==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/DNA 07-AUG-00 1FIU . COMPND 2 MOLECULE: DNA (5'-D(*TP*GP*CP*G)-3'); . SOURCE 2 SYNTHETIC: YES; . AUTHOR M.DEIBERT,S.GRAZULIS,G.SASNAUSKAS,V.SIKSNYS,R.HUBER . 1144 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 41279.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 816 71.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 80 7.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 60 5.2 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 0.3 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 . 52 4.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 173 15.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 384 33.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 17 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 9 1 0 2 4 1 2 5 8 4 0 4 0 0 0 0 2 2 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 8 0 4 4 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 . 4 0 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 ANTIPARALLEL BRIDGES PER LADDER . 0 4 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 M 0 0 198 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 98.6 71.6 101.5 140.6 2 2 A Q - 0 0 82 1,-0.1 1017,-0.1 2,-0.1 5,-0.1 -0.672 360.0-111.2 -80.4 134.0 69.4 98.5 140.0 3 3 A P >> - 0 0 2 0, 0.0 4,-2.0 0, 0.0 3,-0.6 -0.209 29.0-106.5 -61.3 161.4 71.4 95.7 138.2 4 4 A L H 3> S+ 0 0 39 1015,-3.5 4,-2.6 1,-0.2 1016,-0.2 0.817 118.0 55.7 -62.6 -32.8 70.4 95.0 134.6 5 5 A F H 3> S+ 0 0 2 1015,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.829 108.2 50.2 -69.6 -27.4 68.7 91.7 135.3 6 6 A T H <> S+ 0 0 18 -3,-0.6 4,-2.1 1014,-0.4 -2,-0.2 0.921 111.2 48.9 -72.7 -41.2 66.4 93.5 137.8 7 7 A Q H X S+ 0 0 74 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.915 111.5 49.3 -62.5 -42.2 65.7 96.1 135.1 8 8 A E H X S+ 0 0 26 -4,-2.6 4,-2.1 1,-0.2 -1,-0.2 0.876 108.3 53.4 -64.9 -38.2 64.9 93.4 132.6 9 9 A R H X S+ 0 0 16 -4,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.898 109.7 48.5 -64.2 -39.1 62.6 91.6 135.1 10 10 A R H X S+ 0 0 133 -4,-2.1 4,-2.7 1,-0.2 -2,-0.2 0.895 109.3 52.0 -68.6 -37.5 60.7 94.9 135.6 11 11 A I H X S+ 0 0 74 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.895 107.5 53.8 -63.1 -39.5 60.4 95.4 131.8 12 12 A F H X S+ 0 0 2 -4,-2.1 4,-1.4 2,-0.2 -2,-0.2 0.947 111.3 44.5 -59.4 -49.5 59.0 91.8 131.6 13 13 A H H X S+ 0 0 15 