==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE,TRANSLATION 10-FEB-05 1YTA . COMPND 2 MOLECULE: OLIGORIBONUCLEASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR T.J.FIEDLER,Y.ZUO,A.MALHOTRA . 720 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 29575.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 531 73.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 28 3.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 76 10.6 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 . 4 0.6 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 . 47 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 81 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 263 36.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 1.5 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 5 3 2 4 0 4 0 8 4 0 0 0 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 4 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 PARALLEL BRIDGES PER LADDER . 2 4 4 0 0 0 0 4 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 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 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1 A S 0 0 126 0, 0.0 2,-0.9 0, 0.0 93,-0.1 0.000 360.0 360.0 360.0 93.8 49.8 38.5 44.3 2 2 A A - 0 0 62 91,-0.1 2,-0.4 94,-0.1 94,-0.3 -0.643 360.0-178.7 -78.5 106.0 46.2 37.4 43.5 3 3 A N > - 0 0 70 92,-1.6 3,-2.1 -2,-0.9 92,-0.0 -0.903 31.5-139.0-110.2 134.4 46.3 33.6 43.2 4 4 A E T 3 S+ 0 0 107 -2,-0.4 -1,-0.1 1,-0.3 92,-0.1 0.665 103.2 60.2 -62.1 -17.6 43.2 31.6 42.3 5 5 A N T 3 S+ 0 0 72 2,-0.1 -1,-0.3 96,-0.1 2,-0.1 0.393 81.3 112.7 -90.9 1.7 44.3 29.0 44.9 6 6 A N < - 0 0 9 -3,-2.1 2,-0.4 89,-0.2 27,-0.2 -0.466 59.6-136.7 -78.3 148.9 44.1 31.4 47.8 7 7 A L E -A 32 0A 0 25,-2.1 25,-2.0 -2,-0.1 2,-0.6 -0.893 4.3-143.0-111.0 133.6 41.5 31.1 50.5 8 8 A I E -Ab 31 103A 0 94,-0.6 96,-2.0 -2,-0.4 2,-0.4 -0.831 15.0-165.1 -97.1 118.5 39.5 33.9 52.1 9 9 A W E +Ab 30 104A 0 21,-3.1 21,-1.9 -2,-0.6 2,-0.3 -0.854 12.3 178.9-103.4 133.9 38.8 33.5 55.8 10 10 A I E -A 29 0A 3 94,-2.2 2,-0.3 -2,-0.4 19,-0.2 -0.957 15.4-178.4-136.2 155.1 36.2 35.7 57.4 11 11 A D E -A 28 0A 33 17,-2.0 17,-1.4 -2,-0.3 2,-0.3 -0.926 9.9-175.2-153.4 124.9 34.6 36.2 60.8 12 12 A L E -A 27 0A 5 -2,-0.3 2,-0.3 15,-0.2 15,-0.2 -0.734 15.5-147.6-117.8 166.9 31.8 38.6 61.7 13 13 A E E -A 26 0A 49 13,-1.9 12,-2.0 -2,-0.3 13,-1.3 -0.930 22.6-172.8-127.2 150.8 30.1 39.7 64.9 14 14 A X E -A 24 0A 21 -2,-0.3 10,-0.2 10,-0.3 3,-0.1 -0.941 37.7-115.9-143.0 165.2 26.3 40.6 64.9 15 15 A T S S- 0 0 0 8,-2.3 43,-0.6 -2,-0.3 2,-0.3 0.655 94.2 -22.5 -75.5 -16.1 23.7 42.0 67.2 16 16 A G S S- 0 0 4 7,-0.3 -1,-0.1 41,-0.1 41,-0.1 -0.966 70.3 -88.9-173.7-176.3 21.8 38.8 67.1 17 17 A L S S+ 0 0 129 -2,-0.3 -1,-0.0 -3,-0.1 -2,-0.0 0.461 93.1 90.6 -91.2 -3.6 21.1 35.5 65.1 18 18 A D >> - 0 0 74 1,-0.1 4,-3.9 5,-0.0 3,-1.1 -0.837 57.6-161.7-102.9 108.1 18.3 36.9 62.9 19 19 A P T 34 S+ 0 0 12 0, 0.0 -1,-0.1 0, 0.0 5,-0.1 0.783 92.6 50.4 -53.4 -34.5 19.4 38.4 59.5 20 20 A E T 34 S+ 0 0 84 1,-0.1 -2,-0.0 3,-0.0 3,-0.0 0.747 124.5 26.8 -79.8 -21.8 16.1 40.3 59.1 21 21 A R T <4 S+ 0 0 128 -3,-1.1 2,-0.1 2,-0.0 -1,-0.1 0.715 115.7 59.8-108.7 -32.1 16.2 41.8 62.6 22 22 A D < - 0 0 10 -4,-3.9 2,-0.3 -6,-0.0 32,-0.0 -0.427 65.2-142.5 -98.9 172.8 19.9 42.0 63.5 23 23 A R - 0 0 65 -2,-0.1 -8,-2.3 30,-0.1 2,-0.4 -0.892 23.2-101.4-134.7 163.0 22.9 43.7 62.0 24 24 A I E +A 14 0A 0 -2,-0.3 -10,-0.3 -10,-0.2 3,-0.1 -0.686 34.7 171.9 -81.4 132.7 26.6 43.2 61.4 25 25 A I E + 0 0 2 -12,-2.0 22,-1.6 -2,-0.4 2,-0.3 0.458 63.6 25.1-119.8 -8.5 28.7 45.1 64.0 26 26 A E E -AC 13 46A 8 -13,-1.3 -13,-1.9 20,-0.3 2,-0.4 -0.967 56.7-174.6-157.8 142.0 32.2 43.7 63.2 27 27 A I E +AC 12 45A 0 18,-2.1 18,-3.3 -2,-0.3 2,-0.3 -1.000 6.3 171.3-139.7 139.3 34.1 42.2 60.3 28 28 A A E -A 11 0A 0 -17,-1.4 -17,-2.0 -2,-0.4 2,-0.3 -0.990 6.0-179.6-145.2 143.9 37.5 40.8 59.9 29 29 A T E +A 10 0A 0 -2,-0.3 13,-2.0 14,-0.3 2,-0.3 -0.967 6.8 178.3-144.7 159.3 39.2 38.9 57.1 30 30 A L E -AD 9 41A 0 -21,-1.9 -21,-3.1 -2,-0.3 2,-0.4 -0.970 19.2-136.3-156.5 153.2 42.5 37.2 56.3 31 31 A V E -AD 8 40A 0 9,-2.6 8,-2.7 -2,-0.3 9,-1.5 -0.974 18.4-179.2-122.6 133.2 43.9 35.3 53.3 32 32 A T E -AD 7 38A 0 -25,-2.0 -25,-2.1 -2,-0.4 6,-0.2 -0.708 30.4-108.8-116.8 171.2 46.0 32.1 53.3 33 33 A D > - 0 0 34 4,-1.8 3,-2.7 -2,-0.2 -27,-0.2 -0.468 49.2 -84.2 -92.4 174.5 47.4 30.1 50.4 34 34 A A T 3 S+ 0 0 18 1,-0.3 -28,-0.1 -2,-0.2 -1,-0.1 0.741 132.5 53.1 -49.6 -25.2 46.0 26.8 49.4 35 35 A N T 3 S- 0 0 85 2,-0.1 -1,-0.3 289,-0.0 3,-0.1 0.102 121.1-105.1-101.9 22.0 48.2 25.2 52.1 36 36 A L < + 0 0 11 -3,-2.7 2,-0.4 1,-0.2 -2,-0.1 0.564 68.4 147.5 70.0 12.4 47.0 27.4 54.9 37 37 A N - 0 0 95 1,-0.1 -4,-1.8 -4,-0.0 2,-0.5 -0.683 54.1-119.5 -77.6 128.4 50.0 29.7 55.1 38 38 A I E +D 32 0A 61 -2,-0.4 -6,-0.3 -6,-0.2 3,-0.1 -0.591 37.0 174.6 -73.4 120.5 48.7 33.2 56.2 39 39 A L E - 0 0 68 -8,-2.7 2,-0.3 -2,-0.5 -7,-0.2 0.798 61.7 -2.4 -95.5 -36.8 49.6 35.7 53.4 40 40 A A E -D 31 0A 17 -9,-1.5 -9,-2.6 55,-0.0 2,-0.6 -0.966 56.0-138.7-161.0 141.9 48.0 38.8 54.6 41 41 A E E -D 30 0A 94 -2,-0.3 -11,-0.2 -11,-0.2 3,-0.1 -0.911 26.1-150.6-106.0 120.9 45.7 40.0 57.4 42 42 A G - 0 0 8 -13,-2.0 2,-0.2 -2,-0.6 46,-0.1 -0.033 34.9 -64.0 -78.4-172.7 42.9 42.4 56.3 43 43 A P - 0 0 48 0, 0.0 2,-0.7 0, 0.0 -14,-0.3 -0.541 35.0-141.8 -79.9 137.4 41.3 45.1 58.3 44 44 A T - 0 0 60 -2,-0.2 