==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-FEB-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/ANTIBOTIC/INHIBITOR 24-JAN-12 4DFU . COMPND 2 MOLECULE: APH(2")-ID; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROCOCCUS CASSELIFLAVUS; . AUTHOR P.J.STOGIOS,G.MINASOV,A.DONG,E.EVDOKIMOVA,E.EGOROVA,R.DI LEO . 593 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 29690.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 433 73.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 0.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 74 12.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.7 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 . 35 5.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 61 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 234 39.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.3 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 2 2 0 0 0 0 1 5 0 0 0 2 3 1 2 0 0 0 0 0 0 1 1 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 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 2 4 4 2 2 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 2 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 3 A T 0 0 156 0, 0.0 2,-0.3 0, 0.0 46,-0.0 0.000 360.0 360.0 360.0 161.8 -21.5 15.6 -27.1 2 4 A Y - 0 0 39 43,-0.1 2,-0.2 4,-0.0 43,-0.0 -0.924 360.0-134.9-129.3 146.6 -22.1 18.9 -25.2 3 5 A T > - 0 0 76 -2,-0.3 4,-2.3 1,-0.1 5,-0.1 -0.650 30.7-117.1 -89.2 160.0 -24.3 21.9 -25.2 4 6 A F H > S+ 0 0 81 -2,-0.2 4,-2.6 1,-0.2 5,-0.3 0.875 119.5 57.3 -59.6 -37.0 -23.0 25.5 -24.9 5 7 A D H > S+ 0 0 120 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.903 107.8 47.4 -58.8 -41.9 -24.9 25.6 -21.6 6 8 A Q H > S+ 0 0 87 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.895 112.4 47.9 -67.3 -44.3 -23.0 22.6 -20.4 7 9 A V H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 5,-0.2 0.967 114.2 45.8 -59.8 -53.8 -19.6 23.9 -21.4 8 10 A E H X S+ 0 0 86 -4,-2.6 4,-2.9 1,-0.2 -2,-0.2 0.916 114.2 49.0 -58.9 -46.2 -20.2 27.3 -19.9 9 11 A K H X S+ 0 0 123 -4,-2.2 4,-1.6 -5,-0.3 -1,-0.2 0.911 109.9 52.1 -59.4 -44.6 -21.6 25.7 -16.7 10 12 A A H X S+ 0 0 31 -4,-2.5 4,-0.7 1,-0.2 -2,-0.2 0.911 115.0 41.2 -57.6 -47.8 -18.6 23.4 -16.5 11 13 A I H >X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 