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.913 109.5 56.8 -63.4 -40.6 56.3 92.7 134.2 14 14 A K H X S+ 0 0 121 -4,-2.7 4,-3.5 1,-0.2 5,-0.2 0.864 103.7 52.8 -60.8 -36.9 55.6 96.0 132.5 15 15 A K H X S+ 0 0 74 -4,-1.9 4,-1.9 1,-0.2 6,-0.3 0.888 108.3 50.8 -65.9 -37.0 54.8 94.3 129.2 16 16 A L H <>S+ 0 0 0 -4,-1.4 6,-1.9 2,-0.2 5,-1.8 0.886 115.9 42.7 -67.0 -37.3 52.3 92.0 130.9 17 17 A L H ><5S+ 0 0 27 -4,-2.1 3,-2.0 3,-0.2 -2,-0.2 0.957 113.0 50.1 -72.8 -50.6 50.7 95.1 132.5 18 18 A D H 3<5S+ 0 0 105 -4,-3.5 -2,-0.2 1,-0.3 -1,-0.2 0.824 111.5 49.0 -59.1 -32.1 50.7 97.3 129.4 19 19 A G T 3<5S- 0 0 40 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.438 110.9-121.9 -87.1 2.8 49.2 94.6 127.3 20 20 A N T < 5S+ 0 0 54 -3,-2.0 40,-0.3 2,-0.2 3,-0.2 0.744 76.9 128.5 63.0 23.1 46.5 94.0 129.9 21 21 A I S - 0 0 27 4,-2.1 3,-1.9 -2,-0.4 33,-0.1 -0.322 37.6 -91.4 -87.8 179.8 38.4 93.0 136.1 26 26 A N T 3 S+ 0 0 114 1,-0.3 -1,-0.1 2,-0.1 32,-0.1 0.411 124.9 57.1 -72.8 4.8 35.4 95.0 137.4 27 27 A R T 3 S- 0 0 206 2,-0.2 -1,-0.3 0, 0.0 -2,-0.0 0.182 121.0-104.9-113.4 9.6 34.6 92.2 139.9 28 28 A G S < S+ 0 0 16 -3,-1.9 2,-0.5 1,-0.2 -2,-0.1 0.516 73.6 140.4 82.8 6.0 38.0 92.4 141.5 29 29 A V - 0 0 26 2,-0.0 -4,-2.1 4,-0.0 -1,-0.2 -0.722 48.1-135.0 -88.1 124.3 39.4 89.2 140.0 30 30 A V B > -A 24 0A 0 -2,-0.5 3,-2.2 11,-0.2 -6,-0.2 -0.538 24.4-115.5 -76.7 142.5 43.1 89.3 138.8 31 31 A S T 3 S+ 0 0 7 -8,-2.8 -1,-0.1 1,-0.3 -7,-0.1 0.495 111.4 47.6 -61.8 -9.9 43.6 87.7 135.4 32 32 A N T 3 S+ 0 0 1 -9,-0.2 -1,-0.3 8,-0.1 2,-0.2 0.315 96.7 98.4-109.7 8.0 45.8 84.9 136.4 33 33 A A S < S- 0 0 2 -3,-2.2 2,-0.7 189,-0.1 8,-0.1 -0.494 73.1-131.2 -91.0 161.6 43.6 83.9 139.3 34 34 A D > - 0 0 23 3,-0.2 3,-2.1 -2,-0.2 7,-0.4 -0.945 21.1-154.7-108.4 102.8 40.9 81.2 139.5 35 35 A G T 3 S+ 0 0 47 -2,-0.7 -1,-0.1 1,-0.3 6,-0.0 0.619 86.1 67.6 -57.5 -14.4 38.0 83.2 141.0 36 36 A S T 3 S+ 0 0 102 1,-0.1 2,-0.5 5,-0.0 -1,-0.3 0.481 92.3 71.5 -84.7 -2.0 36.4 80.1 142.5 37 37 A N <> - 0 0 64 -3,-2.1 4,-2.9 1,-0.2 -3,-0.2 -0.959 67.1-154.6-124.9 118.0 39.2 79.8 145.0 38 38 A T H > S+ 0 0 98 -2,-0.5 4,-2.6 1,-0.2 5,-0.2 0.880 97.5 45.9 -51.9 -49.2 39.8 82.2 147.9 39 39 A R H > S+ 0 0 142 2,-0.2 4,-2.8 1,-0.2 5,-0.3 0.916 113.3 48.5 -67.9 -40.4 43.5 81.6 148.2 40 40 A S H > S+ 0 0 0 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.954 113.0 49.5 -60.7 -48.5 44.1 81.9 144.4 41 41 A F H X S+ 0 0 55 -4,-2.9 