2,-0.5 -16,-0.2 -16,-0.2 -0.891 31.4-171.9 -95.2 116.9 39.2 44.4 61.5 45 45 A I E -C 27 0A 17 -18,-3.3 -18,-2.1 -2,-0.7 2,-0.6 -0.949 25.4-145.2-123.9 123.9 36.3 46.9 61.2 46 46 A A E -C 26 0A 10 -2,-0.5 2,-0.5 -20,-0.2 33,-0.4 -0.728 28.5-137.8 -80.9 124.3 33.6 47.7 63.8 47 47 A V - 0 0 0 -22,-1.6 33,-0.2 -2,-0.6 2,-0.1 -0.748 15.2-123.5 -89.2 123.9 30.5 48.4 61.7 48 48 A H + 0 0 76 31,-3.2 2,-0.3 -2,-0.5 33,-0.3 -0.422 35.1 173.0 -67.2 136.6 28.5 51.4 62.8 49 49 A Q - 0 0 20 25,-0.3 28,-0.1 -2,-0.1 5,-0.0 -0.981 36.1 -92.2-142.1 146.9 24.8 50.7 63.6 50 50 A S > - 0 0 59 -2,-0.3 4,-2.2 1,-0.1 5,-0.1 -0.013 29.8-115.2 -57.1 161.2 22.2 53.1 65.1 51 51 A D H > S+ 0 0 115 1,-0.2 4,-0.9 2,-0.2 -1,-0.1 0.756 116.7 56.2 -69.4 -25.3 21.5 53.4 68.8 52 52 A E H 4 S+ 0 0 161 2,-0.2 4,-0.5 1,-0.1 -1,-0.2 0.850 107.1 48.0 -74.7 -35.7 18.0 52.0 68.2 53 53 A Q H >4 S+ 0 0 16 1,-0.2 3,-2.1 2,-0.2 4,-0.5 0.952 109.7 52.3 -67.9 -48.7 19.4 48.9 66.6 54 54 A L H >< S+ 0 0 18 -4,-2.2 3,-0.7 1,-0.3 -1,-0.2 0.762 102.5 60.4 -58.2 -25.9 21.8 48.4 69.5 55 55 A A T 3< S+ 0 0 83 -4,-0.9 -1,-0.3 1,-0.2 -2,-0.2 0.700 96.0 63.6 -74.3 -18.8 18.9 48.7 71.8 56 56 A L T < S+ 0 0 73 -3,-2.1 -1,-0.2 -4,-0.5 -2,-0.2 0.638 75.1 116.6 -79.8 -16.1 17.3 45.7 70.1 57 57 A X < - 0 0 16 -3,-0.7 -41,-0.1 -4,-0.5 -42,-0.0 -0.216 67.7-118.0 -55.4 140.1 20.1 43.3 71.2 58 58 A D > - 0 0 81 -43,-0.6 4,-2.5 1,-0.1 3,-0.3 -0.223 35.2 -89.7 -74.8 171.2 19.1 40.4 73.4 59 59 A D H > S+ 0 0 120 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.889 123.9 43.7 -47.3 -54.1 20.4 40.0 77.0 60 60 A W H > S+ 0 0 192 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.825 113.4 50.4 -68.3 -31.0 23.4 37.8 76.1 61 61 A N H > S+ 0 0 32 -3,-0.3 4,-2.7 2,-0.2 5,-0.3 0.937 108.2 51.8 -72.2 -45.0 24.5 39.8 73.0 62 62 A V H X S+ 0 0 55 -4,-2.5 4,-1.6 1,-0.2 5,-0.3 0.904 112.7 47.6 -57.1 -41.2 24.4 43.1 74.9 63 63 A R H X S+ 0 0 142 -4,-1.7 4,-2.4 -5,-0.3 -1,-0.2 0.945 114.5 43.1 -65.2 -50.7 26.6 41.6 77.6 64 64 A T H X S+ 0 0 64 -4,-2.0 4,-1.5 1,-0.2 6,-0.3 0.925 119.1 42.3 -62.4 -48.5 29.2 40.0 75.3 65 65 A H H < S+ 0 0 7 -4,-2.7 6,-2.5 2,-0.2 5,-0.5 0.753 116.3 47.9 -74.3 -24.5 29.6 42.9 73.0 66 66 A T H >< S+ 0 0 75 -4,-1.6 3,-0.5 -5,-0.3 6,-0.2 0.891 112.6 49.8 -80.1 -39.1 29.6 45.6 75.7 67 67 A A H 3< S+ 0 0 85 -4,-2.4 -2,-0.2 -5,-0.3 -3,-0.2 0.786 108.7 51.4 -68.1 -30.8 32.2 43.6 77.7 68 68 A S T 3< S- 0 0 42 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.668 114.0-116.2 -80.5 -16.5 34.5 43.1 74.8 69 69 A G S <> S+ 0 0 25 -3,-0.5 4,-2.0 -4,-0.4 3,-0.3 0.341 83.9 120.7 96.4 -4.5 34.4 46.9 74.1 70 70 A L H > + 0 0 3 -5,-0.5 4,-3.0 -6,-0.3 5,-0.2 0.877 67.0 60.2 -60.3 -38.1 32.8 46.3 70.7 71 71 A V H > S+ 0 0 17 -6,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.912 107.7 45.8 -57.4 -41.4 29.7 48.4 71.7 72 72 A E H > S+ 0 0 111 -3,-0.3 4,-1.9 -7,-0.3 -1,-0.2 0.922 113.0 48.7 -67.1 -44.1 32.0 51.4 72.2 73 73 A R H X S+ 0 0 96 -4,-2.0 4,-1.1 1,-0.2 -2,-0.2 0.887 110.0 53.0 -63.2 -38.6 33.9 50.8 68.9 74 74 A V H < S+ 0 0 1 -4,-3.0 -25,-0.3 1,-0.2 -1,-0.2 0.893 110.6 46.2 -64.5 -41.0 30.6 50.4 67.0 75 75 A K H < S+ 0 0 95 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.834 116.0 45.6 -70.5 -32.5 29.3 53.7 68.4 76 76 A A H < S+ 0 0 81 -4,-1.9 -1,-0.2 -5,-0.1 -2,-0.2 0.593 93.1 109.4 -85.5 -11.2 32.6 55.5 67.6 77 77 A S < - 0 0 19 -4,-1.1 -30,-0.1 -5,-0.2 -28,-0.1 -0.384 49.0-168.6 -69.9 140.6 32.7 53.8 64.1 78 78 A T + 0 0 131 -2,-0.1 2,-0.5 -32,-0.1 -1,-0.1 0.078 64.0 90.5-113.7 19.2 32.2 55.9 61.0 79 79 A X - 0 0 58 -33,-0.4 -31,-3.2 -5,-0.1 -2,-0.1 -0.957 54.9-171.6-122.7 116.0 31.9 52.9 58.7 80 80 A G > - 0 0 15 -2,-0.5 4,-2.4 -33,-0.2 5,-0.3 -0.086 50.3 -70.1 -87.3-166.5 28.5 51.4 58.0 81 81 A D H > S+ 0 0 35 -33,-0.3 4,-2.1 1,-0.2 5,-0.1 0.909 132.0 42.0 -52.2 -51.9 27.7 48.2 56.1 82 82 A R H > S+ 0 0 102 2,-0.2 4,-3.1 1,-0.2 -1,-0.2 0.898 114.5 49.3 -66.2 -44.5 28.7 49.5 52.7 83 83 A E H > S+ 0 0 90 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.902 115.2 44.3 -63.5 -43.0 31.8 51.4 53.7 84 84 A A H X S+ 0 0 0 -4,-2.4 4,-2.0 2,-0.2 -1,-0.2 0.881 113.1 53.3 -69.3 -36.0 33.1 48.3 55.7 85 85 A E H X S+ 0 0 6 -4,-2.1 4,-2.4 -5,-0.3 -2,-0.2 0.948 108.8 48.9 -61.8 -49.2 32.1 46.2 52.7 86 86 A L H X S+ 0 0 76 -4,-3.1 4,-2.5 1,-0.2 -2,-0.2 0.896 110.9 48.8 -59.3 -43.6 34.1 48.4 50.3 87 87 A A H X S+ 0 0 33 -4,-2.0 4,-1.6 1,-0.2 -1,-0.2 0.891 111.2 50.9 -65.4 -37.8 37.3 48.4 52.4 88 88 A T H X S+ 0 0 0 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.915 112.2 46.2 -67.0 -40.7 37.1 44.6 52.8 89 89 A L H X S+ 0 0 6 -4,-2.4 4,-3.0 2,-0.2 5,-0.2 0.906 107.1 57.4 -67.3 -40.6 36.7 44.1 49.0 90 90 A E H < S+ 0 0 109 -4,-2.5 4,-0.4 1,-0.2 -1,-0.2 0.875 112.4 42.8 -57.7 -36.6 39.6 46.6 48.3 91 91 A F H >< S+ 0 0 26 -4,-1.6 3,-1.0 -5,-0.2 4,-0.2 0.931 115.0 47.9 -73.8 -49.4 41.8 44.3 50.5 92 92 A L H >X S+ 0 0 0 -4,-2.6 3,-2.5 1,-0.2 4,-2.4 0.878 99.3 66.5 -60.9 -40.2 40.5 41.0 49.1 93 93 A K T 3< S+ 0 0 103 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.1 0.740 97.6 56.8 -55.6 -22.4 40.9 42.1 45.4 94 94 A Q T <4 S+ 0 0 118 -3,-1.0 -1,-0.3 -4,-0.4 -2,-0.2 0.537 118.2 28.8 -88.0 -4.9 44.6 42.2 45.9 95 95 A W T <4 S+ 0 0 62 -3,-2.5 -92,-1.6 1,-0.3 -2,-0.2 0.652 122.7 28.2-126.1 -25.7 44.9 38.6 47.0 96 96 A V S < S- 0 0 0 -4,-2.4 -1,-0.3 -94,-0.3 -92,-0.1 -0.990 70.9-126.7-144.7 133.1 42.2 36.5 45.5 97 97 A P > - 