==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-AUG-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 28-MAR-11 3RAM . COMPND 2 MOLECULE: HMRA PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: STAPHYLOCOCCUS AUREUS; . AUTHOR T.BOTELHO,T.GUEVARA,A.MARRERO,F.X.GOMIS-RUTH . 1561 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 57746.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1169 74.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 86 5.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 208 13.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.3 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 . 2 0.1 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 . 79 5.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 153 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 567 36.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 1.0 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 6 1 2 2 4 0 0 2 3 10 1 6 1 0 0 0 0 0 7 4 1 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 13 0 8 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 PARALLEL BRIDGES PER LADDER . 21 0 0 0 4 7 5 0 0 4 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 4 0 0 8 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 X > 0 0 219 0, 0.0 3,-0.9 0, 0.0 4,-0.2 0.000 360.0 360.0 360.0 -56.8 18.5 9.9 36.1 2 2 A G T 3> + 0 0 30 1,-0.2 4,-1.3 2,-0.1 3,-0.3 0.286 360.0 99.4 -77.0 10.2 16.4 11.9 38.6 3 3 A E H 3> S+ 0 0 61 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.817 81.5 54.8 -68.2 -32.1 17.6 15.5 37.7 4 4 A K H <> S+ 0 0 73 -3,-0.9 4,-1.7 1,-0.2 -1,-0.2 0.841 105.5 54.1 -63.4 -34.8 14.5 16.0 35.6 5 5 A Q H > S+ 0 0 113 -3,-0.3 4,-2.5 -4,-0.2 -2,-0.2 0.821 102.6 55.3 -75.6 -31.2 12.3 15.2 38.6 6 6 A Q H X S+ 0 0 77 -4,-1.3 4,-2.2 2,-0.2 -1,-0.2 0.862 107.8 50.0 -66.4 -38.5 14.0 17.8 40.9 7 7 A I H X S+ 0 0 0 -4,-1.2 4,-2.5 2,-0.2 -2,-0.2 0.959 115.3 42.1 -62.1 -53.3 13.2 20.6 38.4 8 8 A L H X S+ 0 0 31 -4,-1.7 4,-2.8 1,-0.2 5,-0.3 0.895 113.4 52.8 -63.7 -44.0 9.5 19.6 38.1 9 9 A D H X S+ 0 0 88 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.919 111.7 46.3 -58.8 -46.2 9.1 18.9 41.8 10 10 A Y H X S+ 0 0 30 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.974 115.1 45.3 -58.9 -55.9 10.5 22.4 42.6 11 11 A I H < S+ 0 0 0 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.917 120.4 39.8 -56.5 -46.7 8.4 24.2 40.0 12 12 A E H >< S+ 0 0 77 -4,-2.8 3,-0.8 -5,-0.2 4,-0.2 0.792 110.4 59.3 -74.8 -31.8 5.2 22.3 41.0 13 13 A T H 3< S+ 0 0 109 -4,-2.4 3,-0.2 -5,-0.3 -2,-0.2 0.952 123.0 19.6 -62.6 -52.9 5.8 22.4 44.8 14 14 A N T 3X S+ 0 0 56 -4,-2.0 4,-0.6 -5,-0.2 -1,-0.2 -0.409 84.6 125.5-119.1 56.9 5.9 26.2 45.1 15 15 A K H X> + 0 0 45 -3,-0.8 4,-1.9 2,-0.2 3,-0.9 0.884 67.6 59.9 -75.4 -43.6 4.1 27.2 41.9 16 16 A Y H 3> S+ 0 0 167 1,-0.3 4,-1.7 -4,-0.2 -1,-0.2 0.757 96.8 62.5 -62.7 -27.5 1.5 29.4 43.6 17 17 A S H 3> S+ 0 0 41 2,-0.2 4,-1.0 1,-0.2 -1,-0.3 0.904 108.9 41.6 -57.6 -43.9 4.3 31.6 45.0 18 18 A Y H - 0 0 69 -2,-0.4 3,-2.1 53,-0.2 4,-0.2 -0.171 51.4 -58.8 -80.2 173.1 5.6 51.3 30.9 32 32 A G T 3 S+ 0 0 24 53,-0.3 -1,-0.2 1,-0.3 100,-0.1 -0.232 123.8 6.9 -59.5 138.5 9.0 50.7 29.2 33 33 A N T 3 S+ 0 0 46 -3,-0.1 -1,-0.3 1,-0.1 28,-0.1 0.446 119.5 77.8 63.6 9.1 12.1 51.8 31.2 34 34 A E < + 0 0 118 -3,-2.1 2,-2.1 28,-0.1 3,-0.3 0.164 52.2 