4,-1.7 -7,-0.4 -11,-0.2 0.928 116.4 41.0 -53.7 -51.9 42.0 85.1 144.3 42 42 A N H X S+ 0 0 57 -4,-2.6 4,-2.2 -5,-0.2 -1,-0.2 0.856 114.4 50.3 -69.6 -37.7 43.9 86.6 147.2 43 43 A I H X S+ 0 0 2 -4,-2.8 4,-2.5 -5,-0.2 5,-0.2 0.958 112.4 47.4 -65.8 -48.3 47.4 85.5 146.2 44 44 A A H X S+ 0 0 1 -4,-2.7 4,-2.5 -5,-0.3 -2,-0.2 0.873 112.1 50.3 -59.9 -39.2 47.0 86.8 142.7 45 45 A K H X S+ 0 0 79 -4,-1.7 4,-2.2 -5,-0.3 -1,-0.2 0.914 110.1 49.8 -65.2 -44.8 45.7 90.1 144.0 46 46 A G H X S+ 0 0 15 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.915 111.9 48.2 -60.8 -43.5 48.6 90.5 146.3 47 47 A I H X S+ 0 0 2 -4,-2.5 4,-1.2 1,-0.2 -2,-0.2 0.949 110.4 50.3 -63.6 -46.2 51.1 89.8 143.6 48 48 A A H <>S+ 0 0 3 -4,-2.5 5,-2.7 1,-0.2 3,-0.3 0.876 109.7 52.2 -60.8 -36.4 49.4 92.2 141.2 49 49 A D H ><5S+ 0 0 117 -4,-2.2 3,-1.8 1,-0.2 -1,-0.2 0.940 107.9 50.5 -65.1 -43.5 49.6 94.9 143.9 50 50 A L H 3<5S+ 0 0 44 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.721 110.0 51.6 -65.9 -18.4 53.3 94.3 144.4 51 51 A L T 3<5S- 0 0 13 -4,-1.2 -1,-0.3 -3,-0.3 -2,-0.2 0.375 115.6-119.1 -96.3 1.6 53.6 94.6 140.6 52 52 A H T < 5 + 0 0 146 -3,-1.8 2,-0.3 1,-0.2 -3,-0.2 0.805 47.9 173.5 63.7 34.4 51.8 98.0 140.7 53 53 A S < + 0 0 19 -5,-2.7 -1,-0.2 1,-0.2 -30,-0.1 -0.557 11.4 158.4 -71.6 134.0 49.0 96.8 138.5 54 54 A E + 0 0 172 -2,-0.3 -1,-0.2 -37,-0.0 -31,-0.1 0.529 31.7 111.3-130.5 -19.3 46.3 99.4 138.3 55 55 A T - 0 0 61 -33,-0.2 -31,-1.9 1,-0.1 2,-0.6 -0.312 49.9-154.2 -67.0 137.4 44.4 98.7 135.1 56 56 A V B +b 24 0A 96 -33,-0.2 2,-0.3 -2,-0.1 -31,-0.2 -0.965 35.7 135.5-111.4 122.3 40.8 97.4 135.2 57 57 A S - 0 0 26 -33,-2.4 3,-0.1 -2,-0.6 -34,-0.1 -0.981 57.1 -82.3-160.1 160.0 39.8 95.4 132.2 58 58 A E - 0 0 124 -2,-0.3 2,-0.1 -33,-0.1 -27,-0.0 -0.379 58.3 -92.7 -67.4 146.0 38.0 92.3 131.2 59 59 A R - 0 0 108 1,-0.1 -1,-0.1 -2,-0.1 3,-0.1 -0.354 47.1-118.2 -57.1 132.3 40.0 89.0 131.4 60 60 A L - 0 0 44 -40,-0.3 -1,-0.1 -39,-0.2 -40,-0.0 -0.371 36.8 -87.0 -73.9 156.2 41.5 88.3 128.0 61 61 A P >> - 0 0 73 0, 0.0 4,-2.1 0, 0.0 3,-0.9 -0.353 40.4-117.6 -58.6 142.5 40.6 85.2 126.1 62 62 A G H 3> S+ 0 0 52 1,-0.3 4,-2.4 2,-0.2 5,-0.2 0.802 114.3 57.8 -54.9 -33.1 42.9 82.3 127.2 63 63 A Q H 3> S+ 0 0 157 2,-0.2 4,-2.0 1,-0.2 -1,-0.3 0.871 108.2 48.2 -65.2 -34.8 44.3 82.0 123.7 64 64 A T H <> S+ 0 0 66 -3,-0.9 4,-2.7 2,-0.2 5,-0.2 0.939 114.5 42.2 -71.1 -48.2 45.3 85.6 123.8 65 65 A S H X S+ 0 