0 0 44 0, 0.0 3,-1.1 0, 0.0 4,-0.5 -0.404 47.4 -83.3 -74.7 155.5 40.2 36.8 42.3 98 98 A A T 3 S+ 0 0 57 1,-0.2 28,-0.2 2,-0.1 27,-0.1 -0.164 106.2 12.9 -60.1 149.8 36.4 36.9 42.5 99 99 A G T 3 S+ 0 0 31 26,-2.2 -1,-0.2 25,-0.2 29,-0.2 0.519 101.2 97.5 63.8 9.7 34.4 33.7 42.6 100 100 A K < + 0 0 65 -3,-1.1 -2,-0.1 25,-0.4 26,-0.1 0.836 67.4 61.9 -96.6 -38.7 37.4 31.5 43.4 101 101 A S S S- 0 0 0 -4,-0.5 26,-3.8 24,-0.4 -2,-0.1 -0.734 71.3-137.6 -96.9 136.1 37.4 31.0 47.1 102 102 A P - 0 0 0 0, 0.0 -94,-0.6 0, 0.0 2,-0.5 -0.362 45.2 -87.2 -75.7 170.2 34.7 29.3 49.1 103 103 A I E -be 8 130A 0 26,-1.8 28,-2.8 24,-0.3 2,-0.4 -0.712 53.3-156.3 -82.4 126.1 33.9 31.1 52.4 104 104 A C E +be 9 131A 0 -96,-2.0 -94,-2.2 -2,-0.5 2,-0.3 -0.863 37.4 68.2-112.8 142.0 36.2 29.8 55.1 105 105 A G E S- e 0 132A 2 26,-1.6 28,-2.7 -2,-0.4 2,-0.5 -0.979 82.4 -44.4 155.8-161.9 36.0 29.7 58.9 106 106 A N S S- 0 0 32 -2,-0.3 26,-0.1 1,-0.2 60,-0.0 -0.915 118.0 -16.1-106.2 123.1 34.1 28.1 61.7 107 107 A S S >> S+ 0 0 28 -2,-0.5 3,-0.7 1,-0.1 4,-0.6 0.930 79.9 164.9 49.3 51.8 30.3 27.8 61.2 108 108 A I H 3> + 0 0 2 -3,-0.3 4,-2.6 1,-0.2 5,-0.2 0.432 54.1 86.9 -77.8 1.8 30.6 30.5 58.5 109 109 A G H 3> S+ 0 0 1 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.928 90.1 46.8 -65.1 -43.9 27.1 29.6 57.4 110 110 A Q H <> S+ 0 0 32 -3,-0.7 4,-1.1 2,-0.2 -1,-0.2 0.876 112.3 50.6 -65.3 -38.8 25.6 32.0 59.9 111 111 A D H >X S+ 0 0 11 -4,-0.6 4,-1.9 1,-0.2 3,-0.7 0.940 107.4 53.0 -66.1 -45.2 28.1 34.7 58.8 112 112 A R H 3X S+ 0 0 3 -4,-2.6 4,-2.7 1,-0.2 -1,-0.2 0.846 99.7 63.8 -61.3 -31.0 27.2 34.2 55.1 113 113 A R H 3X S+ 0 0 23 -4,-1.5 4,-1.3 1,-0.2 -1,-0.2 0.914 106.7 43.0 -58.7 -41.1 23.6 34.7 55.9 114 114 A F H S+ 0 0 0 -4,-1.1 4,-3.0 -3,-0.7 5,-0.5 0.850 110.9 54.7 -73.7 -33.3 24.3 38.3 57.0 115 115 A L H X5S+ 0 0 0 -4,-1.9 4,-2.1 1,-0.2 8,-0.4 0.925 103.6 57.0 -64.0 -43.0 26.6 39.0 54.1 116 116 A F H <5S+ 0 0 50 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.910 117.3 33.9 -53.0 -46.0 23.8 37.9 51.7 117 117 A K H <5S+ 0 0 62 -4,-1.3 -2,-0.2 -5,-0.2 -1,-0.2 0.917 133.8 20.5 -79.6 -46.6 21.5 40.6 53.2 118 118 A Y H <5S+ 0 0 31 -4,-3.0 -3,-0.2 1,-0.2 -2,-0.2 0.663 130.8 33.7-101.9 -19.2 23.9 43.5 54.1 119 119 A X X< + 0 0 0 -4,-2.1 4,-2.7 -5,-0.5 -1,-0.2 -0.490 64.3 158.9-135.2 64.0 27.0 43.0 52.0 120 120 A P H > S+ 0 0 72 0, 0.0 4,-2.5 0, 0.0 5,-0.1 0.838 74.1 52.2 -55.6 -40.8 25.8 41.5 48.7 121 121 A E H > S+ 0 0 97 2,-0.2 4,-0.7 1,-0.2 -2,-0.1 0.929 112.4 44.2 -66.5 -44.0 28.8 42.5 46.7 122 122 A L H >> S+ 0 0 0 1,-0.2 3,-1.2 2,-0.2 4,-0.6 0.933 112.2 54.3 -65.3 -42.3 31.3 41.0 49.2 123 123 A E H >< S+ 0 0 17 -4,-2.7 3,-1.4 -8,-0.4 -2,-0.2 0.929 107.2 50.3 -56.5 -45.3 29.0 37.9 49.4 124 124 A A H 3< S+ 0 0 67 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.638 96.0 71.6 -69.0 -12.4 29.2 37.5 45.6 125 125 A Y H << S+ 0 0 28 -3,-1.2 -26,-2.2 -4,-0.7 -25,-0.4 0.749 88.3 79.4 -75.2 -20.9 33.0 37.8 45.7 126 126 A F S << S- 0 0 3 -3,-1.4 2,-0.1 -4,-0.6 -23,-0.1 -0.451 91.8-108.4 -83.7 157.9 33.1 34.3 47.2 127 127 A H - 0 0 24 -26,-3.8 -24,-0.3 -2,-0.1 -27,-0.1 -0.439 40.0-108.6 -73.8 160.2 32.7 31.0 45.4 128 128 A Y S S+ 0 0 11 -29,-0.2 -1,-0.1 -26,-0.1 -25,-0.1 0.778 90.3 93.6 -68.3 -22.7 29.3 29.5 46.2 129 129 A R - 0 0 19 1,-0.1 -26,-1.8 186,-0.1 2,-0.4 -0.208 68.3-133.6 -71.8 160.9 30.8 26.7 48.3 130 130 A Y E -e 103 0A 7 -28,-0.2 2,-0.5 2,-0.1 189,-0.2 -0.909 9.7-165.1-113.5 138.3 31.4 26.6 52.0 131 131 A L E +e 104 0A 1 -28,-2.8 -26,-1.6 -2,-0.4 2,-0.7 -0.764 20.1 177.7-122.6 82.9 34.6 25.5 53.7 132 132 A D E >> -e 105 0A 3 -2,-0.5 3,-1.6 -28,-0.2 4,-0.8 -0.791 22.3-161.9 -93.3 111.9 33.4 25.1 57.3 133 133 A V H 3> S+ 0 0 1 -28,-2.7 4,-2.0 -2,-0.7 3,-0.5 0.819 90.1 66.3 -59.5 -31.2 36.1 23.9 59.7 134 134 A S H 3> S+ 0 0 5 -29,-0.4 4,-2.3 1,-0.2 -1,-0.3 0.707 91.3 63.9 -64.6 -20.7 33.4 22.8 62.2 135 135 A T H <> S+ 0 0 1 -3,-1.6 4,-2.1 2,-0.2 -1,-0.2 0.932 105.9 42.3 -67.4 -45.8 32.2 20.3 59.7 136 136 A L H X S+ 0 0 1 -4,-0.8 4,-2.5 -3,-0.5 -2,-0.2 0.895 112.5 54.4 -67.5 -38.0 35.5 18.4 60.0 137 137 A K H X S+ 0 0 31 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.933 108.2 49.8 -60.1 -43.9 35.4 18.9 63.8 138 138 A E H X S+ 0 0 0 -4,-2.3 4,-1.0 1,-0.2 -2,-0.2 0.928 112.3 46.8 -61.4 -44.9 32.0 17.3 63.8 139 139 A L H X S+ 0 0 0 -4,-2.1 4,-2.2 1,-0.2 5,-0.3 0.841 110.1 55.1 -65.9 -33.8 33.3 14.3 61.7 140 140 A A H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.910 106.1 48.9 -68.1 -42.2 36.3 14.0 64.0 141 141 A R H < S+ 0 0 95 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.756 117.2 44.0 -71.6 -18.1 34.3 13.7 67.2 142 142 A R H < S+ 0 0 37 -4,-1.0 -2,-0.2 -5,-0.2 -1,-0.2 0.766 130.6 19.3 -93.3 -29.7 32.2 11.0 65.5 143 143 A W H < S+ 0 0 35 -4,-2.2 -3,-0.2 -5,-0.1 -2,-0.2 0.561 140.4 14.7-117.2 -14.5 34.9 9.0 63.8 144 144 A K >< + 0 0 26 -4,-2.6 3,-1.3 -5,-0.3 4,-0.5 -0.273 58.9 166.5-160.8 61.1 38.1 9.8 65.5 145 145 A P T > + 0 0 66 0, 0.0 3,-0.8 0, 0.0 4,-0.4 0.713 68.0 80.4 -53.5 -21.5 37.5 11.6 68.9 146 146 A E T >> S+ 0 0 114 1,-0.2 3,-1.7 2,-0.2 4,-0.6 0.898 85.7 54.4 -53.6 -48.5 41.1 11.0 69.8 147 147 A I H X> S+ 0 0 11 -3,-1.3 3,-0.9 1,-0.3 4,-0.6 0.776 92.7 71.7 -61.5 -27.6 42.5 13.9 67.7 148 148 A L H <4 S+ 0 0 50 -3,-0.8 3,-0.4 -4,-0.5 -1,-0.3 0.736 92.7 58.0 -62.9 -19.3 40.2 16.4 69.4 149 149 A D H <4 S+ 0 0 140 -3,-1.7 -1,-0.2 -4,-0.4 -2,-0.2 0.815 99.1 