 D R H < S+ 0 0 139 -4,-1.8 4,-0.5 2,-0.2 -2,-0.2 0.902 112.3 44.6 -60.4 -43.1 22.1 45.5 85.0 443 97 D I H >X S+ 0 0 0 -4,-2.3 3,-1.8 1,-0.2 4,-0.6 0.939 110.8 54.1 -66.1 -49.1 23.6 42.7 82.9 444 98 D Y H >< S+ 0 0 32 -4,-2.4 3,-1.1 1,-0.3 -1,-0.2 0.844 100.0 62.0 -53.9 -37.4 24.9 40.8 86.0 445 99 D A T 3< S+ 0 0 64 -4,-2.0 -1,-0.3 1,-0.2 4,-0.3 0.726 105.9 46.6 -62.8 -21.8 21.4 40.9 87.5 446 100 D E T <> S+ 0 0 58 -3,-1.8 4,-2.3 -4,-0.5 -1,-0.2 0.476 87.0 90.1 -98.3 -6.5 20.1 38.8 84.5 447 101 D L H S+ 0 0 68 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.950 110.4 44.0 -55.9 -45.7 21.1 33.8 86.9 449 103 D K H > S+ 0 0 87 -4,-0.3 4,-1.8 1,-0.2 -2,-0.2 0.925 111.5 55.3 -60.8 -43.7 18.2 33.6 84.4 450 104 D A H X S+ 0 0 0 -4,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.910 104.9 52.0 -55.1 -45.8 20.8 33.3 81.6 451 105 D L H X S+ 0 0 20 -4,-2.9 4,-2.5 1,-0.2 -1,-0.2 0.886 104.5 57.9 -59.1 -40.7 22.4 30.3 83.3 452 106 D E H X S+ 0 0 112 -4,-1.8 4,-2.0 -5,-0.2 -1,-0.2 0.914 107.2 46.8 -56.2 -45.5 19.0 28.7 83.6 453 107 D R H X S+ 0 0 42 -4,-1.8 4,-1.3 2,-0.2 -1,-0.2 0.840 110.1 52.5 -67.6 -34.0 18.6 28.9 79.8 454 108 D F H X S+ 0 0 0 -4,-1.8 4,-1.9 2,-0.2 3,-0.2 0.948 110.2 48.3 -66.3 -46.9 22.1 27.5 79.1 455 109 D Q H X S+ 0 0 62 -4,-2.5 4,-2.0 1,-0.3 -2,-0.2 0.879 110.3 50.8 -60.7 -39.9 21.4 24.5 81.4 456 110 D E H X S+ 0 0 55 -4,-2.0 4,-1.9 1,-0.2 -1,-0.3 0.809 109.5 53.3 -67.4 -28.6 18.1 23.8 79.7 457 111 D L H X S+ 0 0 0 -4,-1.3 4,-1.2 -3,-0.2 -2,-0.2 0.841 105.0 53.1 -73.9 -35.6 19.9 24.0 76.4 458 112 D L H X S+ 0 0 34 -4,-1.9 4,-1.2 2,-0.2 -2,-0.2 0.940 111.7 45.9 -65.3 -45.7 22.5 21.4 77.5 459 113 D R H >< S+ 0 0 149 -4,-2.0 3,-2.2 1,-0.2 -2,-0.2 0.995 115.3 43.7 -57.6 -69.1 19.8 18.9 78.5 460 114 D R H 3< S+ 0 0 99 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.698 109.0 62.7 -49.4 -22.1 17.7 19.3 75.3 461 115 D L H 3< 0 0 24 -4,-1.2 -1,-0.3 -5,-0.1 -2,-0.2 0.797 360.0 360.0 -77.5 -28.4 20.9 19.2 73.3 462 116 D E << 0 0 195 -3,-2.2 -2,-0.1 -4,-1.2 -3,-0.1 0.820 360.0 360.0-106.7 360.0 21.8 15.7 74.4