3,-0.9 0.898 109.3 58.6 -67.8 -42.9 -16.1 26.2 -16.8 12 14 A E H 3< S+ 0 0 81 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.844 98.3 62.5 -56.8 -34.7 -18.0 28.6 -14.5 13 15 A Q H 3< S+ 0 0 113 -4,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.861 117.5 25.1 -60.7 -38.3 -17.7 26.0 -11.7 14 16 A L H << S+ 0 0 41 -3,-0.9 -1,-0.2 -4,-0.7 -2,-0.2 0.620 132.6 37.4-104.3 -18.0 -13.9 26.1 -11.6 15 17 A Y >< + 0 0 50 -4,-2.4 3,-1.7 -5,-0.1 -1,-0.2 -0.538 63.4 161.9-133.6 65.8 -13.4 29.6 -12.9 16 18 A P T 3 S+ 0 0 53 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.776 77.2 53.8 -62.1 -26.0 -16.3 31.7 -11.5 17 19 A D T 3 S+ 0 0 157 -3,-0.1 2,-0.7 2,-0.1 -5,-0.1 0.610 85.1 100.1 -83.4 -10.9 -14.4 35.0 -12.2 18 20 A F < - 0 0 46 -3,-1.7 2,-0.5 -7,-0.2 -3,-0.1 -0.644 66.5-148.4 -79.8 111.6 -14.0 34.1 -15.9 19 21 A T - 0 0 95 -2,-0.7 2,-0.7 19,-0.0 -2,-0.1 -0.682 4.3-153.0 -86.5 123.5 -16.6 35.9 -17.9 20 22 A I + 0 0 28 -2,-0.5 3,-0.1 1,-0.2 -1,-0.0 -0.847 25.8 161.1 -99.2 116.8 -17.7 34.1 -21.0 21 23 A N + 0 0 125 -2,-0.7 2,-0.3 1,-0.3 -1,-0.2 0.811 65.9 17.3 -99.3 -42.7 -18.9 36.4 -23.8 22 24 A T + 0 0 51 2,-0.0 16,-2.1 0, 0.0 2,-0.3 -0.975 56.2 176.2-135.1 148.7 -18.7 34.3 -26.9 23 25 A I E +A 37 0A 32 -2,-0.3 2,-0.3 14,-0.2 14,-0.2 -0.947 9.2 162.5-152.7 123.9 -18.5 30.6 -27.5 24 26 A E E -A 36 0A 104 12,-1.8 12,-2.9 -2,-0.3 2,-0.2 -0.977 47.7 -93.7-136.9 152.6 -18.5 28.8 -30.9 25 27 A I E -A 35 0A 101 -2,-0.3 10,-0.3 10,-0.2 3,-0.1 -0.488 39.5-178.8 -63.4 133.8 -17.5 25.4 -32.0 26 28 A S E - 0 0 60 8,-3.2 2,-0.3 1,-0.4 9,-0.2 0.761 55.6 -31.4-105.1 -41.8 -13.9 25.7 -33.2 27 29 A G E -A 34 0A 28 7,-1.3 7,-2.6 2,-0.0 -1,-0.4 -0.960 49.3-135.5-166.2 177.8 -13.1 22.2 -34.4 28 30 A E E +A 33 0A 128 -2,-0.3 5,-0.2 5,-0.2 2,-0.2 -0.959 19.5 173.3-152.9 129.8 -13.8 18.5 -33.7 29 31 A G - 0 0 38 3,-3.0 -2,-0.0 -2,-0.3 5,-0.0 -0.529 50.4 -92.2-118.3-169.6 -11.5 15.5 -33.6 30 32 A N S S+ 0 0 56 -2,-0.2 21,-0.2 1,-0.1 3,-0.1 0.728 124.5 32.0 -73.7 -23.4 -11.9 11.8 -32.7 31 33 A D S S+ 0 0 26 1,-0.3 16,-2.9 20,-0.1 17,-0.7 0.816 124.1 15.1-103.3 -42.2 -11.0 12.6 -29.1 32 34 A C E - B 0 46A 16 14,-0.3 -3,-3.0 15,-0.2 2,-0.4 -0.929 56.4-133.5-137.4 152.5 -12.2 16.1 -28.3 33 35 A I E -AB 28 45A 7 12,-2.7 12,-2.6 -2,-0.3 2,-0.4 -0.898 30.7-141.7-100.1 143.5 -14.5 18.8 -29.5 34 36 A A E -AB 27 44A 13 -7,-2.6 -8,-3.2 -2,-0.4 -7,-1.3 -0.893 13.5-166.2-108.3 138.0 -12.9 22.3 -29.4 35 37 A Y E -AB 25 43A 2 8,-2.9 8,-3.5 -2,-0.4 2,-0.6 -0.971 14.8-142.4-119.8 135.3 -14.6 25.5 -28.5 36 38 A E E -AB 24 42A 17 -12,-2.9 -12,-1.8 -2,-0.4 2,-0.4 -0.874 24.5-166.6 -94.6 125.7 -13.3 29.0 -29.1 37 39 A I E >> -AB 23 41A 0 4,-2.5 3,-2.1 -2,-0.6 4,-1.9 -0.961 65.3 -14.3-123.6 130.7 -14.2 31.2 -26.2 38 40 A N T 34 S- 0 0 23 -16,-2.1 -1,-0.1 -2,-0.4 -15,-0.1 0.658 107.4 -87.0 51.9 22.6 -14.0 35.0 -26.1 39 41 A R T 34 S+ 0 0 140 2,-0.2 -1,-0.3 -17,-0.2 3,-0.1 0.631 124.5 84.0 51.4 18.1 -11.9 34.6 -29.3 40 42 A D T <4 S+ 0 0 99 -3,-2.1 55,-2.3 1,-0.2 2,-0.3 0.602 85.0 41.5-115.8 -23.1 -9.0 34.2 -26.9 41 43 A F E < -BC 37 94A 35 -4,-1.9 -4,-2.5 53,-0.2 2,-0.6 -0.951 58.8-141.3-135.6 147.7 -9.0 30.6 -25.9 42 44 A I E -BC 36 93A 26 51,-2.6 51,-3.3 -2,-0.3 2,-0.5 -0.953 23.9-163.5-105.1 118.4 -9.5 27.1 -27.3 43 45 A F E -BC 35 92A 0 -8,-3.5 -8,-2.9 -2,-0.6 2,-0.5 -0.892 2.8-156.2-102.2 126.9 -11.4 24.9 -24.8 44 46 A K E -BC 34 91A 24 47,-3.3 47,-1.6 -2,-0.5 -10,-0.2 -0.892 8.8-173.6-105.5 129.6 -11.3 21.1 -25.4 45 47 A F E -B 33 0A 3 -12,-2.6 -12,-2.7 -2,-0.5 2,-0.2 -0.979 28.8-118.1-118.4 132.7 -13.9 18.8 -24.0 46 48 A P E -B 32 0A 0 0, 0.0 -14,-0.3 0, 0.0 3,-0.1 -0.480 9.5-153.5 -74.0 139.4 -13.5 15.1 -24.3 47 49 A K S S- 0 0 64 -16,-2.9 2,-0.3 -2,-0.2 -15,-0.2 0.611 79.4 -4.4 -83.1 -13.7 -16.0 13.2 -26.4 48 50 A H S > S- 0 0 12 -17,-0.7 4,-1.8 1,-0.1 334,-0.2 -0.971 82.7 -86.6-165.4 175.8 -15.3 10.1 -24.4 49 51 A S H > S+ 0 0 9 332,-0.7 4,-1.0 -2,-0.3 38,-0.4 0.918 124.3 49.8 -58.4 -44.4 -13.2 8.6 -21.6 50 52 A R H >> S+ 0 0 78 331,-2.1 4,-1.2 1,-0.2 3,-0.9 0.926 109.8 50.4 -64.0 -45.9 -10.5 7.6 -24.0 51 53 A G H 3> S+ 0 0 0 330,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.833 102.9 62.7 -56.4 -34.3 -10.3 11.0 -25.5 52 54 A S H 3X S+ 0 0 2 -4,-1.8 4,-2.4 1,-0.2 -1,-0.2 0.782 98.4 54.7 -66.6 -26.6 -10.1 12.5 -22.0 53 55 A T H < S+ 0 0 0 -4,-1.7 3,-1.6 -5,-0.1 4,-0.4 0.280 80.4 140.6-110.5 7.9 7.9 21.8 -22.3 66 68 A H T 3< S+ 0 0 96 -4,-0.6 -3,-0.1 -3,-0.5 9,-0.1 -0.278 78.8 4.4 -55.1 137.5 6.5 25.3 -21.9 67 69 A N T 3 S+ 0 0 143 1,-0.1 -1,-0.3 6,-0.1 -2,-0.0 0.837 106.0 98.2 41.9 45.7 9.1 27.8 -23.2 68 70 A K < + 0 0 115 -3,-1.6 -2,-0.2 63,-0.0 -1,-0.1 0.371 66.8 83.5-121.0 -5.0 11.5 25.1 -24.4 69 71 A L S S- 0 0 21 -4,-0.4 4,-0.1 2,-0.1 55,-0.1 -0.771 70.3-140.4-112.0 145.1 10.4 25.3 -28.0 70 72 A P S S+ 0 0 40 0, 0.0 54,-0.1 0, 0.0 -1,-0.1 0.444 89.5 56.1 -80.6 -2.6 11.5 27.6 -30.9 71 73 A L S S- 0 0 21 53,-0.1 -2,-0.1 50,-0.0 140,-0.1 -0.956 98.8 -92.8-126.8 150.9 7.9 27.8 -32.2 72 74 A P - 0 0 68 0, 0.0 141,-2.2 0, 0.0 24,-0.0 -0.336 44.9-178.1 -57.8 136.3 4.7 28.9 -30.4 73 75 A I - 0 0 25 139,-0.2 141,-0.2 -4,-0.1 -6,-0.1 -0.927 38.5 -79.2-131.0 158.8 2.7 26.1 -28.8 74 76 A P - 0 0 11 0, 0.0 2,-0.5 0, 0.0 21,-0.1 -0.269 43.1-144.7 -58.5 142.0 -0.6 26.1 -26.9 75 77 A E - 0 0 87 19,-0.1 19,-2.0 -9,-0.1 2,-0.4 -0.921 14.6-122.6-108.7 131.9 -0.3 27.3 -23.3 76 78 A V E +D 93 0A 29 -2,-0.5 17,-0.2 17,-0.2 3,-0.1 -0.577 43.1 154.9 -71.8 127.3 -2.6 25.8 -20.7 77 79 A V E + 0 0 65 15,-3.1 2,-0.4 -2,-0.4 16,-0.2 0.621 64.6 32.9-120.0 -29.2 -4.6 28.5 -18.9 78 80 A F E -D 92 0A 16 14,-2.4 14,-2.8 -63,-0.0 -1,-0.4 -0.989 62.9-172.1-131.6 137.1 -7.6 26.5 -17.7 79 81 A T E -D 91 0A 23 -2,-0.4 12,-0.3 12,-0.2 9,-0.0 -0.977 10.3-146.2-129.1 148.7 -8.0 22.9 -16.5 80 82 A G - 0 0 4 10,-2.8 -1,-0.0 -2,-0.4 11,-0.0 0.051 27.3 -95.6 -88.4-156.2 -11.0 20.7 -15.6 81 83 A X - 0 0 33 373,-0.0 8,-1.2 495,-0.0 2,-0.2 -0.885 29.1-106.5-127.7 154.1 -11.3 18.0 -13.0 82 84 A P + 0 0 33 0, 0.0 2,-0.2 0, 0.0 5,-0.2 -0.510 37.5 176.6 -76.4 148.0 -11.1 14.2 -13.0 83 85 A S - 0 0 25 3,-3.5 494,-0.2 -2,-0.2 493,-0.1 -0.703 50.4 -95.5-129.9-173.4 -14.3 12.1 -12.8 84 86 A E S S+ 0 0 50 492,-0.7 263,-2.1 -2,-0.2 262,-0.8 0.568 129.8 39.1 -76.7 -11.5 -15.0 8.4 -12.8 85 87 A T S S+ 0 0 49 1,-0.3 2,-0.4 261,-0.2 -33,-0.2 0.782 119.8 37.7-105.1 -41.0 -15.7 9.0 -16.5 86 88 A Y - 0 0 59 1,-0.1 -3,-3.5 -5,-0.1 -1,-0.3 -0.940 54.8-152.1-121.9 137.0 -13.0 11.5 -17.6 87 89 A Q S S+ 0 0 50 -38,-0.4 2,-0.3 -2,-0.4 -1,-0.1 0.803 101.8 13.3 -68.8 -26.6 -9.3 11.8 -16.6 88 90 A X - 0 0 10 -39,-0.1 -1,-0.3 -6,-0.1 -32,-0.1 -0.923 67.7-152.2-153.3 125.7 -9.9 15.5 -17.3 89 91 A S S S- 0 0 31 -8,-1.2 2,-0.3 -2,-0.3 -1,-0.1 0.786 73.4 -38.6 -74.5 -29.7 -13.2 17.2 -17.8 90 92 A F - 0 0 0 -45,-0.2 -10,-2.8 -38,-0.1 2,-0.3 -0.953 