121.5-124.0 14.4 9.8 52.6 34.2 35 35 A E > + 0 0 0 1,-0.2 4,-1.8 -5,-0.2 5,-0.2 -0.410 23.1 144.2 -87.4 69.5 9.3 49.0 35.4 36 36 A I H > S+ 0 0 97 -2,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.945 72.2 42.6 -72.1 -52.0 10.6 49.6 39.0 37 37 A F H > S+ 0 0 53 -3,-0.3 4,-2.4 2,-0.2 5,-0.2 0.925 116.4 48.4 -61.3 -47.1 8.2 47.3 40.8 38 38 A A H > S+ 0 0 0 2,-0.2 4,-2.2 -10,-0.2 5,-0.2 0.947 113.2 44.6 -61.8 -52.8 8.4 44.5 38.2 39 39 A S H X S+ 0 0 9 -4,-1.8 4,-3.0 1,-0.2 5,-0.2 0.950 116.3 47.5 -57.6 -51.2 12.2 44.4 37.9 40 40 A R H X S+ 0 0 153 -4,-2.0 4,-2.6 -5,-0.2 -1,-0.2 0.854 110.6 50.6 -58.2 -43.7 12.7 44.5 41.7 41 41 A T H X S+ 0 0 28 -4,-2.4 4,-1.4 2,-0.2 -1,-0.2 0.903 116.2 42.3 -61.4 -44.1 10.1 41.8 42.5 42 42 A L H X S+ 0 0 0 -4,-2.2 4,-1.7 -5,-0.2 -2,-0.2 0.874 114.3 51.6 -70.3 -39.1 11.8 39.5 39.9 43 43 A I H X S+ 0 0 17 -4,-3.0 4,-2.5 -5,-0.2 -2,-0.2 0.879 107.5 52.7 -65.6 -39.4 15.3 40.5 41.1 44 44 A D H X S+ 0 0 82 -4,-2.6 4,-1.7 2,-0.2 -1,-0.2 0.903 108.3 50.5 -63.4 -40.6 14.4 39.7 44.8 45 45 A R H X S+ 0 0 38 -4,-1.4 4,-0.6 2,-0.2 -1,-0.2 0.880 112.9 45.6 -68.1 -37.6 13.1 36.2 43.8 46 46 A L H ><>S+ 0 0 0 -4,-1.7 5,-2.0 2,-0.2 3,-1.0 0.917 112.6 51.1 -65.5 -43.3 16.4 35.5 41.9 47 47 A K H ><5S+ 0 0 115 -4,-2.5 3,-1.1 1,-0.3 -2,-0.2 0.785 103.6 59.1 -65.6 -29.5 18.5 36.9 44.8 48 48 A E H 3<5S+ 0 0 117 -4,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.727 106.1 49.6 -70.5 -23.8 16.5 34.6 47.2 49 49 A H T <<5S- 0 0 28 -3,-1.0 -1,-0.2 -4,-0.6 -2,-0.2 -0.101 125.2 -99.8-109.5 33.5 17.8 31.6 45.2 50 50 A D T < 5 + 0 0 116 -3,-1.1 2,-0.2 1,-0.2 -3,-0.2 0.616 66.9 154.8 64.2 22.8 21.5 32.7 45.3 51 51 A F < - 0 0 8 -5,-2.0 2,-0.5 -8,-0.1 17,-0.2 -0.579 46.2-122.5 -75.0 140.0 21.8 34.3 41.8 52 52 A E E -A 67 0A 155 15,-2.9 15,-2.8 -2,-0.2 2,-0.4 -0.757 33.9-147.1 -83.3 125.8 24.5 37.0 41.3 53 53 A I E -A 66 0A 45 -2,-0.5 2,-0.4 13,-0.2 13,-0.2 -0.807 21.7-176.0-108.7 134.1 22.7 40.2 40.2 54 54 A E E -A 65 0A 102 11,-2.2 11,-2.7 -2,-0.4 2,-0.3 -0.999 17.3-162.0-119.4 129.8 23.9 43.0 37.9 55 55 A T E +A 64 0A 83 -2,-0.4 9,-0.3 9,-0.2 7,-0.1 -0.787 55.6 34.7-113.0 155.4 21.6 46.0 37.4 56 56 A E E S- 0 0 122 7,-2.7 2,-0.5 5,-0.5 3,-0.3 0.999 70.6-165.9 70.6 79.0 21.4 48.7 34.9 57 57 A I E > -A 60 0A 5 3,-1.3 3,-1.4 1,-0.2 -1,-0.2 -0.830 57.5 -17.3-108.3 122.2 22.4 47.1 31.6 58 58 A A T 3 S- 0 0 41 -2,-0.5 -1,-0.2 1,-0.3 3,-0.1 0.815 131.0 -44.3 62.1 34.7 23.3 48.9 28.4 59 59 A G T 3 S+ 0 0 55 -3,-0.3 2,-0.7 1,-0.2 -1,-0.3 0.545 111.7 120.2 86.0 7.7 21.7 52.2 29.5 60 60 A H E X -A 57 0A 0 -3,-1.4 3,-1.8 1,-0.2 -3,-1.3 -0.891 44.5-167.4-108.6 103.0 18.5 50.6 30.9 61 61 A A E 3 S+ 0 0 62 -2,-0.7 -5,-0.5 1,-0.3 -1,-0.2 0.850 89.3 48.7 -51.4 -41.1 18.1 51.3 34.6 62 62 A T E 3 S+ 0 0 7 -7,-0.1 -1,-0.3 -6,-0.1 2,-0.2 0.249 94.7 97.0 -92.6 11.7 15.4 48.7 35.0 63 63 A G E < + 0 0 1 -3,-1.8 -7,-2.7 62,-0.1 2,-0.3 -0.623 49.4 172.1 -93.4 160.0 17.4 46.0 33.2 64 64 A F E -AB 55 124A 0 60,-1.0 60,-2.5 -9,-0.3 2,-0.4 -0.975 29.9-137.6-156.4 164.3 19.5 43.4 34.9 65 65 A I E -AB 54 123A 2 -11,-2.7 -11,-2.2 -2,-0.3 2,-0.6 -0.987 18.2-168.2-125.6 121.6 21.6 40.2 34.5 66 66 A A E -AB 53 122A 0 56,-3.0 56,-2.8 -2,-0.4 2,-0.4 -0.947 12.4-173.1-112.6 114.0 21.1 37.5 37.1 67 67 A T E -AB 52 121A 24 -15,-2.8 -15,-2.9 -2,-0.6 2,-0.5 -0.926 19.6-175.5-116.0 129.1 23.7 34.7 36.8 68 68 A Y E - B 0 120A 42 52,-3.1 52,-2.7 -2,-0.4 2,-0.4 -0.931 16.4-173.4-117.1 107.0 24.1 31.4 38.7 69 69 A D E - B 0 119A 81 -2,-0.5 50,-0.2 50,-0.2 45,-0.1 -0.836 21.7-159.6-100.8 131.8 27.3 29.6 37.7 70 70 A S - 0 0 23 48,-1.9 49,-0.1 -2,-0.4 -1,-0.1 0.731 39.7-123.7 -74.4 -25.2 28.1 26.1 38.8 71 71 A G S S+ 0 0 63 47,-0.4 2,-0.3 1,-0.4 48,-0.1 0.575 78.6 106.3 85.7 13.5 31.9 26.7 38.2 72 72 A L S S- 0 0 100 46,-0.5 46,-1.2 1,-0.1 -1,-0.4 -0.891 80.2 -85.8-123.7 153.8 31.9 23.7 35.9 73 73 A D S S+ 0 0 164 -2,-0.3 45,-0.1 44,-0.2 -1,-0.1 -0.211 73.1 94.8 -58.2 141.4 32.1 23.4 32.1 74 74 A G S S- 0 0 42 43,-0.2 44,-0.2 44,-0.1 299,-0.1 -0.822 71.6 -51.5 156.2 170.9 28.9 23.6 30.1 75 75 A P - 0 0 13 0, 0.0 44,-2.0 0, 0.0 2,-0.6 -0.208 42.3-127.6 -63.2 155.8 26.5 25.9 28.2 76 76 A A E -c 119 0A 4 42,-0.2 74,-2.9 -7,-0.0 75,-1.2 -0.953 25.3-155.5 -98.0 116.0 25.2 29.1 29.6 77 77 A I E -cd 120 151A 0 42,-2.7 44,-2.2 -2,-0.6 2,-0.3 -0.860 8.7-153.9 -99.8 116.6 21.4 28.9 29.2 78 78 A G E -cd 121 152A 0 73,-3.0 75,-2.9 -2,-0.7 2,-0.5 -0.698 8.0-160.8 -93.5 141.1 19.8 32.3 29.0 79 79 A F E -cd 122 153A 0 42,-3.1 44,-2.7 -2,-0.3 2,-0.5 -0.988 15.2-140.6-120.4 122.5 16.2 33.1 30.0 80 80 A L E -c 123 0A 0 73,-3.0 2,-0.5 -2,-0.5 75,-0.3 -0.721 15.1-161.8 -86.6 122.5 14.7 36.3 28.7 81 81 A A E -c 124 0A 0 42,-2.6 44,-3.1 -2,-0.5 2,-0.3 -0.928 8.3-176.7-108.4 122.9 12.5 38.2 31.2 82 82 A E + 0 0 0 -2,-0.5 17,-1.5 13,-0.2 18,-0.2 -0.892 14.0 159.4-114.5 149.7 10.0 40.8 29.9 83 83 A Y + 0 0 0 42,-0.5 -53,-0.3 -2,-0.3 2,-0.3 0.211 26.8 122.5-162.1 25.6 7.8 43.0 32.2 84 84 A D - 0 0 3 41,-0.2 11,-0.3 -55,-0.1 -53,-0.2 -0.777 43.2-147.4 -99.3 141.1 6.6 46.2 30.6 85 85 A A - 0 0 5 -55,-3.4 -53,-0.3 -2,-0.3 44,-0.1 -0.268 19.0-107.6 -91.2-179.4 2.9 47.1 30.2 86 86 A L >> - 0 0 20 -55,-0.1 4,-2.5 -2,-0.1 3,-0.8 -0.853 38.7 -96.5-108.5 147.6 1.0 49.1 27.5 87 87 A P T 34 S- 0 0 93 0, 0.0 -57,-0.0 0, 0.0 -1,-0.0 -0.439 105.0 -5.1 -61.2 133.2 -0.4 52.7 27.8 88 88 A G T 34 S+ 0 0 85 1,-0.2 0, 0.0 -2,-0.1 0, 0.0 0.302 132.7 64.7 69.0 -11.2 -4.1 52.7 28.7 89 89 A L T <4 S- 0 0 45 -3,-0.8 -1,-0.2 257,-0.0 257,-0.1 0.692 83.2-153.4-115.6 -35.1 -4.2 48.9 28.3 90 90 A G S < S- 0 0 12 -4,-2.5 -5,-0.1 1,-0.2 -59,-0.0 0.908 72.3 -11.2 65.5 63.2 -2.0 47.6 31.2 91 91 A H S > S+ 0 0 2 -61,-0.0 3,-0.9 -7,-0.0 258,-0.2 0.793 77.7 147.4 82.9 37.1 -0.5 44.2 30.3 92 92 A A T 3 S+ 0 0 0 1,-0.2 249,-2.6 2,-0.1 250,-0.7 0.253 75.2 54.4 -79.2 6.4 -2.6 43.4 27.3 93 93 A C T 3 S- 0 0 12 247,-0.2 -1,-0.2 248,-0.2 247,-0.1 0.299 112.5-120.9-113.8 0.8 0.4 41.5 25.9 94 94 A G X> + 0 0 0 -3,-0.9 3,-1.1 1,-0.1 4,-0.9 0.791 57.3 152.1 70.1 33.6 0.8 39.3 29.0 95 95 A H H 3> + 0 0 0 -11,-0.3 4,-1.7 1,-0.3 5,-0.3 0.668 63.2 71.8 -73.7 -17.8 4.3 40.4 30.0 96 96 A N H 3> S+ 0 0 0 1,-0.2 4,-1.2 2,-0.2 -1,-0.3 0.867 102.0 46.8 -54.9 -37.7 3.6 39.7 33.7 97 97 A I H <> S+ 0 0 0 -3,-1.1 4,-2.9 2,-0.2 5,-0.2 0.859 107.2 55.9 -73.3 -38.9 3.7 36.0 32.6 98 98 A I H X S+ 0 0 0 -4,-0.9 4,-2.5 2,-0.2 5,-0.2 0.968 110.2 42.0 -65.2 -55.5 6.9 36.2 30.5 99 99 A G H X S+ 0 0 0 -4,-1.7 4,-1.8 -17,-1.5 -1,-0.2 0.875 118.8 45.4 -59.0 -42.5 9.2 37.6 33.2 100 100 A T H X S+ 0 0 0 -4,-1.2 4,-2.8 -5,-0.3 5,-0.2 0.912 111.5 51.9 -68.9 -43.1 7.8 35.3 35.9 101 101 A A H X S+ 0 0 0 -4,-2.9 4,-2.5 1,-0.2 -2,-0.2 0.939 112.4 46.1 -59.2 -46.5 7.9 32.2 33.7 102 102 A S H X S+ 0 0 0 -4,-2.5 4,-2.5 -5,-0.2 -1,-0.2 0.871 112.7 49.9 -65.0 -39.7 11.6 32.8 32.8 103 103 A V H X S+ 0 0 0 -4,-1.8 4,-2.6 -5,-0.2 -2,-0.2 0.952 114.5 44.2 -62.3 -49.8 12.5 33.5 36.4 104 104 A L H X S+ 0 0 0 -4,-2.8 4,-1.8 2,-0.2 -2,-0.2 0.822 113.7 51.0 -64.7 -37.9 10.8 30.2 37.6 105 105 A G H X S+ 0 0 0 -4,-2.5 4,-2.7 -5,-0.2 5,-0.3 0.953 112.0 46.6 -61.2 -51.7 12.3 28.3 34.7 106 106 A A H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.897 114.5 46.9 -57.3 -44.8 15.8 29.6 35.5 107 107 A I H X S+ 0 0 0 -4,-2.6 4,-0.9 2,-0.2 -1,-0.2 0.808 110.6 53.5 -71.3 -29.9 15.3 28.8 39.2 108 108 A G H >< S+ 0 0 0 -4,-1.8 3,-0.9 2,-0.2 4,-0.5 0.970 114.2 40.5 -63.9 -54.4 14.0 25.3 38.4 109 109 A L H >X S+ 0 0 0 -4,-2.7 4,-1.3 1,-0.2 3,-1.2 0.851 106.6 66.2 -61.4 -36.9 17.1 24.5 36.3 110 110 A K H 3< S+ 0 0 26 -4,-2.6 4,-0.5 -5,-0.3 -1,-0.2 0.809 90.3 66.3 -52.7 -33.4 19.2 26.3 39.0 111 111 A Q T << S+ 0 0 60 -4,-0.9 -1,-0.2 -3,-0.9 -2,-0.2 0.847 114.3 27.4 -56.0 -36.4 18.2 23.4 41.4 112 112 A V T X> S+ 0 0 0 -3,-1.2 3,-2.3 -4,-0.5 4,-1.6 0.560 93.8 97.6-104.9 -12.0 20.1 20.9 39.3 113 113 A I H 3X S+ 0 0 0 -4,-1.3 4,-1.4 1,-0.3 -43,-0.1 0.721 78.5 58.4 -60.7 -28.9 22.8 23.1 37.8 114 114 A D H 34 S+ 0 0 81 -4,-0.5 -1,-0.3 1,-0.2 -2,-0.1 0.695 111.8 43.6 -70.7 -20.2 25.5 22.2 40.4 115 115 A Q H <4 S+ 0 0 103 -3,-2.3 -2,-0.2 2,-0.1 -1,-0.2 0.843 121.4 35.3 -88.6 -42.0 25.1 18.5 39.3 116 116 A I H < S- 0 0 34 -4,-1.6 -2,-0.2 1,-0.2 -3,-0.2 0.535 102.7-135.0 -95.4 -10.5 24.9 18.9 35.5 117 117 A G < + 0 0 3 -4,-1.4 -1,-0.2 -5,-0.3 -43,-0.2 -0.139 58.4 83.8 80.8-179.0 27.4 21.8 35.1 118 118 A G S S- 0 0 0 -46,-1.2 -48,-1.9 -44,-0.2 -46,-0.5 -0.506 73.7 -78.3 79.6-150.2 27.2 24.9 33.0 119 119 A K E -Bc 69 76A 63 -44,-2.0 -42,-2.7 -50,-0.2 2,-0.4 -0.998 20.0-140.6-159.1 140.0 25.4 28.1 34.0 120 120 A V E -Bc 68 77A 0 -52,-2.7 -52,-3.1 -2,-0.3 2,-0.4 -0.925 22.2-176.5-111.1 136.7 21.9 29.7 34.3 121 121 A V E -Bc 67 78A 1 -44,-2.2 -42,-3.1 -2,-0.4 2,-0.5 -0.982 14.4-163.3-137.0 122.2 21.3 33.3 33.3 122 122 A V E -Bc 66 79A 0 -56,-2.8 -56,-3.0 -2,-0.4 2,-0.6 -0.928 12.6-158.1 -99.7 125.2 18.1 35.5 33.5 123 123 A L E -Bc 65 80A 0 -44,-2.7 -42,-2.6 -2,-0.5 2,-0.6 -0.922 9.8-144.1-103.9 109.9 18.4 38.6 31.4 124 124 A G E -Bc 64 81A 0 -60,-2.5 -60,-1.0 -2,-0.6 -67,-0.2 -0.659 22.0-173.3 -74.6 114.7 16.0 41.4 32.5 125 125 A C - 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0 0 10 -3,-1.7 2,-0.4 -179,-0.1 -179,-0.2 -0.466 46.2-163.4 -61.9 131.7 8.0 102.4 19.6 730 339 B V > - 0 0 93 -2,-0.2 3,-0.7 -181,-0.1 6,-0.3 -0.988 21.8-110.6-122.0 129.6 6.5 99.3 18.1 731 340 B G T 3 S+ 0 0 39 -2,-0.4 -247,-0.2 1,-0.2 3,-0.1 -0.162 97.8 24.2 -55.9 149.7 3.3 97.7 19.4 732 341 B H T 3 S+ 0 0 78 -249,-2.5 2,-0.3 1,-0.2 -1,-0.2 0.783 97.0 119.5 63.7 33.2 3.6 94.3 21.1 733 342 B T S <> S- 0 0 45 -250,-0.7 4,-1.3 -3,-0.7 -1,-0.2 -0.758 76.2-114.2-118.8 167.1 7.2 94.7 22.1 734 343 B H H > S+ 0 0 111 -2,-0.3 4,-2.1 1,-0.2 5,-0.2 0.874 118.0 55.2 -65.3 -39.9 9.0 94.8 25.5 735 344 B R H > S+ 0 0 120 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.749 105.6 54.0 -67.1 -23.0 9.9 98.5 24.9 736 345 B F H > S+ 0 0 6 -6,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.835 106.4 49.7 -79.5 -37.3 6.2 99.3 24.4 737 346 B R H X S+ 0 0 55 -4,-1.3 4,-0.8 2,-0.2 -2,-0.2 0.936 111.9 49.2 -61.3 -48.5 5.2 97.7 27.8 738 347 B E H >< S+ 