0 9 -4,-2.1 4,-2.5 2,-0.2 5,-0.2 0.895 113.5 54.6 -67.2 -36.2 47.0 85.5 127.2 66 66 A G H X S+ 0 0 25 -4,-2.4 4,-1.7 -5,-0.2 -2,-0.2 0.959 114.4 39.5 -59.3 -52.7 48.6 82.1 126.3 67 67 A N H X S+ 0 0 89 -4,-2.0 4,-2.3 -5,-0.2 -2,-0.2 0.919 116.4 49.7 -65.0 -43.8 50.2 83.5 123.2 68 68 A A H X S+ 0 0 19 -4,-2.7 4,-2.7 1,-0.2 5,-0.2 0.884 108.2 53.8 -64.9 -36.8 51.1 86.9 124.7 69 69 A F H X S+ 0 0 1 -4,-2.5 4,-2.4 -5,-0.2 -1,-0.2 0.908 108.6 50.0 -65.4 -39.9 52.8 85.2 127.7 70 70 A E H X S+ 0 0 34 -4,-1.7 4,-2.5 -5,-0.2 -2,-0.2 0.945 112.3 47.4 -61.7 -47.9 54.9 83.1 125.3 71 71 A A H X S+ 0 0 25 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.929 113.8 45.7 -60.7 -46.1 56.0 86.2 123.3 72 72 A I H X S+ 0 0 20 -4,-2.7 4,-2.0 2,-0.2 -1,-0.2 0.879 112.3 51.3 -66.6 -38.1 56.8 88.3 126.4 73 73 A C H X S+ 0 0 1 -4,-2.4 4,-2.5 -5,-0.2 -1,-0.2 0.923 109.3 52.4 -62.8 -41.9 58.7 85.4 128.0 74 74 A S H X S+ 0 0 11 -4,-2.5 4,-2.8 1,-0.2 -2,-0.2 0.904 108.6 49.1 -59.6 -45.0 60.7 85.0 124.8 75 75 A E H X S+ 0 0 87 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.887 110.9 50.0 -64.0 -40.1 61.7 88.6 124.7 76 76 A F H X S+ 0 0 5 -4,-2.0 4,-2.5 2,-0.2 5,-0.3 0.922 113.0 46.4 -64.2 -45.5 62.8 88.6 128.3 77 77 A V H X S+ 0 0 2 -4,-2.5 4,-2.7 2,-0.2 5,-0.3 0.945 112.9 49.5 -63.6 -46.2 65.0 85.5 127.7 78 78 A Q H X S+ 0 0 99 -4,-2.8 4,-1.6 1,-0.2 -2,-0.2 0.947 114.7 44.2 -57.1 -49.5 66.4 86.8 124.5 79 79 A S H < S+ 0 0 36 -4,-2.4 4,-0.5 -5,-0.2 -1,-0.2 0.902 118.4 40.6 -65.9 -44.3 67.4 90.2 126.1 80 80 A A H >< S+ 0 0 0 -4,-2.5 3,-1.2 -5,-0.2 -2,-0.2 0.918 113.9 51.4 -73.5 -40.9 68.8 88.8 129.3 81 81 A F H >< S+ 0 0 7 -4,-2.7 3,-2.1 -5,-0.3 -1,-0.2 0.843 98.4 67.4 -65.2 -31.8 70.7 85.8 127.8 82 82 A E G >< S+ 0 0 140 -4,-1.6 3,-0.8 -5,-0.3 -1,-0.3 0.788 94.5 59.2 -57.4 -27.7 72.3 88.1 125.3 83 83 A K G < S+ 0 0 49 -3,-1.2 3,-0.3 -4,-0.5 -1,-0.3 0.475 94.0 66.3 -83.0 0.1 74.2 89.7 128.2 84 84 A L G X> + 0 0 0 -3,-2.1 4,-1.9 1,-0.2 3,-1.7 0.168 58.0 119.6-107.6 20.0 75.8 86.4 129.2 85 85 A Q T <4 S+ 0 0 89 -3,-0.8 -1,-0.2 1,-0.3 -2,-0.1 0.774 72.0 58.9 -55.8 -28.0 78.0 86.0 126.1 86 86 A H T 34 S+ 0 0 28 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.720 114.5 34.5 -76.5 -20.9 81.2 86.0 128.3 87 87 A I T <4 S+ 0 0 2 -3,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.603 137.8 19.7-105.5 -13.7 80.1 83.0 130.3 88 88 A R S < S- 0 0 1 -4,-1.9 -2,-0.2 -7,-0.1 -1,-0.2 -0.504 