58.5 -78.5 -29.2 42.4 16.0 72.6 150 150 A G H << S+ 0 0 48 -3,-0.9 2,-0.4 -4,-0.6 -1,-0.2 0.588 106.4 50.0 -76.4 -11.6 45.5 17.1 70.8 151 151 A F < + 0 0 43 -4,-0.6 2,-0.4 -3,-0.4 -1,-0.1 -0.995 62.3 171.5-131.7 128.8 44.1 20.5 69.7 152 152 A T - 0 0 116 -2,-0.4 2,-0.2 -3,-0.0 -3,-0.0 -0.975 24.6-136.4-141.3 124.5 42.4 23.0 72.0 153 153 A K - 0 0 70 -2,-0.4 9,-0.0 1,-0.1 -2,-0.0 -0.533 5.3-149.5 -78.0 143.6 41.3 26.5 71.3 154 154 A Q - 0 0 181 -2,-0.2 -1,-0.1 1,-0.0 0, 0.0 0.800 35.1-131.4 -82.5 -30.8 42.1 29.2 73.8 155 155 A G + 0 0 46 6,-0.1 2,-0.3 7,-0.1 7,-0.0 0.328 32.0 176.3 86.1 138.3 39.1 31.4 73.0 156 156 A T - 0 0 59 1,-0.1 -1,-0.0 3,-0.0 -3,-0.0 -0.983 39.9-131.1-166.0 168.9 39.3 35.2 72.5 157 157 A H S S+ 0 0 111 -2,-0.3 2,-0.4 -89,-0.0 -1,-0.1 0.741 77.4 101.6 -98.3 -32.3 37.5 38.4 71.6 158 158 A Q > - 0 0 108 1,-0.2 4,-2.1 2,-0.1 3,-0.4 -0.390 67.5-146.9 -59.4 111.2 40.0 39.6 69.0 159 159 A A H > S+ 0 0 1 -2,-0.4 4,-1.9 1,-0.2 -1,-0.2 0.873 94.1 50.1 -45.9 -50.4 38.4 38.7 65.6 160 160 A X H > S+ 0 0 1 1,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.883 108.3 50.9 -62.3 -41.3 41.7 38.1 63.9 161 161 A D H > S+ 0 0 65 -3,-0.4 4,-1.7 1,-0.2 -1,-0.2 0.889 107.6 55.8 -64.4 -35.3 43.0 35.7 66.6 162 162 A D H X S+ 0 0 41 -4,-2.1 4,-1.2 2,-0.2 -1,-0.2 0.923 110.6 44.5 -60.1 -44.6 39.7 33.9 66.3 163 163 A I H >X S+ 0 0 2 -4,-1.9 4,-2.3 1,-0.2 3,-0.6 0.934 109.3 53.5 -67.2 -46.2 40.4 33.4 62.6 164 164 A R H 3X S+ 0 0 82 -4,-2.9 4,-2.1 1,-0.3 -1,-0.2 0.822 107.8 54.3 -57.9 -28.3 44.0 32.4 63.0 165 165 A E H 3X S+ 0 0 40 -4,-1.7 4,-2.5 -5,-0.2 -1,-0.3 0.845 105.9 51.0 -74.3 -32.0 42.7 29.8 65.4 166 166 A S H X S+ 0 0 56 -4,-2.2 4,-2.5 -3,-0.2 3,-0.6 0.964 110.6 47.5 -65.9 -52.7 45.7 20.3 62.7 173 173 A Y H 3X>S+ 0 0 3 -4,-2.4 5,-3.4 1,-0.2 4,-2.0 0.824 106.0 60.1 -57.8 -32.4 43.0 18.3 60.9 174 174 A R H 3<5S+ 0 0 44 -4,-1.9 6,-0.4 -5,-0.2 -1,-0.2 0.897 113.5 36.2 -64.5 -37.5 45.1 18.3 57.7 175 175 A E H <<5S+ 0 0 101 -4,-1.4 -2,-0.2 -3,-0.6 -1,-0.2 0.882 133.0 21.3 -81.1 -42.9 47.9 16.5 59.5 176 176 A H H <5S+ 0 0 86 -4,-2.5 -3,-0.2 -5,-0.1 -2,-0.2 0.537 132.1 28.7-109.5 -7.1 46.1 14.1 61.9 177 177 A F T <5S+ 0 0 0 -4,-2.0 183,-2.5 -5,-0.3 2,-0.2 0.695 104.3 70.7-119.0 -45.2 42.5 13.6 60.5 178 178 A I B - 0 0 73 92,-1.9 3,-2.2 -2,-0.3 92,-0.0 -0.994 29.6-136.9-130.8 126.5 19.7 7.3 68.4 185 4 B E T 3 S+ 0 0 111 -2,-0.4 -1,-0.1 1,-0.3 92,-0.1 0.639 104.4 55.3 -54.7 -16.6 21.7 10.3 69.4 186 5 B N T 3 S+ 0 0 72 2,-0.1 -1,-0.3 96,-0.1 91,-0.1 0.546 81.4 112.3 -95.4 -9.3 24.4 9.4 66.9 187 6 B N < - 0 0 7 -3,-2.2 2,-0.4 89,-0.2 27,-0.2 -0.276 61.2-132.4 -65.5 149.5 22.1 9.2 63.8 188 7 B L E -G 213 0C 2 25,-2.5 25,-1.9 94,-0.1 2,-0.6 -0.869 5.1-142.7-109.3 138.2 22.5 11.8 61.0 189 8 B I E -Gh 212 284C 1 94,-0.6 96,-2.0 -2,-0.4 2,-0.4 -0.874 16.8-166.5 -99.6 119.4 19.7 13.8 59.4 190 9 B W E +Gh 211 285C 0 21,-3.3 21,-2.2 -2,-0.6 2,-0.3 -0.876 11.6 178.1-105.3 136.8 20.3 14.3 55.6 191 10 B I E -G 210 0C 2 94,-2.4 2,-0.3 -2,-0.4 96,-0.3 -0.987 17.0-176.2-142.5 152.2 18.1 16.9 53.8 192 11 B D E -G 209 0C 33 17,-2.1 17,-1.5 -2,-0.3 2,-0.2 -0.962 11.3-173.4-148.8 124.8 17.7 18.4 50.4 193 12 B L E -G 208 0C 5 -2,-0.3 2,-0.4 15,-0.2 15,-0.2 -0.706 15.5-147.3-115.1 169.0 15.3 21.2 49.4 194 13 B E E -G 207 0C 56 13,-1.8 12,-3.0 -2,-0.2 13,-1.5 -0.980 22.0-172.7-131.6 139.8 14.2 22.9 46.2 195 14 B X E -G 205 0C 19 -2,-0.4 10,-0.2 10,-0.3 3,-0.1 -0.865 36.9-119.3-131.4 166.4 13.3 26.6 46.1 196 15 B T S S- 0 0 0 8,-2.2 43,-0.6 -2,-0.3 2,-0.3 0.631 92.9 -22.3 -79.6 -13.7 11.8 29.0 43.7 197 16 B G S S- 0 0 4 7,-0.3 -1,-0.1 41,-0.1 6,-0.1 -0.972 70.8 -87.1-175.0-176.7 15.0 31.1 44.0 198 17 B L S S+ 0 0 60 -2,-0.3 -1,-0.0 1,-0.1 -2,-0.0 0.561 94.4 88.1 -87.4 -10.3 18.1 32.0 46.0 199 18 B D >> - 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0 0 21 -3,-1.1 -41,-0.1 -4,-0.1 2,-0.1 -0.389 64.9-120.3 -73.3 151.4 10.7 32.8 39.7 239 58 B D > - 0 0 41 -43,-0.6 4,-3.0 -2,-0.1 5,-0.3 -0.401 30.9 -96.4 -87.5 168.3 13.6 33.6 37.5 240 59 B D H > S+ 0 0 93 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.885 122.6 46.9 -49.6 -50.7 14.3 32.1 34.0 241 60 B W H > S+ 0 0 66 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.905 116.4 45.0 -62.0 -42.3 16.7 29.4 35.2 242 61 B N H > S+ 0 0 9 2,-0.2 4,-2.8 1,-0.2 5,-0.3 0.953 111.5 49.2 -67.7 -51.7 14.4 28.4 38.0 243 62 B V H X S+ 0 0 23 -4,-3.0 4,-1.5 1,-0.2 5,-0.2 0.889 114.4 48.0 -56.2 -40.9 11.1 28.3 36.1 244 63 B R H X S+ 0 0 56 -4,-2.0 4,-2.2 -5,-0.3 5,-0.2 0.945 114.1 44.3 -66.8 -48.6 12.7 26.3 33.3 245 64 B T H X S+ 0 0 45 -4,-2.1 4,-1.8 -5,-0.2 6,-0.2 0.936 118.6 41.4 -62.5 -48.9 14.3 23.7 35.6 246 65 B H H <>S+ 0 0 5 -4,-2.8 6,-2.1 2,-0.2 5,-0.7 0.720 114.8 51.9 -74.8 -20.5 11.3 23.2 37.9 247 66 B T H ><5S+ 0 0 26 -4,-1.5 3,-0.7 -5,-0.3 6,-0.2 0.915 110.5 46.8 -79.8 -44.6 8.8 23.2 35.0 248 67 B A H 3<5S+ 0 0 45 -4,-2.2 267,-0.3 1,-0.3 -2,-0.2 0.911 110.7 52.4 -60.9 -44.4 10.8 20.5 33.0 249 68 B S T 3<5S- 0 0 28 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.653 113.1-121.3 -66.8 -16.4 11.2 18.3 36.0 250 69 B G T <>5S+ 0 0 26 -3,-0.7 4,-2.0 -4,-0.3 3,-0.3 0.437 78.4 124.9 88.4 -0.2 7.4 18.5 36.6 251 70 B L H >< + 0 0 4 -5,-0.7 4,-3.0 -6,-0.2 -4,-0.2 0.860 66.6 59.6 -61.9 -34.4 7.9 20.0 40.0 252 71 B V H > S+ 0 0 18 -6,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.911 106.9 46.2 -62.3 -39.9 5.8 23.0 39.1 253 72 B E H > S+ 