0 0 126 -4,-2.1 3,-0.9 1,-0.2 -2,-0.2 0.907 109.8 52.9 -56.4 -42.7 7.9 99.7 29.5 739 348 B A H >< S+ 0 0 11 -4,-1.5 3,-1.5 1,-0.2 6,-0.6 0.892 101.2 58.7 -62.8 -40.3 6.5 102.8 27.7 740 349 B A H 3< S+ 0 0 0 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.692 108.5 46.7 -64.5 -19.9 2.9 102.2 28.9 741 350 B A T << S+ 0 0 37 -3,-0.9 -1,-0.3 -4,-0.8 2,-0.2 -0.152 97.9 98.9-112.0 36.8 4.2 102.4 32.6 742 351 B S S <> S- 0 0 38 -3,-1.5 4,-2.3 -18,-0.1 5,-0.1 -0.638 88.6-102.0-115.4 173.6 6.3 105.6 32.0 743 352 B V H > S+ 0 0 106 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.861 123.4 52.1 -68.0 -37.0 5.7 109.3 32.8 744 353 B H H > S+ 0 0 62 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.899 110.8 48.6 -61.4 -42.9 4.9 109.9 29.1 745 354 B G H > S+ 0 0 0 -6,-0.6 4,-1.9 -21,-0.3 -2,-0.2 0.891 110.4 50.9 -65.1 -41.5 2.3 107.0 29.2 746 355 B D H X S+ 0 0 21 -4,-2.3 4,-1.6 2,-0.2 -2,-0.2 0.893 110.2 50.0 -60.1 -44.2 0.8 108.5 32.3 747 356 B E H X S+ 0 0 98 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.878 108.3 52.6 -62.4 -39.8 0.6 111.9 30.6 748 357 B A H X S+ 0 0 1 -4,-2.1 4,-3.3 2,-0.2 5,-0.2 0.892 104.8 56.2 -64.7 -40.4 -1.2 110.4 27.6 749 358 B L H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.948 113.1 40.3 -51.5 -52.6 -3.7 108.7 29.9 750 359 B I H X S+ 0 0 7 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.869 115.9 49.7 -70.3 -38.6 -4.7 112.1 31.3 751 360 B K H X S+ 0 0 42 -4,-2.6 4,-2.9 2,-0.2 -1,-0.2 0.913 112.2 49.6 -65.4 -41.8 -4.5 113.9 28.0 752 361 B G H X S+ 0 0 0 -4,-3.3 4,-2.4 2,-0.2 5,-0.2 0.889 109.7 50.3 -61.0 -43.1 -6.7 111.2 26.5 753 362 B A H X S+ 0 0 0 -4,-2.2 4,-2.3 -5,-0.2 -2,-0.2 0.910 113.1 46.6 -63.2 -44.4 -9.2 111.5 29.3 754 363 B K H X S+ 0 0 39 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.950 111.8 50.6 -59.8 -51.6 -9.4 115.3 28.8 755 364 B I H X S+ 0 0 0 -4,-2.9 4,-1.7 1,-0.2 -2,-0.2 0.936 115.4 41.7 -54.6 -50.9 -9.7 115.0 25.0 756 365 B X H X S+ 0 0 0 -4,-2.4 4,-2.7 1,-0.2 -1,-0.2 0.914 112.6 52.6 -67.0 -44.3 -12.6 112.5 25.2 757 366 B A H X S+ 0 0 0 -4,-2.3 4,-1.5 -5,-0.2 -1,-0.2 0.878 112.6 46.6 -58.1 -38.0 -14.4 114.3 28.1 758 367 B L H X S+ 0 0 3 -4,-2.3 4,-1.8 2,-0.2 -1,-0.2 0.761 109.4 52.6 -79.3 -28.3 -14.3 117.5 26.0 759 368 B X H X S+ 0 0 0 -4,-1.7 4,-2.6 -5,-0.2 5,-0.2 0.929 109.0 51.1 -67.6 -47.9 -15.5 115.8 22.8 760 369 B G H X S+ 0 0 0 -4,-2.7 4,-1.9 1,-0.2 5,-0.3 0.876 107.7 54.1 -52.4 -41.3 -18.4 114.5 24.8 761 370 B L H X S+ 0 0 16 -4,-1.5 4,-2.5 -5,-0.2 5,-0.3 0.936 111.9 43.3 -58.2 -47.7 -19.0 118.0 26.1 762 371 B E H X S+ 0 0 29 -4,-1.8 4,-2.0 1,-0.2 8,-0.3 0.831 111.5 53.0 -73.2 -31.7 -19.2 119.3 22.5 763 372 B L H < S+ 0 0 1 -4,-2.6 -1,-0.2 2,-0.2 -2,-0.2 0.860 118.3 36.0 -71.1 -34.8 -21.4 116.5 21.1 764 373 B I H < S+ 0 0 13 -4,-1.9 -2,-0.2 -5,-0.2 -3,-0.1 0.887 122.5 44.5 -82.3 -43.5 -24.1 116.9 23.8 765 374 B T H < S+ 0 0 67 -4,-2.5 2,-0.4 -5,-0.3 -3,-0.2 0.928 112.4 54.2 -62.4 -53.9 -23.8 120.7 24.0 766 375 B N < - 0 0 57 -4,-2.0 4,-0.5 -5,-0.3 -1,-0.1 -0.739 56.1-178.9 -89.8 130.3 -23.7 121.3 20.3 767 376 B Q S > S+ 0 0 150 -2,-0.4 4,-2.2 2,-0.1 -1,-0.1 0.708 84.7 53.2 -98.5 -29.0 -26.6 119.8 18.1 768 377 B D H > S+ 0 0 121 2,-0.2 4,-1.9 3,-0.2 5,-0.1 0.865 112.5 44.0 -71.1 -40.0 -25.2 121.1 14.8 769 378 B V H > S+ 0 0 37 -7,-0.2 4,-1.4 2,-0.2 -2,-0.1 0.870 116.6 47.7 -73.1 -37.9 -21.8 