82.5-168.9-153.1 72.5 78.3 81.2 127.5 89 89 A P + 0 0 17 0, 0.0 2,-0.2 0, 0.0 -3,-0.1 -0.190 27.8 108.3 -64.0 154.5 79.4 82.4 124.1 90 90 A G S S- 0 0 18 2,-0.1 2,-1.1 859,-0.0 57,-0.1 -0.825 74.0 -83.1 156.5 168.1 77.7 81.5 120.9 91 91 A D - 0 0 87 55,-0.5 55,-2.6 -2,-0.2 2,-0.3 -0.826 62.5-173.2 -98.8 91.1 75.5 82.7 118.0 92 92 A W E -C 145 0B 39 -2,-1.1 2,-0.4 53,-0.2 53,-0.2 -0.646 19.6-168.0 -97.0 146.0 72.2 82.2 119.8 93 93 A N E -C 144 0B 67 51,-2.2 51,-2.5 -2,-0.3 2,-0.4 -0.986 2.2-166.9-128.3 140.0 68.6 82.5 118.6 94 94 A V E +C 143 0B 15 -2,-0.4 2,-0.4 49,-0.2 49,-0.2 -0.994 19.2 165.8-126.3 128.1 65.6 82.7 120.8 95 95 A K E -C 142 0B 67 47,-2.7 47,-2.6 -2,-0.4 2,-0.5 -0.991 42.3-124.3-153.5 147.8 62.1 82.3 119.3 96 96 A Q E -C 141 0B 57 -2,-0.4 45,-0.3 45,-0.2 44,-0.1 -0.700 32.2-159.0 -78.7 125.9 58.5 81.6 120.0 97 97 A V - 0 0 12 43,-2.7 -1,-0.2 -2,-0.5 43,-0.1 0.985 10.4-146.7 -76.6 -61.9 57.7 78.6 117.9 98 98 A G > - 0 0 19 42,-0.4 3,-3.3 41,-0.3 42,-0.0 0.564 29.6-102.7 92.9 118.3 53.9 78.5 117.2 99 99 A S T 3 S+ 0 0 103 1,-0.3 -1,-0.1 39,-0.1 41,-0.0 0.640 114.1 82.4 -44.1 -16.9 52.0 75.2 116.9 100 100 A R T 3 S+ 0 0 223 1,-0.2 2,-1.3 -3,-0.1 -1,-0.3 0.739 74.1 83.3 -61.5 -23.8 52.1 75.9 113.2 101 101 A N X + 0 0 54 -3,-3.3 3,-1.3 2,-0.0 2,-0.3 -0.589 59.5 178.9 -88.9 79.2 55.6 74.4 113.2 102 102 A R T 3 S+ 0 0 205 -2,-1.3 36,-0.1 1,-0.3 34,-0.0 -0.618 79.0 9.1 -77.9 135.6 55.2 70.6 112.9 103 103 A L T > S+ 0 0 48 -2,-0.3 3,-0.9 34,-0.2 -1,-0.3 0.692 85.1 137.0 67.3 18.0 58.6 69.0 112.8 104 104 A E G X + 0 0 1 -3,-1.3 3,-2.0 1,-0.3 4,-0.1 0.914 69.8 57.4 -60.2 -40.0 60.2 72.4 113.7 105 105 A I G > S+ 0 0 0 32,-0.7 3,-1.6 -4,-0.3 6,-0.4 0.740 92.2 69.0 -64.3 -21.1 62.5 70.4 116.1 106 106 A A G < S+ 0 0 6 -3,-0.9 -1,-0.3 1,-0.3 -2,-0.2 0.535 83.1 73.0 -74.5 -3.7 63.7 68.3 113.3 107 107 A R G < S+ 0 0 126 -3,-2.0 2,-0.3 -4,-0.2 -1,-0.3 0.555 90.0 78.0 -82.2 -4.7 65.5 71.3 111.9 108 108 A Y S X> S- 0 0 12 -3,-1.6 3,-1.7 -4,-0.1 4,-0.7 -0.799 89.6-115.7-111.1 147.7 67.9 70.9 114.8 109 109 A Q G >4 S+ 0 0 26 69,-2.8 3,-0.9 -2,-0.3 4,-0.3 0.821 107.1 52.6 -46.1 -51.4 70.7 68.4 115.1 110 110 A Q G 34 S+ 0 0 5 1,-0.2 100,-0.9 2,-0.1 -1,-0.3 0.657 123.5 29.1 -67.0 -13.8 69.7 66.2 118.0 111 111 A Y G X4 S+ 0 0 0 -3,-1.7 3,-2.1 -6,-0.4 4,-0.3 0.248 80.6 113.4-129.1 14.0 66.3 65.5 116.4 112 112 A A T XX + 0 0 23 -3,-0.9 3,-1.4 -4,-0.7 4,-0.5 0.779 69.6 68.5 -59.6 -28.3 