0 0 70 -3,-0.3 4,-1.8 -7,-0.3 -1,-0.2 0.919 112.7 50.3 -66.9 -41.5 2.8 20.8 38.4 254 73 B R H X S+ 0 0 95 -4,-2.0 4,-1.8 1,-0.2 -2,-0.2 0.903 110.8 50.6 -61.6 -41.3 3.4 18.9 41.6 255 74 B V H < S+ 0 0 0 -4,-3.0 3,-0.3 2,-0.2 -2,-0.2 0.958 108.9 49.4 -61.5 -52.3 3.6 22.1 43.5 256 75 B K H < S+ 0 0 66 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.834 118.0 41.1 -56.6 -35.2 0.3 23.5 42.1 257 76 B A H < S+ 0 0 74 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.701 90.4 112.0 -86.3 -22.8 -1.5 20.2 43.0 258 77 B S < - 0 0 23 -4,-1.8 -30,-0.1 -3,-0.3 -28,-0.0 -0.192 50.5-162.6 -55.3 141.0 0.2 19.8 46.4 259 78 B T + 0 0 134 -32,-0.1 2,-0.5 1,-0.1 -1,-0.1 0.067 66.5 88.0-111.8 21.0 -2.1 20.1 49.4 260 79 B X - 0 0 55 -33,-0.4 -31,-2.7 -5,-0.1 -2,-0.1 -0.937 56.3-171.1-127.8 111.7 0.8 20.6 51.8 261 80 B G > - 0 0 26 -2,-0.5 4,-2.2 -33,-0.2 5,-0.3 -0.079 49.3 -73.3 -82.5-171.0 2.1 24.1 52.5 262 81 B D H > S+ 0 0 21 -33,-0.4 4,-2.3 2,-0.2 5,-0.2 0.928 129.6 45.5 -51.5 -57.1 5.3 24.9 54.5 263 82 B R H > S+ 0 0 116 1,-0.2 4,-3.0 2,-0.2 -1,-0.2 0.945 114.7 46.3 -56.3 -52.0 3.9 24.1 57.9 264 83 B E H > S+ 0 0 109 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.836 113.8 48.5 -63.2 -32.3 2.2 20.9 57.0 265 84 B A H X S+ 0 0 0 -4,-2.2 4,-1.8 2,-0.2 -1,-0.2 0.853 111.9 51.8 -74.2 -32.3 5.3 19.7 55.1 266 85 B E H X S+ 0 0 5 -4,-2.3 4,-2.5 -5,-0.3 -2,-0.2 0.939 108.9 49.1 -66.7 -47.3 7.3 20.7 58.2 267 86 B L H X S+ 0 0 60 -4,-3.0 4,-2.2 1,-0.2 -2,-0.2 0.925 111.5 49.1 -58.3 -45.7 5.0 18.7 60.5 268 87 B A H X S+ 0 0 31 -4,-2.0 4,-1.6 2,-0.2 -1,-0.2 0.863 111.1 49.4 -63.2 -37.8 5.2 15.6 58.3 269 88 B T H X S+ 0 0 0 -4,-1.8 4,-2.8 1,-0.2 -1,-0.2 0.917 111.4 50.7 -67.4 -41.7 9.0 15.8 58.2 270 89 B L H X S+ 0 0 5 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.860 105.3 54.4 -65.5 -37.7 9.2 16.2 61.9 271 90 B E H < S+ 0 0 108 -4,-2.2 4,-0.4 2,-0.2 -1,-0.2 0.927 113.1 45.0 -63.2 -41.1 7.0 13.2 62.6 272 91 B F H >< S+ 0 0 25 -4,-1.6 3,-1.5 -5,-0.2 4,-0.4 0.973 114.8 45.7 -64.3 -55.3 9.4 11.1 60.5 273 92 B L H >X S+ 0 0 0 -4,-2.8 4,-2.8 1,-0.3 3,-2.0 0.864 102.2 64.8 -57.1 -41.2 12.6 12.5 62.1 274 93 B K T 3< S+ 0 0 107 -4,-2.5 -1,-0.3 1,-0.3 -91,-0.2 0.669 98.6 56.7 -59.4 -16.2 11.4 12.2 65.7 275 94 B Q T <4 S+ 0 0 116 -3,-1.5 -1,-0.3 -4,-0.4 -2,-0.2 0.658 118.8 28.4 -90.1 -14.6 11.3 8.5 65.2 276 95 B W T <4 S+ 0 0 66 -3,-2.0 -92,-1.9 -4,-0.4 -89,-0.2 0.688 122.8 28.0-117.7 -25.3 15.0 8.2 64.2 277 96 B V S < S- 0 0 0 -4,-2.8 -1,-0.3 -94,-0.3 -92,-0.1 -0.988 70.3-125.4-143.7 132.7 16.9 11.1 65.8 278 97 B P >> - 0 0 43 0, 0.0 3,-1.1 0, 0.0 4,-0.5 -0.342 47.3 -83.6 -72.7 160.4 16.4 13.1 69.0 279 98 B A T 34 S+ 0 0 59 1,-0.2 28,-0.2 2,-0.1 27,-0.1 -0.218 105.8 11.4 -63.7 149.5 16.3 16.9 68.8 280 99 B G T 34 S+ 0 0 32 26,-2.0 -1,-0.2 25,-0.2 29,-0.2 0.544 102.1 96.8 62.7 10.4 19.4 19.1 68.7 281 100 B K T <4 + 0 0 90 -3,-1.1 -2,-0.1 25,-0.5 26,-0.1 0.868 68.1 62.2 -95.8 -44.4 21.7 16.1 68.1 282 101 B S S < S- 0 0 0 -4,-0.5 26,-3.0 24,-0.4 -2,-0.1 -0.693 70.9-139.0 -93.3 133.2 22.3 16.0 64.4 283 102 B P - 0 0 0 0, 0.0 -94,-0.6 0, 0.0 2,-0.5 -0.316 44.5 -87.8 -72.9 168.9 24.0 18.7 62.3 284 103 B I E -hk 189 311C 0 26,-1.8 28,-2.9 24,-0.3 2,-0.4 -0.700 52.7-157.6 -82.7 125.2 22.3 19.4 59.0 285 104 B C E +hk 190 312C 0 -96,-2.0 -94,-2.4 -2,-0.5 2,-0.3 -0.865 36.7 68.4-113.1 142.4 23.8 17.0 56.4 286 105 B G E S- k 0 313C 2 26,-1.7 28,-2.8 -2,-0.4 2,-0.6 -0.988 82.0 -41.3 159.3-154.9 24.0 17.2 52.6 287 106 B N S S- 0 0 35 -2,-0.3 26,-0.1 -96,-0.3 -2,-0.0 -0.946 116.8 -19.8-112.0 119.3 25.7 19.1 49.8 288 107 B S S >> S+ 0 0 10 -2,-0.6 3,-1.5 1,-0.1 4,-0.5 0.826 81.0 161.3 54.9 35.5 25.8 22.9 50.2 289 108 B I H 3> + 0 0 1 1,-0.3 4,-2.7 2,-0.2 5,-0.2 0.436 52.1 88.3 -67.9 3.4 23.0 22.6 52.7 290 109 B G H 3> S+ 0 0 1 1,-0.2 4,-1.4 2,-0.2 -1,-0.3 0.903 89.9 48.0 -65.8 -37.9 24.0 26.1 54.0 291 110 B Q H <> S+ 0 0 14 -3,-1.5 4,-0.9 2,-0.2 -1,-0.2 0.871 111.2 50.7 -68.7 -37.4 21.6 27.5 51.4 292 111 B D H >X S+ 0 0 12 -4,-0.5 4,-1.9 1,-0.2 3,-0.9 0.922 105.0 55.5 -67.6 -44.8 18.9 25.0 52.4 293 112 B R H 3X S+ 0 0 3 -4,-2.7 4,-2.7 1,-0.3 -1,-0.2 0.883 98.6 64.2 -57.3 -35.9 19.2 25.9 56.1 294 113 B R H 3X S+ 0 0 18 -4,-1.4 4,-1.0 1,-0.2 -1,-0.3 0.872 106.0 43.3 -55.2 -39.5 18.5 29.6 55.2 295 114 B F H S+ 0 0 0 -4,-0.9 4,-3.1 -3,-0.9 5,-0.5 0.870 110.7 54.5 -76.1 -33.7 15.1 28.7 54.0 296 115 B L H X5S+ 0 0 0 -4,-1.9 4,-1.7 1,-0.2 8,-0.4 0.896 102.9 57.9 -64.7 -39.4 14.4 26.4 56.9 297 116 B F H <5S+ 0 0 55 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.880 117.7 32.7 -56.8 -41.0 15.2 29.3 59.3 298 117 B K H <5S+ 0 0 83 -4,-1.0 -2,-0.2 -5,-0.2 -1,-0.2 0.863 133.7 21.8 -88.7 -37.6 12.5 31.4 57.7 299 118 B Y H <5S+ 0 0 38 -4,-3.1 -3,-0.2 1,-0.2 -2,-0.2 0.663 132.6 28.9-107.7 -17.7 9.8 29.0 56.7 300 119 B X X< + 0 0 0 -4,-1.7 4,-2.8 -5,-0.5 3,-0.2 -0.440 65.8 157.4-139.7 61.9 10.2 25.9 58.8 301 120 B P H > S+ 0 0 73 0, 0.0 4,-2.3 0, 0.0 5,-0.1 0.735 73.5 55.3 -60.0 -28.0 11.8 27.2 62.1 302 121 B E H > S+ 0 0 99 2,-0.2 4,-0.9 1,-0.2 -5,-0.1 0.916 111.7 43.7 -73.0 -42.2 10.7 24.2 64.2 303 122 B L H >> S+ 0 0 0 -3,-0.2 3,-1.1 2,-0.2 4,-0.6 0.951 112.8 53.4 -65.4 -47.1 12.4 21.8 61.8 304 123 B E H >< S+ 0 0 26 -4,-2.8 3,-1.4 -8,-0.4 -2,-0.2 0.921 107.8 50.3 -53.4 -46.7 15.4 24.1 61.7 305 124 B A H 3< S+ 0 0 66 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.718 96.1 71.8 -66.5 -18.5 15.7 