119.5 15.4 770 379 B Y H > S+ 0 0 31 -4,-0.5 4,-2.4 -8,-0.3 -2,-0.2 0.922 112.6 48.1 -62.9 -47.5 -23.4 116.4 16.6 771 380 B Q H X S+ 0 0 83 -4,-2.2 4,-2.6 1,-0.2 5,-0.3 0.865 106.6 57.2 -66.3 -35.8 -25.9 116.2 13.7 772 381 B D H X S+ 0 0 77 -4,-1.9 4,-1.7 2,-0.2 -1,-0.2 0.908 111.6 43.5 -56.0 -43.9 -23.0 116.8 11.2 773 382 B I H X S+ 0 0 1 -4,-1.4 4,-2.7 2,-0.2 -2,-0.2 0.949 114.4 47.3 -68.6 -52.9 -21.3 113.7 12.6 774 383 B I H X S+ 0 0 47 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.886 116.3 44.8 -55.1 -45.2 -24.4 111.4 12.8 775 384 B E H X S+ 0 0 131 -4,-2.6 4,-1.1 -5,-0.2 -1,-0.2 0.849 112.9 51.9 -71.3 -35.2 -25.4 112.4 9.2 776 385 B E H X S+ 0 0 45 -4,-1.7 4,-1.7 -5,-0.3 3,-0.3 0.951 112.2 45.3 -61.7 -51.4 -21.9 111.9 7.9 777 386 B H H X S+ 0 0 4 -4,-2.7 4,-1.6 1,-0.2 3,-0.2 0.913 110.8 51.4 -60.4 -49.0 -21.5 108.5 9.5 778 387 B A H < S+ 0 0 50 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.760 111.7 49.8 -62.2 -26.8 -24.9 107.2 8.3 779 388 B H H < S+ 0 0 169 -4,-1.1 -1,-0.2 -3,-0.3 -2,-0.2 0.806 109.8 50.1 -77.3 -34.7 -24.0 108.4 4.7 780 389 B L H < 0 0 94 -4,-1.7 -2,-0.2 -3,-0.2 -1,-0.2 0.704 360.0 360.0 -78.7 -22.0 -20.6 106.6 4.8 781 390 B K < 0 0 130 -4,-1.6 -68,-0.1 -5,-0.2 -67,-0.0 -0.329 360.0 360.0-102.9 360.0 -22.2 103.3 6.0 782 !* 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 0.0 783 1 C X 0 0 243 0, 0.0 2,-0.4 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 30.6 23.0 127.7 -40.4 784 2 C G >> + 0 0 40 1,-0.1 3,-0.6 2,-0.0 4,-0.6 -0.849 360.0 170.7-139.6 96.2 20.5 124.8 -39.5 785 3 C E H 3> S+ 0 0 73 -2,-0.4 4,-1.3 1,-0.2 3,-0.1 0.678 82.7 72.4 -72.6 -21.1 21.4 121.1 -39.9 786 4 C K H 3> S+ 0 0 69 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.878 92.2 55.3 -53.5 -41.6 18.0 120.5 -38.0 787 5 C Q H <> S+ 0 0 111 -3,-0.6 4,-2.1 1,-0.2 -1,-0.2 0.805 102.0 54.3 -74.0 -30.6 16.2 121.6 -41.2 788 6 C Q H X S+ 0 0 76 -4,-0.6 4,-2.0 2,-0.2 -1,-0.2 0.910 106.4 53.9 -63.5 -45.0 17.9 119.0 -43.5 789 7 C I H X S+ 0 0 0 -4,-1.3 4,-1.7 1,-0.2 -2,-0.2 0.942 113.2 40.8 -53.9 -52.9 16.8 116.2 -41.1 790 8 C L H X S+ 0 0 36 -4,-1.7 4,-2.6 1,-0.2 5,-0.2 0.861 111.0 56.9 -69.9 -38.0 13.1 117.2 -41.2 791 9 C D H X S+ 0 0 87 -4,-2.1 4,-1.9 2,-0.2 5,-0.2 0.872 108.2 48.2 -60.1 -40.4 13.1 117.9 -44.9 792 10 C Y H X S+ 0 0 27 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.966 115.5 42.1 -64.8 -53.0 14.3 114.4 -45.7 793 11 C I H < S+ 0 0 0 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.889 118.4 46.5 -62.0 -41.1 11.8 112.5 -43.4 794 12 C E H >< S+ 0 0 86 -4,-2.6 3,-0.6 -5,-0.2 -1,-0.2 0.815 111.2 49.5 -75.5 -33.5 8.9 114.8 -44.5 795 13 C T H 3< S+ 0 0 110 -4,-1.9 3,-0.3 1,-0.2 -2,-0.2 0.938 125.1 26.9 -75.7 -45.5 9.5 114.7 -48.3 796 14 C N T 3< S+ 0 0 55 -4,-2.0 4,-0.4 -5,-0.2 -1,-0.2 -0.391 79.5 121.6-114.8 59.4 9.8 110.8 -48.5 797 15 C K X> + 0 0 46 -3,-0.6 4,-2.3 2,-0.2 3,-0.7 0.809 69.2 62.9 -75.4 -36.7 7.7 109.7 -45.5 798 16 C Y H 3> S+ 0 0 167 -3,-0.3 4,-1.7 1,-0.3 -1,-0.1 0.787 95.2 59.9 -63.5 -31.5 5.4 107.6 -47.8 799 17 C S H 3> S+ 0 0 40 2,-0.2 4,-1.2 1,-0.2 -1,-0.3 0.850 111.6 40.9 -60.0 -36.6 8.2 105.4 -48.8 800 18 C Y H <> S+ 0 0 1 -3,-0.7 4,-1.9 -4,-0.4 -2,-0.2 0.829 108.1 57.9 -85.3 -36.5 8.7 104.5 -45.2 801 19 C I H X S+ 0 0 13 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.854 104.7 55.5 -58.8 -35.7 5.0 104.2 -44.3 802 