50.4-144.7-173.0 174.4 -11.8 19.9 -20.1 91 93 A A E -CD 44 79A 0 -47,-1.6 -47,-3.3 -2,-0.3 2,-0.5 -0.969 7.9-146.4-152.9 145.9 -8.9 22.2 -20.7 92 94 A G E -CD 43 78A 0 -14,-2.8 -15,-3.1 -2,-0.3 -14,-2.4 -0.964 20.1-175.1-116.5 123.5 -8.6 25.8 -22.0 93 95 A F E -CD 42 76A 5 -51,-3.3 -51,-2.6 -2,-0.5 -17,-0.2 -0.781 35.6 -93.5-112.3 155.0 -5.5 26.7 -24.0 94 96 A T E -C 41 0A 45 -19,-2.0 2,-0.5 -2,-0.3 -53,-0.2 -0.401 47.5-114.7 -57.4 140.5 -4.4 30.1 -25.4 95 97 A K - 0 0 62 -55,-2.3 2,-0.7 -21,-0.1 -1,-0.1 -0.729 21.6-150.2 -81.6 131.6 -5.6 30.4 -29.0 96 98 A I - 0 0 26 -2,-0.5 2,-0.1 2,-0.1 115,-0.0 -0.904 17.0-138.7 -98.1 113.2 -2.8 30.5 -31.6 97 99 A K + 0 0 113 -2,-0.7 2,-0.2 114,-0.1 105,-0.0 -0.432 55.5 81.7 -72.6 149.1 -4.0 32.6 -34.5 98 100 A G - 0 0 46 -2,-0.1 106,-0.2 104,-0.1 -2,-0.1 -0.764 68.9 -92.4 141.5 171.7 -3.1 31.3 -38.0 99 101 A V E -E 203 0B 60 104,-2.1 104,-4.0 -2,-0.2 112,-0.2 -0.844 45.2 -92.8-119.4 156.6 -4.1 28.8 -40.7 100 102 A P E -E 202 0B 59 0, 0.0 2,-1.8 0, 0.0 102,-0.2 -0.474 34.1-121.0 -71.3 140.0 -3.0 25.2 -41.2 101 103 A L - 0 0 0 100,-3.0 99,-0.1 97,-0.7 101,-0.1 -0.579 41.2-169.0 -77.2 80.5 -0.1 24.7 -43.6 102 104 A T > - 0 0 52 -2,-1.8 4,-2.7 1,-0.1 5,-0.2 -0.212 37.0-110.8 -65.4 158.3 -1.9 22.5 -46.0 103 105 A P H > S+ 0 0 35 0, 0.0 4,-2.3 0, 0.0 5,-0.1 0.930 123.3 52.9 -51.8 -44.2 -0.0 20.6 -48.8 104 106 A L H > S+ 0 0 121 1,-0.2 4,-0.6 2,-0.2 -3,-0.1 0.928 110.5 44.9 -54.2 -53.0 -1.8 23.0 -51.1 105 107 A L H >4 S+ 0 0 51 1,-0.2 3,-1.1 2,-0.2 -1,-0.2 0.920 112.1 52.3 -62.2 -45.2 -0.6 26.1 -49.2 106 108 A L H >< S+ 0 0 0 -4,-2.7 3,-1.8 1,-0.3 -1,-0.2 0.919 106.7 51.5 -57.6 -48.5 3.0 24.8 -48.9 107 109 A N H 3< S+ 0 0 101 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.560 105.3 57.7 -71.4 -8.3 3.5 24.1 -52.6 108 110 A N T << S+ 0 0 128 -3,-1.1 -1,-0.3 -4,-0.6 -2,-0.2 0.330 87.7 103.1 -97.9 3.2 2.3 27.6 -53.5 109 111 A L S < S- 0 0 18 -3,-1.8 5,-0.1 -4,-0.2 -3,-0.0 -0.544 88.7 -86.6 -89.2 151.6 5.0 29.3 -51.4 110 112 A P >> - 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0 0 5 -81,-0.2 3,-2.0 -2,-0.2 4,-0.4 -0.603 42.8-151.4 -81.6 118.9 7.1 2.6 -1.5 521 226 B P T > S+ 0 0 16 0, 0.0 3,-1.1 0, 0.0 4,-0.4 0.769 94.6 70.6 -59.6 -23.2 7.3 -1.0 -0.1 522 227 B D T >> S+ 0 0 11 1,-0.2 4,-2.2 