24.1 65.5 306 125 B Y H << S+ 0 0 31 -3,-1.1 -26,-2.0 -4,-0.9 -25,-0.5 0.716 88.4 78.9 -69.0 -20.5 15.5 20.3 65.5 307 126 B F S << S- 0 0 7 -3,-1.4 -23,-0.1 -4,-0.6 -28,-0.1 -0.603 94.3-105.2 -88.6 151.9 19.0 20.2 64.1 308 127 B H - 0 0 33 -26,-3.0 -24,-0.3 -2,-0.2 -27,-0.1 -0.384 42.8-108.4 -63.8 154.6 22.2 20.7 66.1 309 128 B Y S S+ 0 0 144 -29,-0.2 -1,-0.1 -26,-0.1 -2,-0.1 0.710 91.4 92.8 -64.5 -17.1 23.4 24.2 65.2 310 129 B R - 0 0 41 -176,-0.1 -26,-1.8 1,-0.1 2,-0.4 -0.229 69.5-128.8 -78.2 164.6 26.4 22.8 63.2 311 130 B Y E -k 284 0C 12 -28,-0.2 2,-0.5 2,-0.1 -173,-0.2 -0.921 10.8-166.8-114.9 136.9 26.7 22.1 59.4 312 131 B L E +k 285 0C 1 -28,-2.9 -26,-1.7 -2,-0.4 2,-0.7 -0.733 21.4 173.4-120.7 78.2 27.9 18.8 57.8 313 132 B D E >> -k 286 0C 2 -2,-0.5 3,-1.9 -28,-0.2 4,-0.6 -0.806 23.2-161.0 -92.6 111.8 28.4 20.0 54.3 314 133 B V H >> S+ 0 0 1 -28,-2.8 4,-1.8 -2,-0.7 3,-0.8 0.795 88.8 69.8 -60.1 -29.6 30.0 17.2 52.2 315 134 B S H 3> S+ 0 0 4 -29,-0.4 4,-2.0 1,-0.3 -1,-0.3 0.662 87.8 65.0 -63.7 -17.5 31.0 19.9 49.6 316 135 B T H <> S+ 0 0 0 -3,-1.9 4,-1.7 2,-0.2 -1,-0.3 0.913 105.2 43.4 -70.9 -40.6 33.4 21.2 52.2 317 136 B L H < + 0 0 27 -4,-2.4 3,-1.3 -5,-0.4 4,-0.3 -0.297 63.4 165.5-158.5 61.6 44.4 15.4 46.9 326 145 B P G >> + 0 0 66 0, 0.0 3,-1.5 0, 0.0 4,-0.6 0.716 64.6 79.4 -55.3 -24.7 42.7 15.9 43.5 327 146 B E G >4 S+ 0 0 125 1,-0.3 3,-0.9 2,-0.2 4,-0.4 0.882 87.3 56.3 -53.1 -43.2 43.6 12.3 42.4 328 147 B I G X4 S+ 0 0 17 -3,-1.3 3,-0.7 1,-0.2 -1,-0.3 0.693 90.4 76.1 -64.9 -19.2 40.7 10.8 44.4 329 148 B L G X4 S+ 0 0 52 -3,-1.5 3,-1.6 -4,-0.3 -1,-0.2 0.884 87.0 58.2 -60.3 -40.9 38.2 13.0 42.6 330 149 B D G << S+ 0 0 140 -3,-0.9 -1,-0.2 -4,-0.6 -2,-0.2 0.786 94.7 67.0 -61.1 -28.5 38.2 11.0 39.4 331 150 B G G < S+ 0 0 54 -3,-0.7 2,-0.4 -4,-0.4 -1,-0.3 0.479 97.6 59.8 -74.1 -2.0 37.2 7.9 41.3 332 151 B F < + 0 0 49 -3,-1.6 2,-0.3 -4,-0.2 18,-0.0 -0.979 59.1 169.7-130.4 141.6 33.7 9.3 42.1 333 152 B T - 0 0 113 -2,-0.4 2,-0.4 13,-0.0 -3,-0.0 -0.998 21.0-142.7-150.3 147.7 30.9 10.5 39.9 334 153 B K - 0 0 56 -2,-0.3 185,-0.1 95,-0.3 9,-0.0 -0.917 8.9-147.0-114.3 139.5 27.2 11.5 40.2 335 154 B Q - 0 0 120 -2,-0.4 184,-1.5 183,-0.1 185,-0.2 0.879 35.0-131.9 -68.7 -42.5 24.5 10.7 37.6 336 155 B G + 0 0 6 182,-0.2 2,-0.3 183,-0.1 183,-0.2 0.484 34.5 172.9 88.1 122.1 22.4 13.8 38.1 337 156 B T - 0 0 34 181,-0.1 180,-0.2 2,-0.1 179,-0.1 -0.921 44.1-124.8-151.7 175.0 18.6 13.3 38.6 338 157 B H S S+ 0 0 58 178,-1.1 2,-0.7 -2,-0.3 179,-0.1 0.496 82.2 101.0-102.0 -10.1 15.4 15.1 39.4 339 158 B Q > - 0 0 88 177,-0.3 4,-1.5 1,-0.2 3,-0.4 -0.691 63.5-153.0 -81.6 115.2 14.6 12.7 42.2 340 159 B A H > S+ 0 0 2 -2,-0.7 4,-2.2 1,-0.2 3,-0.4 0.900 92.8 53.7 -52.9 -48.7 15.5 14.3 45.6 341 160 B X H > S+ 0 0 15 1,-0.3 4,-2.8 2,-0.2 -1,-0.2 0.866 105.6 54.2 -57.7 -38.5 16.1 11.1 47.4 342 161 B D H > S+ 0 0 63 -3,-0.4 4,-1.8 1,-0.2 -1,-0.3 0.867 107.3 51.6 -64.0 -36.7 18.6 10.0 44.7 343 162 B D H X S+ 0 0 46 -4,-1.5 4,-1.6 -3,-0.4 -2,-0.2 0.920 111.2 47.2 -66.0 -43.0 20.5 13.2 45.2 344 163 B I H X S+ 0 0 3 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.916 109.3 52.9 -67.0 -40.5 20.6 12.6 49.0 345 164 B R H X S+ 0 0 87 -4,-2.8 4,-2.6 1,-0.2 -1,-0.2 0.894 109.7 49.8 -61.4 -37.3 21.7 9.0 48.5 346 165 B E H X S+ 0 0 34 -4,-1.8 4,-2.6 2,-0.2 -1,-0.2 0.829 107.6 53.9 -70.0 -30.5 24.6 10.2 46.3 347 166 B S H X S+ 0 0 10 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.930 110.4 47.1 -66.6 -43.9 25.5 12.8 48.9 348 167 B V H X S+ 0 0 8 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.949 112.2 49.4 -60.3 -51.6 25.8 10.0 51.5 349 168 B A H X S+ 0 0 45 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.922 108.5 54.0 -54.4 -46.6 27.8 7.9 49.1 350 169 B E H X S+ 0 0 4 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.923 109.1 47.2 -55.3 -47.3 30.1 10.8 48.4 351 170 B L H X S+ 0 0 0 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.873 111.0 52.5 -62.6 -37.0 30.8 11.3 52.1 352 171 B A H X S+ 0 0 27 -4,-2.3 4,-1.4 2,-0.2 -1,-0.2 0.890 107.3 53.2 -65.0 -39.0 31.4 7.5 52.4 353 172 B Y H X S+ 0 0 39 -4,-2.6 4,-2.4 1,-0.2 5,-0.3 0.928 110.8 45.8 -60.5 -47.7 33.9 7.8 49.5 354 173 B Y H X>S+ 0 0 6 -4,-2.3 4,-2.8 1,-0.2 5,-0.7 0.862 106.5 58.7 -65.1 -37.0 35.8 10.5 51.3 355 174 B R H <5S+ 0 0 81 -4,-2.2 4,-0.3 3,-0.2 -1,-0.2 0.866 114.6 38.7 -61.5 -32.0 35.8 8.6 54.6 356 175 B E H <5S+ 0 0 131 -4,-1.4 -2,-0.2 -3,-0.3 -1,-0.2 0.830 131.2 23.9 -87.0 -35.9 37.6 5.8 52.8 357 176 B H H <5S+ 0 0 67 -4,-2.4 -3,-0.2 -5,-0.1 -2,-0.2 0.508 131.9 33.3-109.4 -7.0 40.0 7.7 50.6 358 177 B F T <5S+ 0 0 0 -4,-2.8 -179,-2.5 -5,-0.3 2,-0.3 0.422 105.3 68.5-129.6 -0.6 40.4 11.1 52.4 359 178 B I B - 0 0 70 92,-0.6 3,-2.9 3,-0.1 -1,-0.0 -0.787 26.0-134.8-165.6 116.6 17.1 11.4 3.3 366 4 C E T 3 S+ 0 0 119 1,-0.3 -1,-0.1 -2,-0.2 92,-0.0 0.670 106.7 46.0 -41.2 -28.7 14.8 14.5 2.6 367 5 C N T 3 S+ 0 0 59 2,-0.1 -1,-0.3 96,-0.1 91,-0.1 0.381 81.0 120.9-103.9 4.7 12.6 13.6 5.5 368 6 C N < - 0 0 5 -3,-2.9 2,-0.4 89,-0.2 27,-0.3 -0.393 57.0-131.7 -69.1 147.7 15.1 12.9 8.2 369 7 C L E -L 394 0D 1 25,-2.7 25,-2.5 94,-0.1 2,-0.6 -0.843 6.1-143.8-105.9 137.0 14.8 15.1 11.3 370 8 C I E -Lm 393 465D 0 94,-0.6 96,-1.7 -2,-0.4 2,-0.4 -0.874 16.2-166.9 -99.2 119.7 17.7 16.8 13.0 371 9 C W E +Lm 392 466D 0 21,-3.4 21,-2.4 -2,-0.6 2,-0.3 -0.899 11.4 178.6-107.2 136.4 17.5 16.9 16.8 372 10 C I E -L 391 0D 4 94,-2.2 2,-0.4 -2,-0.4 96,-0.2 -0.987 17.1-174.7-141.4 148.4 19.8 19.2 18.7 373 11 C D E -L 390 0D 37 17,-2.3 17,-1.6 -2,-0.3 2,-0.3 -0.976 11.9-168.1-142.9 127.9 20.5 20.3 22.3 374 12 C L E -L 389 0D 5 -2,-0.4 2,-0.4 15,-0.2 15,-0.2 -0.737 12.5-149.0-113.8 163.4 23.0 23.0 23.4 375 13 C E E -L 388 0D 53 13,-2.1 12,-3.2 -2,-0.3 13,-1.6 -0.987 22.2-177.0-128.8 136.9 24.5 24.1 26.7 376 14 C X E -L 386 0D 19 -2,-0.4 10,-0.2 10,-0.3 3,-0.1 -0.899 39.9-116.1-133.6 163.3 25.4 27.7 27.3 377 15 C T S S- 0 0 2 8,-2.0 43,-0.4 -2,-0.3 2,-0.3 0.621 95.0 -26.4 -73.2 -14.5 27.0 29.8 30.0 378 16 C G S S- 0 0 5 7,-0.3 -1,-0.1 41,-0.1 41,-0.1 -0.959 74.7 -82.9-178.9-176.6 23.7 31.7 30.4 379 17 C L S S+ 0 0 61 -2,-0.3 -2,-0.0 1,-0.1 -1,-0.0 0.452 95.2 85.0 -90.9 0.8 20.5 32.7 28.6 380 18 C D >> - 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0 0 42 0, 0.0 3,-1.3 0, 0.0 4,-0.5 -0.472 46.6 -84.6 -80.1 156.0 20.2 17.6 3.0 460 98 C A T 3 S+ 0 0 66 1,-0.2 28,-0.2 2,-0.1 27,-0.1 -0.287 107.2 10.2 -63.3 136.4 20.5 21.4 3.7 461 99 C G T 3 S+ 0 0 32 26,-2.7 -1,-0.2 2,-0.2 29,-0.2 0.556 102.9 99.3 74.8 9.6 17.4 23.4 4.4 462 100 C K < + 0 0 90 -3,-1.3 -2,-0.1 25,-0.4 26,-0.1 0.807 67.2 62.2 -95.1 -38.3 15.2 20.3 4.7 463 101 C S S S- 0 0 0 -4,-0.5 26,-3.5 24,-0.4 -2,-0.2 -0.772 70.6-136.8-102.4 135.6 14.9 19.7 8.4 464 102 C P - 0 0 0 0, 0.0 -94,-0.6 0, 0.0 2,-0.5 -0.371 43.2 -91.8 -73.9 163.6 13.3 22.0 11.0 465 103 C I E -mp 370 492D 0 26,-1.7 28,-2.8 24,-0.3 2,-0.4 -0.692 51.6-156.7 -79.0 126.2 15.3 22.4 14.3 466 104 C C E +mp 371 493D 0 -96,-1.7 -94,-2.2 -2,-0.5 2,-0.3 -0.912 37.9 67.7-114.8 137.9 13.9 19.7 16.6 467 105 C G E S- p 0 494D 2 26,-1.8 28,-2.5 -2,-0.4 2,-0.6 -0.985 83.2 -41.2 159.1-159.2 14.0 19.4 20.4 468 106 C N S S- 0 0 33 -2,-0.3 26,-0.1 -96,-0.2 -2,-0.0 -0.921 118.2 -18.0-106.0 121.8 12.5 21.1 23.6 469 107 C S S >> S+ 0 0 22 -2,-0.6 3,-1.2 1,-0.1 4,-0.6 0.889 80.3 165.8 51.4 44.3 12.3 24.9 23.5 470 108 C I H 3> + 0 0 0 -3,-0.3 4,-3.0 1,-0.3 5,-0.2 0.554 55.2 85.7 -68.3 -6.7 14.9 24.9 20.7 471 109 C G H 3> S+ 0 0 0 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.909 91.1 47.6 -59.2 -40.5 14.1 28.5 19.9 472 110 C Q H <> S+ 0 0 17 -3,-1.2 4,-1.1 2,-0.2 -1,-0.2 0.855 110.9 50.7 -68.7 -36.2 16.6 29.5 22.6 473 111 C D H X S+ 0 0 11 -4,-0.6 4,-1.7 1,-0.2 3,-0.4 0.923 107.1 55.4 -67.5 -42.3 19.2 27.1 21.1 474 112 C R H X S+ 0 0 6 -4,-3.0 4,-2.6 1,-0.2 -2,-0.2 0.871 99.8 59.6 -60.3 -36.9 18.6 28.6 17.7 475 113 C R H X S+ 0 0 33 -4,-1.6 4,-1.4 1,-0.2 -1,-0.2 0.895 106.9 46.3 -59.1 -41.6 19.4 32.1 18.9 476 114 C F H X>S+ 0 0 0 -4,-1.1 4,-3.1 -3,-0.4 5,-0.6 0.853 109.8 55.3 -70.2 -31.4 22.9 31.0 19.9 477 115 C L H X5S+ 0 0 0 -4,-1.7 4,-2.2 3,-0.2 8,-0.3 0.948 105.1 51.9 -65.2 -45.7 23.3 29.2 16.6 478 116 C F H <5S+ 0 0 52 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.871 118.4 38.5 -53.5 -42.8 22.5 32.5 14.7 479 117 C K H <5S+ 0 0 82 -4,-1.4 -2,-0.2 -5,-0.2 -1,-0.2 0.935 134.5 15.3 -77.5 -50.4 25.1 34.3 16.7 480 118 C Y H <5S+ 0 0 34 -4,-3.1 -3,-0.2 1,-0.2 -2,-0.2 0.697 134.4 31.2-103.8 -21.3 27.9 31.7 17.0 481 119 C X X< + 0 0 0 -4,-2.2 4,-2.5 -5,-0.6 -1,-0.2 -0.463 64.3 157.3-135.6 61.6 27.2 29.0 14.4 482 120 C P H > S+ 0 0 71 0, 0.0 4,-2.3 0, 0.0 -1,-0.1 0.769 74.5 53.4 -56.8 -32.5 25.5 30.8 11.5 483 121 C E H > S+ 0 0 95 2,-0.2 4,-0.7 1,-0.2 -5,-0.1 0.915 111.2 45.2 -72.0 -43.8 26.4 28.2 9.0 484 122 C L H >4 S+ 0 0 0 2,-0.2 3,-0.7 1,-0.2 4,-0.5 0.900 113.2 51.5 -65.3 -40.0 25.0 25.4 11.1 485 123 C E H >< S+ 0 0 25 -4,-2.5 3,-2.0 -8,-0.3 -2,-0.2 0.953 106.6 53.7 -59.9 -49.3 21.9 27.5 11.7 486 124 C A H 3< S+ 0 0 65 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.681 96.0 70.0 -59.5 -19.0 21.5 28.1 8.0 487 125 C Y T << S+ 0 0 33 -4,-0.7 -26,-2.7 -3,-0.7 -25,-0.4 0.695 87.1 80.0 -73.6 -20.8 21.5 24.3 7.5 488 126 C F S < S- 0 0 7 -3,-2.0 2,-0.1 -4,-0.5 -23,-0.1 -0.525 90.9-107.9 -85.9 156.0 18.1 23.9 9.1 489 127 C H - 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0 0 48 0, 0.0 3,-1.1 0, 0.0 4,-0.6 -0.314 45.3 -88.4 -70.1 158.2 -0.5 38.2 34.1 641 98 D A T 34 S+ 0 0 51 1,-0.2 28,-0.2 2,-0.1 27,-0.1 -0.442 109.1 13.6 -69.4 136.6 3.2 38.5 33.4 642 99 D G T 34 S+ 0 0 31 26,-2.4 -1,-0.2 2,-0.2 29,-0.2 0.688 102.9 97.4 73.6 20.2 5.1 35.2 32.8 643 100 D K T <4 + 0 0 34 -3,-1.1 -2,-0.1 25,-0.6 26,-0.1 0.807 68.1 59.1-105.2 -46.1 1.9 33.2 32.2 644 101 D S S < S- 0 0 0 -4,-0.6 26,-4.0 24,-0.4 -2,-0.2 -0.703 71.3-138.5 -94.4 137.4 1.4 33.0 28.5 645 102 D P - 0 0 0 0, 0.0 -94,-0.6 0, 0.0 2,-0.3 -0.448 43.5 -86.6 -80.7 165.3 3.9 31.5 26.0 646 103 D I E -sv 551 673F 0 26,-1.8 28,-3.2 24,-0.5 2,-0.4 -0.616 53.2-159.0 -75.4 131.0 4.4 33.4 22.8 647 104 D C E +sv 552 674F 0 -96,-1.7 -94,-2.0 -2,-0.3 2,-0.3 -0.913 37.4 67.2-118.4 143.6 1.7 32.2 20.3 648 105 D G E S- v 0 675F 3 26,-1.6 28,-2.4 -2,-0.4 2,-0.5 -0.972 84.3 -40.5 150.4-162.2 1.5 32.4 16.5 649 106 D N S S- 0 0 30 -2,-0.3 26,-0.1 1,-0.2 -2,-0.0 -0.883 118.1 -17.6-103.4 124.1 3.3 30.9 13.4 650 107 D S S >> S+ 0 0 22 -2,-0.5 3,-1.4 1,-0.1 4,-0.5 0.894 80.1 165.7 51.6 42.7 7.1 30.6 13.6 651 108 D I H 3> + 0 0 0 -3,-0.3 4,-3.0 1,-0.3 5,-0.2 0.616 55.4 85.4 -66.2 -10.3 7.0 33.1 16.4 652 109 D G H 3> S+ 0 0 0 1,-0.2 4,-1.4 2,-0.2 -1,-0.3 0.874 89.6 51.0 -57.8 -34.7 10.6 32.2 17.3 653 110 D Q H <> S+ 0 0 34 -3,-1.4 4,-1.0 2,-0.2 -1,-0.2 0.876 110.1 48.3 -70.8 -38.7 11.7 34.8 14.7 654 111 D D H >X S+ 0 0 11 -4,-0.5 4,-1.8 1,-0.2 3,-0.7 