20 C E H X S+ 0 0 99 -4,-1.7 4,-2.4 2,-0.2 3,-0.3 0.975 104.2 52.3 -57.3 -55.2 4.9 101.5 -47.1 803 21 C I H X S+ 0 0 8 -4,-1.2 4,-2.3 1,-0.2 -2,-0.2 0.869 108.6 51.2 -50.5 -43.7 7.7 99.5 -45.4 804 22 C S H X S+ 0 0 0 -4,-1.9 4,-1.8 1,-0.2 -1,-0.2 0.912 111.5 46.0 -61.9 -44.3 5.6 99.6 -42.1 805 23 C H H X S+ 0 0 52 -4,-2.0 4,-2.4 -3,-0.3 -2,-0.2 0.811 111.6 53.0 -69.2 -30.3 2.5 98.3 -43.9 806 24 C R H X S+ 0 0 103 -4,-2.4 4,-0.9 2,-0.2 -2,-0.2 0.897 111.8 44.2 -70.2 -44.0 4.5 95.6 -45.7 807 25 C I H < S+ 0 0 1 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.851 114.9 52.2 -63.8 -34.8 6.0 94.4 -42.4 808 26 C H H < S+ 0 0 28 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.877 105.9 50.6 -72.1 -42.7 2.4 94.6 -41.0 809 27 C E H < S+ 0 0 115 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.739 115.3 48.2 -62.5 -27.2 0.7 92.5 -43.7 810 28 C R S < S- 0 0 95 -4,-0.9 -1,-0.2 -5,-0.1 10,-0.2 -0.681 79.6-169.1-120.2 74.3 3.4 89.8 -43.1 811 29 C P - 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0 0 94 -2,-0.2 3,-0.5 -181,-0.1 6,-0.4 -0.978 21.7-112.9-120.1 135.0 8.9 37.2 -20.1 1513 340 D G T 3 S+ 0 0 33 -2,-0.4 -247,-0.2 1,-0.2 3,-0.1 -0.251 97.1 30.3 -64.1 152.7 5.8 38.6 -21.9 1514 341 D H T 3 S+ 0 0 65 -249,-3.1 2,-0.3 1,-0.3 -1,-0.2 0.817 95.7 113.5 63.9 37.0 6.1 42.1 -23.4 1515 342 D T S <> S- 0 0 52 -250,-0.6 4,-1.6 -3,-0.5 -1,-0.3 -0.856 79.1-112.5-126.8 165.7 9.9 41.8 -24.1 1516 343 D H H > S+ 0 0 108 -2,-0.3 4,-2.4 1,-0.2 5,-0.1 0.846 118.1 57.1 -64.9 -36.5 11.9 41.7 -27.4 1517 344 D R H > S+ 0 0 123 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.850 104.4 52.2 -62.8 -35.2 12.8 38.1 -26.6 1518 345 D F H > S+ 0 0 6 -6,-0.4 4,-2.5 2,-0.2 -2,-0.2 0.886 108.7 49.3 -72.0 -39.8 9.1 37.2 -26.4 1519 346 D R H < S+ 0 0 61 -4,-1.6 4,-0.4 2,-0.2 -2,-0.2 0.932 112.4 49.1 -57.4 -47.6 8.4 38.7 -29.8 1520 347 D E H >< S+ 0 0 125 -4,-2.4 3,-1.2 1,-0.2 -2,-0.2 0.921 110.9 50.4 -58.4 -44.5 11.4 36.8 -31.1 1521 348 D A H >< S+ 0 0 11 -4,-2.7 3,-2.3 1,-0.2 6,-0.6 0.917 101.2 62.4 -58.9 -44.7 10.0 33.6 -29.5 1522 349 D A T 3< S+ 0 0 0 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.510 109.6 40.6 -64.7 -8.8 6.5 34.1 -31.1 1523 350 D A T < S+ 0 0 33 -3,-1.2 -1,-0.3 -4,-0.4 -2,-0.2 0.257 97.8 107.1-115.1 6.8 8.1 33.8 -34.6 1524 351 D S S <> S- 0 0 39 -3,-2.3 4,-2.6 -4,-0.2 5,-0.2 -0.277 86.2-106.1 -80.9 169.0 10.4 30.9 -33.7 1525 352 D V H > S+ 0 0 104 1,-0.2 4,-2.7 2,-0.2 5,-0.1 0.853 124.3 53.0 -59.4 -37.9 10.1 27.2 -34.6 1526 353 D H H > S+ 0 0 66 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.880 109.6 49.0 -67.7 -37.7 9.1 26.5 -31.0 1527 354 D G H > S+ 0 0 0 -6,-0.6 4,-1.8 -21,-0.3 -2,-0.2 0.899 110.9 48.9 -66.6 -44.9 6.3 29.2 -31.4 1528 355 D D H X S+ 0 0 18 -4,-2.6 4,-1.9 2,-0.2 -2,-0.2 0.942 111.5 50.3 -56.4 -49.0 5.2 27.7 -34.7 1529 356 D E H X S+ 0 0 98 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.919 108.9 52.1 -55.1 -45.4 5.1 24.2 -33.0 1530 357 D A H X S+ 0 0 2 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.841 105.7 55.5 -60.9 -36.4 3.0 25.7 -30.1 1531 358 D L H X S+ 0 0 0 -4,-1.8 4,-2.2 2,-0.2 -1,-0.2 0.946 111.5 42.1 -61.3 -50.3 0.5 27.2 -32.6 1532 359 D I H X S+ 0 0 9 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.914 114.9 50.4 -65.6 -46.0 -0.2 23.8 -34.2 1533 360 D K H X S+ 0 0 48 -4,-2.6 4,-2.9 2,-0.2 -1,-0.2 0.906 111.7 47.9 -57.5 -46.1 -0.3 22.0 -30.9 1534 361 D G H X S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.880 110.0 52.1 -65.3 -40.5 -2.7 24.5 -29.4 1535 362 D A H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 5,-0.2 0.941 112.7 45.8 -55.7 -50.8 -4.9 24.2 -32.5 1536 363 D K H X S+ 0 0 35 -4,-2.5 4,-2.2 1,-0.2 5,-0.2 0.927 111.6 52.0 -58.8 -49.3 -4.9 20.4 -32.1 1537 364 D I H X S+ 0 0 0 -4,-2.9 4,-1.6 1,-0.2 -1,-0.2 0.892 113.4 44.1 -52.6 -45.9 -5.6 20.7 -28.3 1538 365 D X H X S+ 0 0 0 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.853 113.2 48.6 -74.9 -38.5 -8.6 23.0 -28.8 1539 366 D A H X S+ 0 0 0 -4,-2.3 4,-1.7 2,-0.2 -1,-0.2 0.841 113.4 48.1 -67.8 -35.6 -10.2 21.1 -31.7 1540 367 D L H X S+ 0 0 3 -4,-2.2 4,-1.4 -5,-0.2 -2,-0.2 0.796 110.0 53.9 -75.0 -30.4 -9.8 17.8 -29.7 1541 368 D X H X S+ 0 0 0 -4,-1.6 4,-2.1 -5,-0.2 -2,-0.2 0.904 108.9 47.7 -63.5 -47.6 -11.4 19.6 -26.8 1542 369 D G H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 5,-0.3 0.872 106.8 57.4 -61.9 -38.5 -14.4 20.6 -28.9 1543 370 D L H X S+ 0 0 17 -4,-1.7 4,-2.2 1,-0.2 -1,-0.2 0.911 111.6 42.1 -58.3 -42.9 -14.8 17.1 -30.2 1544 371 D E H X S+ 0 0 27 -4,-1.4 4,-3.0 2,-0.2 8,-0.3 0.870 111.0 55.1 -74.0 -37.5 -15.1 15.8 -26.7 1545 372 D L H < S+ 0 0 0 -4,-2.1 7,-0.2 2,-0.2 -2,-0.2 0.901 117.4 35.9 -64.3 -40.0 -17.4 18.6 -25.5 1546 373 D I H < S+ 0 0 13 -4,-2.3 -2,-0.2 -5,-0.1 -1,-0.2 0.938 125.4 40.5 -71.8 -49.2 -19.9 17.9 -28.3 1547 374 D T H < S+ 0 0 83 -4,-2.2 2,-0.8 -5,-0.3 -3,-0.2 0.822 110.2 57.2 -71.7 -42.8 -19.5 14.1 -28.4 1548 375 D N X - 0 0 60 -4,-3.0 4,-1.6 -5,-0.2 -1,-0.1 -0.881 59.8-179.6 -99.1 107.9 -19.3 13.5 -24.6 1549 376 D Q H > S+ 0 0 153 -2,-0.8 4,-2.8 2,-0.2 5,-0.2 0.771 82.8 54.0 -77.4 -29.4 -22.5 14.9 -23.0 1550 377 D D H > S+ 0 0 106 2,-0.2 4,-1.7 3,-0.2 -1,-0.2 0.829 110.4 45.3 -75.0 -35.9 -21.5 13.8 -19.6 1551 378 D V H > S+ 0 0 35 -7,-0.2 4,-1.5 2,-0.2 -2,-0.2 0.898 117.4 46.3 -70.0 -42.5 -18.1 15.6 -19.8 1552 379 D Y H X S+ 0 0 47 -4,-1.6 4,-2.4 -8,-0.3 3,-0.3 0.951 113.3 47.2 -60.9 -54.1 -19.9 18.7 -21.3 1553 380 D Q H X S+ 0 0 83 -4,-2.8 4,-2.5 1,-0.2 5,-0.2 0.911 110.4 53.4 -58.8 -44.1 -22.7 18.7 -18.7 1554 381 D D H X S+ 0 0 68 -4,-1.7 4,-1.3 1,-0.2 -1,-0.2 0.857 110.3 47.0 -58.9 -39.6 -20.2 18.3 -15.8 1555 382 D I H X S+ 0 0 2 -4,-1.5 4,-2.2 -3,-0.3 -2,-0.2 0.917 113.1 48.6 -69.0 -46.3 -18.2 21.3 -17.1 1556 383 D I H X S+ 0 0 54 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.847 112.8 47.6 -59.9 -40.6 -21.4 23.5 -17.5 1557 384 D E H X S+ 0 0 108 -4,-2.5 4,-1.8 -5,-0.2 -1,-0.2 0.785 111.0 50.8 -76.5 -29.0 -22.7 22.5 -14.0 1558 385 D E H X S+ 0 0 44 -4,-1.3 4,-2.5 -5,-0.2 -2,-0.2 0.894 111.7 47.2 -73.0 -43.9 -19.4 23.2 -12.3 1559 386 D H H X S+ 0 0 5 -4,-2.2 4,-2.4 2,-0.2 5,-0.2 0.904 112.3 50.8 -58.7 -42.9 -19.1 26.6 -13.9 1560 387 D A H X S+ 0 0 47 -4,-1.8 4,-1.1 2,-0.2 -2,-0.2 0.891 113.4 44.7 -65.4 -44.0 -22.8 27.4 -12.9 1561 388 D H H < S+ 0 0 151 -4,-1.8 3,-0.4 2,-0.2 -2,-0.2 0.948 114.8 48.1 -60.0 -53.1 -22.1 26.4 -9.3 1562 389 D L H < S+ 0 0 85 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.802 109.3 51.2 -65.9 -34.5 -18.8 28.3 -9.1 1563 390 D K H < 0 0 101 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.787 360.0 360.0 -75.0 -25.2 -20.1 31.6 -10.6 1564 391 D G < 0 0 96 -4,-1.1 -1,-0.1 -3,-0.4 -2,-0.1 -0.036 360.0 360.0 99.4 360.0 -23.1 31.6 -8.1