2,-0.2 3,-1.2 0.772 81.1 74.3 -63.2 -25.5 6.3 0.3 3.3 523 228 B N H <> S+ 0 0 29 -3,-2.0 4,-1.7 1,-0.2 -1,-0.2 0.864 90.4 57.1 -52.2 -39.1 2.8 0.9 1.8 524 229 B D H <4 S+ 0 0 0 -3,-1.1 -1,-0.2 -4,-0.4 -2,-0.2 0.683 110.5 42.7 -73.4 -17.4 2.2 -2.9 2.0 525 230 B F H X4 S+ 0 0 0 -3,-1.2 3,-1.4 -4,-0.4 4,-0.4 0.852 111.2 51.9 -88.9 -44.8 2.9 -3.0 5.8 526 231 B I H >X S+ 0 0 12 -4,-2.2 3,-1.3 1,-0.3 4,-0.5 0.834 99.8 64.5 -62.9 -33.8 1.0 0.1 6.8 527 232 B S T 3< S+ 0 0 24 -4,-1.7 -1,-0.3 1,-0.2 -32,-0.2 0.679 105.6 45.9 -61.2 -18.1 -2.1 -1.2 5.0 528 233 B L T <4 S+ 0 0 0 -3,-1.4 8,-1.4 -34,-0.1 7,-1.2 0.490 96.2 77.6 -99.6 -3.1 -2.2 -4.1 7.5 529 234 B X T <4 + 0 0 1 -3,-1.3 8,-0.5 -4,-0.4 -2,-0.2 0.696 59.4 116.8 -84.7 -18.2 -1.6 -2.0 10.6 530 235 B E X - 0 0 49 -4,-0.5 4,-0.8 6,-0.2 6,-0.5 -0.221 52.1-154.7 -55.6 132.5 -5.1 -0.5 11.1 531 236 B D T 4 S+ 0 0 98 2,-0.1 -1,-0.1 4,-0.1 -2,-0.0 0.885 87.3 49.6 -76.2 -42.2 -6.7 -1.6 14.3 532 237 B D T 4 S+ 0 0 147 1,-0.1 -1,-0.1 0, 0.0 -2,-0.0 0.980 131.1 9.7 -60.9 -62.1 -10.3 -1.2 13.3 533 238 B E T 4 S+ 0 0 142 -133,-0.0 -38,-0.2 -134,-0.0 -1,-0.1 0.581 124.7 43.1-101.3 -12.9 -10.4 -3.0 10.0 534 239 B E S < S- 0 0 15 -4,-0.8 -5,-0.1 -135,-0.1 -6,-0.1 -0.192 95.0 -74.1-120.8-152.0 -7.0 -4.8 9.8 535 240 B Y - 0 0 22 -7,-1.2 4,-0.4 1,-0.1 -6,-0.2 0.777 63.0-129.4 -85.8 -29.6 -4.4 -6.8 11.8 536 241 B G > - 0 0 2 -8,-1.4 4,-1.9 -6,-0.5 3,-0.3 -0.038 31.1 -73.8 93.2 160.3 -2.8 -4.2 14.0 537 242 B X H > S+ 0 0 69 -8,-0.5 4,-2.5 1,-0.2 -1,-0.1 0.799 122.2 62.4 -65.1 -31.9 0.8 -3.3 14.7 538 243 B E H > S+ 0 0 136 2,-0.2 4,-0.9 1,-0.2 -1,-0.2 0.938 110.2 37.2 -59.9 -52.5 1.5 -6.3 16.9 539 244 B F H >> S+ 0 0 15 -4,-0.4 4,-1.4 -3,-0.3 3,-0.6 0.890 116.0 54.8 -67.0 -38.1 0.9 -8.9 14.1 540 245 B V H 3X S+ 0 0 0 -4,-1.9 4,-2.6 1,-0.3 -2,-0.2 0.881 99.6 60.4 -66.4 -34.1 2.4 -6.6 11.5 541 246 B S H 3X S+ 0 0 57 -4,-2.5 4,-1.8 1,-0.2 -1,-0.3 0.819 100.2 56.6 -65.2 -28.0 5.6 -6.4 13.5 542 247 B K H S+ 0 0 2 -4,-2.6 5,-2.6 1,-0.2 4,-0.9 0.851 107.0 50.1 -56.2 -40.1 8.4 -7.0 9.6 545 250 B N H ><5S+ 0 0 110 -4,-1.8 3,-0.9 2,-0.2 -1,-0.2 0.961 113.4 44.3 -62.5 -51.9 10.9 -9.2 11.5 546 251 B H H 3<5S+ 0 0 73 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.849 112.8 53.1 -59.0 -34.9 10.5 -12.1 9.0 547 252 