0.929 107.1 56.4 -65.9 -45.1 9.4 37.5 16.2 655 112 D R H 3X S+ 0 0 5 -4,-3.0 4,-2.8 1,-0.3 5,-0.2 0.867 98.4 61.7 -56.5 -36.8 10.8 36.7 19.7 656 113 D R H 3X S+ 0 0 30 -4,-1.4 4,-1.4 1,-0.2 -1,-0.3 0.908 106.5 45.3 -57.3 -41.2 14.3 37.4 18.5 657 114 D F H S+ 0 0 0 -4,-1.0 4,-3.3 -3,-0.7 5,-0.5 0.845 111.0 52.6 -71.9 -31.9 13.3 40.9 17.6 658 115 D L H X5S+ 0 0 0 -4,-1.8 4,-1.8 2,-0.2 8,-0.4 0.915 106.6 53.6 -67.9 -41.4 11.5 41.4 21.0 659 116 D F H <5S+ 0 0 51 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.875 119.0 36.3 -57.7 -39.8 14.6 40.2 22.8 660 117 D K H <5S+ 0 0 85 -4,-1.4 -2,-0.2 -5,-0.2 -1,-0.2 0.907 134.8 15.8 -82.6 -47.4 16.6 42.9 21.0 661 118 D Y H <5S+ 0 0 38 -4,-3.3 -3,-0.2 1,-0.2 -2,-0.2 0.629 133.9 30.9-107.9 -15.6 14.2 45.9 20.6 662 119 D X X< + 0 0 0 -4,-1.8 4,-2.5 -5,-0.5 3,-0.4 -0.388 63.1 158.2-140.0 58.6 11.4 45.3 23.1 663 120 D P H > S+ 0 0 72 0, 0.0 4,-2.0 0, 0.0 -1,-0.1 0.723 74.1 55.8 -56.8 -26.0 12.9 43.3 26.1 664 121 D E H 4 S+ 0 0 100 2,-0.2 4,-0.5 1,-0.2 -5,-0.1 0.906 111.2 43.2 -75.3 -41.3 10.2 44.3 28.5 665 122 D L H >4 S+ 0 0 0 -3,-0.4 3,-1.1 2,-0.2 4,-0.5 0.899 112.5 54.2 -68.6 -38.3 7.5 43.0 26.3 666 123 D E H >< S+ 0 0 22 -4,-2.5 3,-1.5 -8,-0.4 -2,-0.2 0.934 106.1 52.8 -59.4 -44.0 9.6 39.9 25.6 667 124 D A T 3< S+ 0 0 67 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.592 94.6 71.7 -67.7 -11.8 9.9 39.3 29.4 668 125 D Y T < S+ 0 0 29 -3,-1.1 -26,-2.4 -4,-0.5 -25,-0.6 0.688 86.8 80.1 -78.0 -18.8 6.1 39.5 29.7 669 126 D F S < S- 0 0 9 -3,-1.5 2,-0.2 -4,-0.5 -28,-0.1 -0.529 90.7-107.4 -88.3 156.7 5.8 36.1 28.1 670 127 D H - 0 0 27 -26,-4.0 -24,-0.5 -2,-0.2 -27,-0.1 -0.522 41.9-108.2 -72.8 150.0 6.3 32.7 29.7 671 128 D Y S S+ 0 0 23 -29,-0.2 -1,-0.1 -2,-0.2 -2,-0.1 0.739 90.6 98.9 -57.0 -20.9 9.6 31.3 28.3 672 129 D R - 0 0 11 1,-0.1 -26,-1.8 -176,-0.0 2,-0.4 -0.179 66.2-136.4 -71.6 161.4 7.7 28.7 26.2 673 130 D Y E -v 646 0F 6 -28,-0.2 2,-0.7 2,-0.1 -173,-0.2 -0.957 8.1-165.1-116.7 130.8 6.8 28.9 22.5 674 131 D L E +v 647 0F 0 -28,-3.2 -26,-1.6 -2,-0.4 2,-0.8 -0.746 20.1 179.5-115.3 80.4 3.4 27.9 21.2 675 132 D D E >> -v 648 0F 2 -2,-0.7 3,-1.8 -28,-0.2 4,-0.6 -0.754 19.6-166.4 -88.7 107.3 4.3 27.6 17.5 676 133 D V H >> S+ 0 0 0 -28,-2.4 4,-1.7 -2,-0.8 3,-1.0 0.834 89.4 64.4 -59.1 -33.7 1.2 26.6 15.4 677 134 D S H 3> S+ 0 0 3 -29,-0.4 4,-2.2 1,-0.3 -1,-0.3 0.670 89.4 67.5 -65.2 -16.9 3.6 25.8 12.5 678 135 D T H <> S+ 0 0 0 -3,-1.8 4,-1.5 2,-0.2 -1,-0.3 0.872 104.1 43.5 -69.7 -36.2 5.1 23.1 14.7 679 136 D L H < + 0 0 25 -4,-3.2 3,-1.4 -5,-0.3 4,-0.3 -0.330 61.0 166.3-156.8 62.7 -1.2 13.2 8.2 688 145 D P T >> + 0 0 61 0, 0.0 3,-1.3 0, 0.0 4,-0.5 0.685 65.5 79.9 -55.4 -22.7 -0.8 15.3 5.0 689 146 D E H >> S+ 0 0 129 1,-0.3 3,-0.7 2,-0.2 4,-0.5 0.867 88.5 54.6 -55.1 -40.2 -4.5 14.8 4.1 690 147 D I H <4 S+ 0 0 15 -3,-1.4 4,-0.3 1,-0.2 -1,-0.3 0.642 85.9 81.6 -72.9 -14.5 -5.5 17.6 6.5 691 148 D L H X4 S+ 0 0 53 -3,-1.3 3,-1.2 -4,-0.3 -1,-0.2 0.882 89.3 53.8 -58.1 -40.2 -3.3 20.3 5.1 692 149 D D H << S+ 0 0 137 -3,-0.7 -1,-0.2 -4,-0.5 -2,-0.2 0.911 91.2 72.3 -61.4 -46.3 -5.7 21.0 2.3 693 150 D G T 3< S+ 0 0 56 -4,-0.5 2,-0.5 1,-0.1 -1,-0.2 0.574 96.9 57.6 -48.5 -12.0 -8.7 21.7 4.6 694 151 D F < - 0 0 45 -3,-1.2 2,-0.4 -4,-0.3 -1,-0.1 -0.965 65.0-177.3-129.4 119.1 -7.1 24.9 5.6 695 152 D T - 0 0 107 -2,-0.5 2,-0.5 0, 0.0 -3,-0.0 -0.941 19.9-137.1-116.4 133.4 -6.2 27.7 3.2 696 153 D K - 0 0 74 -2,-0.4 9,-0.1 1,-0.1 -2,-0.0 -0.775 4.6-150.9 -92.9 127.5 -4.4 31.0 4.3 697 154 D Q - 0 0 141 -2,-0.5 -1,-0.1 7,-0.1 8,-0.1 0.948 17.3-150.7 -57.9 -56.9 -5.8 34.2 2.7 698 155 D G + 0 0 57 3,-0.1 2,-0.1 6,-0.1 -2,-0.0 0.927 29.5 167.6 82.2 48.6 -2.5 36.2 2.8 699 156 D T - 0 0 48 2,-0.2 -1,-0.1 1,-0.1 -88,-0.1 -0.269 48.7-112.6 -87.0 177.2 -3.9 39.7 3.1 700 157 D H S S+ 0 0 107 -90,-0.1 2,-0.6 -2,-0.1 -1,-0.1 0.548 87.6 102.1 -85.5 -9.7 -2.0 42.9 4.0 701 158 D Q >> - 0 0 114 1,-0.2 4,-1.0 2,-0.1 3,-0.5 -0.688 58.9-158.7 -83.8 115.4 -3.8 43.2 7.3 702 159 D A H >> S+ 0 0 4 -2,-0.6 4,-1.8 1,-0.2 3,-1.5 0.931 92.0 52.7 -55.5 -54.2 -1.7 42.0 10.3 703 160 D X H 3> S+ 0 0 17 1,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.777 104.5 59.3 -55.6 -27.1 -4.6 41.3 12.7 704 161 D D H <> S+ 0 0 58 -3,-0.5 4,-1.4 2,-0.2 -1,-0.3 0.810 103.4 50.6 -72.8 -29.8 -6.1 39.2 9.9 705 162 D D H X S+ 0 0 3 -4,-1.8 4,-2.5 2,-0.2 3,-0.7 0.980 111.1 49.0 -67.8 -55.1 -3.2 36.6 13.7 707 164 D R H 3X S+ 0 0 98 -4,-2.5 4,-2.2 1,-0.3 -1,-0.2 0.881 112.5 51.9 -50.6 -37.7 -6.9 35.8 13.8 708 165 D E H 3X S+ 0 0 19 -4,-1.4 4,-1.9 2,-0.2 -1,-0.3 0.845 105.5 53.2 -69.0 -34.7 -6.1 33.3 11.0 709 166 D S H S+ 0 0 5 -4,-2.3 4,-3.0 1,-0.2 5,-1.8 0.858 107.2 59.1 -64.1 -32.6 -5.5 21.3 14.0 717 174 D R H <5S+ 0 0 60 -4,-2.3 6,-0.3 3,-0.2 -1,-0.2 0.907 111.4 41.7 -61.1 -40.2 -7.1 20.8 17.4 718 175 D E H <5S+ 0 0 124 -4,-1.5 -2,-0.2 -3,-0.2 -1,-0.2 0.916 130.2 23.4 -74.3 -44.5 -10.1 19.3 15.6 719 176 D H H <5S+ 0 0 80 -4,-2.5 -2,-0.2 -5,-0.1 -3,-0.2 0.567 134.2 28.5-102.5 -9.6 -8.4 17.2 12.9 720 177 D F T <5S+ 0 0 0 -4,-3.0 -179,-2.3 -5,-0.3 2,-0.4 0.671 102.7 75.3-121.4 -28.2 -4.9 16.6 14.4 721 178 D I B < -Q 540 0E 2 -5,-1.8 2,-1.0 -181,-0.2 -181,-0.3 -0.715 64.8-146.7 -93.1 137.3 -5.3 16.6 18.2 722 179 D K 0 0 81 -183,-4.0 -182,-0.1 -2,-0.4 -4,-0.1 -0.656 360.0 360.0-102.2 76.5 -6.9 13.6 20.0 723 180 D L 0 0 124 -2,-1.0 -1,-0.2 -6,-0.3 -5,-0.1 0.940 360.0 360.0 -62.7 360.0 -8.6 15.3 22.9