66.9 65.8 112.6 113 113 A H H 3> S+ 0 0 16 -4,-0.3 4,-2.0 1,-0.3 -1,-0.3 0.632 79.0 78.3 -67.4 -13.2 66.2 62.1 112.2 114 114 A L H <> S+ 0 0 0 -3,-2.1 4,-2.8 1,-0.2 -1,-0.3 0.819 87.1 60.4 -66.0 -25.9 62.5 62.6 113.0 115 115 A T H <> S+ 0 0 46 -3,-1.4 4,-2.6 -4,-0.3 -1,-0.2 0.931 106.0 46.0 -64.3 -44.5 62.1 63.9 109.5 116 116 A A H X S+ 0 0 46 -4,-0.5 4,-2.3 2,-0.2 -2,-0.2 0.912 112.9 50.1 -65.0 -40.0 63.2 60.5 108.1 117 117 A L H X S+ 0 0 6 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.945 112.3 47.0 -61.6 -49.4 60.9 58.7 110.5 118 118 A A H X S+ 0 0 23 -4,-2.8 4,-2.0 1,-0.2 -2,-0.2 0.909 112.6 49.7 -59.1 -45.3 58.0 60.8 109.6 119 119 A K H < S+ 0 0 128 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.857 112.4 47.5 -64.0 -36.1 58.7 60.3 105.8 120 120 A A H >< S+ 0 0 20 -4,-2.3 3,-0.9 1,-0.2 -2,-0.2 0.885 110.4 51.8 -73.2 -38.1 59.0 56.6 106.2 121 121 A A H >< S+ 0 0 14 -4,-2.5 3,-2.3 1,-0.3 7,-0.3 0.857 92.2 73.1 -66.0 -35.8 55.8 56.3 108.2 122 122 A E T 3< S+ 0 0 143 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.1 0.321 111.3 33.2 -64.3 16.2 53.8 58.3 105.6 123 123 A E T < S+ 0 0 156 -3,-0.9 -1,-0.3 1,-0.1 -2,-0.2 0.278 113.6 66.4-148.2 0.8 54.2 55.0 103.7 124 124 A N X> - 0 0 39 -3,-2.3 4,-1.6 1,-0.2 3,-0.7 -0.835 58.9-157.9-144.5 107.9 54.1 52.4 106.5 125 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4,-1.4 -5,-0.2 -1,-0.2 0.954 113.0 40.7 -62.7 -45.6 46.6 53.1 111.3 555 268 B M H <>S+ 0 0 0 -4,-2.3 5,-3.2 2,-0.2 6,-1.3 0.901 121.6 42.1 -69.2 -38.1 45.5 53.1 115.0 556 269 B V H ><5S+ 0 0 6 -4,-2.7 3,-1.4 4,-0.2 -2,-0.2 0.937 119.8 40.0 -76.5 -47.9 43.2 50.0 114.6 557 270 B N H 3<5S+ 0 0 101 -4,-3.4 -1,-0.2 1,-0.3 -3,-0.2 0.787 114.0 58.7 -69.8 -25.1 45.5 47.9 112.4 558 271 B G T 3<> -o 530 0E 0 -34,-0.2 3,-2.0 -2,-0.2 4,-0.7 -0.583 36.5-112.9 -92.7 158.4 36.0 49.0 120.6 564 277 B I G >4 S+ 0 0 0 -34,-1.8 3,-1.1 1,-0.3 -33,-0.1 0.856 117.9 63.6 -56.5 -31.3 34.6 49.3 124.1 565 278 B S G 34 S+ 0 0 1 1,-0.2 4,-0.4 -35,-0.2 -1,-0.3 0.684 95.0 59.6 -69.0 -17.1 33.3 45.7 123.5 566 279 B D G <> S+ 0 0 0 -3,-2.0 4,-2.0 1,-0.1 -1,-0.2 0.712 87.9 77.5 -81.5 -21.0 36.9 44.4 123.3 567 280 B L H 4 S+ 0 0 0 -4,-0.4 3,-1.6 1,-0.2 -2,-0.2 0.860 110.5 56.0 -68.1 -34.7 38.0 40.2 127.1 570 283 B D H >< S+ 0 0 6 -4,-2.0 3,-1.0 1,-0.3 -1,-0.2 0.824 101.8 58.3 -67.0 -26.5 41.3 42.1 127.0 571 284 B L T 3< 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