B Y H 3<5S- 0 0 44 -4,-2.9 -1,-0.3 -5,-0.2 -2,-0.2 0.720 110.3-129.1 -68.6 -22.4 10.8 -9.5 6.2 548 253 B K T <<5 - 0 0 139 -4,-0.9 -3,-0.2 -3,-0.9 -2,-0.1 0.851 34.9-172.2 69.7 38.3 14.1 -8.3 7.9 549 254 B H < - 0 0 37 -5,-2.6 3,-0.2 1,-0.1 -1,-0.2 -0.397 13.5-162.7 -62.2 138.2 12.9 -4.7 7.9 550 255 B K S S+ 0 0 183 1,-0.2 2,-0.1 -2,-0.1 -1,-0.1 0.583 77.8 40.9-100.2 -15.2 15.7 -2.4 9.0 551 256 B D > + 0 0 70 1,-0.1 4,-1.0 2,-0.1 3,-0.4 -0.536 57.7 159.6-139.3 70.4 13.8 0.8 9.9 552 257 B I H > S+ 0 0 58 -3,-0.2 4,-1.9 1,-0.2 3,-0.3 0.846 73.6 60.5 -63.7 -40.3 10.5 -0.0 11.7 553 258 B P H > S+ 0 0 76 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.890 102.3 55.8 -54.0 -36.4 10.0 3.4 13.3 554 259 B T H > S+ 0 0 13 -3,-0.4 4,-2.1 1,-0.2 -2,-0.2 0.887 104.2 52.2 -62.4 -38.4 9.9 4.8 9.8 555 260 B V H X S+ 0 0 0 -4,-1.0 4,-2.4 -3,-0.3 -1,-0.2 0.905 109.3 50.9 -62.3 -41.2 7.1 2.4 8.9 556 261 B L H X S+ 0 0 68 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.874 108.8 50.0 -65.0 -39.9 5.2 3.7 12.0 557 262 B E H X S+ 0 0 91 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.894 110.6 49.5 -67.3 -39.1 5.6 7.3 11.0 558 263 B K H X S+ 0 0 13 -4,-2.1 4,-2.8 2,-0.2 -2,-0.2 0.912 111.2 50.6 -64.9 -43.5 4.3 6.6 7.5 559 264 B Y H X S+ 0 0 29 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.906 110.0 50.2 -57.1 -45.9 1.4 4.8 9.1 560 265 B R H X S+ 0 0 163 -4,-2.4 4,-1.6 2,-0.2 -2,-0.2 0.938 113.2 44.7 -60.0 -47.4 0.7 7.8 11.3 561 266 B X H X S+ 0 0 14 -4,-2.5 4,-2.8 1,-0.2 -2,-0.2 0.928 111.1 54.5 -65.2 -42.6 0.7 10.3 8.5 562 267 B K H X S+ 0 0 78 -4,-2.8 4,-0.7 1,-0.2 -1,-0.2 0.900 105.5 52.8 -56.7 -42.8 -1.4 8.0 6.3 563 268 B E H < S+ 0 0 65 -4,-2.1 3,-0.4 1,-0.2 4,-0.3 0.872 113.1 43.1 -66.1 -35.6 -4.1 7.8 8.9 564 269 B K H >< S+ 0 0 84 -4,-1.6 3,-1.2 1,-0.2 4,-0.4 0.915 108.4 59.9 -69.8 -40.9 -4.3 11.6 9.2 565 270 B Y H >X S+ 0 0 2 -4,-2.8 4,-1.9 1,-0.3 3,-0.7 0.626 81.0 89.9 -65.0 -11.5 -4.2 11.9 5.4 566 271 B W H 3X S+ 0 0 89 -4,-0.7 4,-2.7 -3,-0.4 -1,-0.3 0.851 78.2 58.9 -57.5 -40.4 -7.3 9.8 5.1 567 272 B S H <> S+ 0 0 17 -3,-1.2 4,-1.4 -4,-0.3 -1,-0.3 0.891 108.1 46.2 -55.4 -43.4 -9.7 12.8 5.3 568 273 B F H <> S+ 0 0 1 -3,-0.7 4,-2.4 -4,-0.4 -1,-0.2 0.881 110.0 54.0 -69.6 -37.5 -8.0 14.3 2.3 569 274 B E H X>S+ 0 0 28 -4,-1.9 4,-3.8 1,-0.2 5,-0.7 0.934 105.9 53.6 -60.3 -43.9 -8.2 11.0 0.4 570 275 B K H X5S+ 0 0 13 -4,-2.7 4,-0.9 1,-0.2 -1,-0.2 0.861 110.8 45.7 -59.2 -38.8 -11.9 10.8 1.1 571 276 B I H X5S+ 0 0 0 -4,-1.4 4,-1.6 3,-0.2 5,-0.3 0.925 122.6 36.4 -69.1 -44.0 -12.5 14.2 -0.4 572 277 B I H X5S+ 0 0 15 -4,-2.4 4,-1.2 2,-0.2 -2,-0.2 0.958 122.7 40.6 -76.4 -54.6 -10.3 13.5 -3.5 573 278 B Y H X5S+ 0 0 65 -4,-3.8 4,-1.6 -5,-0.2 6,-0.3 0.842 120.1 56.5 -60.1 -30.0 -11.1 9.8 -4.0 574 279 B G H <5S+ 0 0 99 -4,-1.6 3,-0.8 1,-0.2 -1,-0.2 0.718 115.7 62.9 -43.1 -30.1 -15.8 13.8 -5.5 576 281 B E H 3<5S+ 0 0 20 -4,-1.2 -492,-0.7 -5,-0.3 -1,-0.2 0.998 107.7 36.6 -53.9 -70.6 -13.8 11.9 -8.2 577 282 B Y T 3<5S- 0 0 19 -4,-1.6 -1,-0.2 -3,-0.5 -2,-0.2 0.148 118.3-111.8 -74.8 20.6 -15.9 8.8 -8.1 578 283 B G T < 5 + 0 0 43 -3,-0.8 2,-1.6 -4,-0.2 -3,-0.2 0.434 67.7 151.4 66.0 -1.9 -19.0 11.0 -7.6 579 284 B Y >< - 0 0 52 -5,-1.2 4,-1.6 -6,-0.3 -1,-0.2 -0.432 23.2-177.6 -65.8 87.2 -19.3 9.6 -4.0 580 285 B X H > S+ 0 0 139 -2,-1.6 4,-2.8 1,-0.2 5,-0.2 0.780 77.0 64.6 -55.9 -27.2 -20.9 12.6 -2.3 581 286 B D H > S+ 0 0 108 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.989 104.0 39.1 -61.2 -65.7 -20.7 10.6 0.9 582 287 B W H > S+ 0 0 77 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.794 117.1 57.1 -56.3 -29.0 -16.9 10.3 1.3 583 288 B Y H X S+ 0 0 15 -4,-1.6 4,-3.5 2,-0.2 5,-0.2 0.984 107.2 42.3 -61.7 -63.2 -16.8 13.9 0.1 584 289 B E H X S+ 0 0 114 -4,-2.8 4,-2.8 2,-0.2 -2,-0.2 0.849 115.6 50.3 -59.7 -38.9 -19.0 15.5 2.7 585 290 B E H X S+ 0 0 88 -4,-2.2 4,-3.4 -5,-0.2 -1,-0.2 0.974 114.5 44.2 -60.4 -55.6 -17.4 13.5 5.5 586 291 B G H X S+ 0 0 0 -4,-2.0 4,-1.0 -5,-0.2 -2,-0.2 0.887 114.4 49.5 -55.1 -44.3 -13.9 14.5 4.3 587 292 B L H < S+ 0 0 33 -4,-3.5 3,-0.4 2,-0.2 -1,-0.2 0.908 113.7 46.4 -63.9 -42.6 -15.0 18.1 3.9 588 293 B N H >< S+ 0 0 110 -4,-2.8 3,-2.3 -5,-0.2 4,-0.3 0.963 107.5 56.5 -59.5 -53.2 -16.5 18.1 7.3 589 294 B E H 3< S+ 0 0 56 -4,-3.4 -1,-0.2 1,-0.3 -2,-0.2 0.703 85.1 84.1 -53.3 -22.7 -13.4 16.5 8.8 590 295 B I T 3< S+ 0 0 13 -4,-1.0 3,-0.5 -3,-0.4 -1,-0.3 0.622 81.0 66.1 -63.6 -8.7 -11.4 19.4 7.4 591 296 B R S < S+ 0 0 184 -3,-2.3 2,-2.0 1,-0.2 -1,-0.2 0.988 98.3 46.8 -69.5 -63.1 -12.4 21.3 10.6 592 297 B S S S+ 0 0 76 -4,-0.3 2,-0.4 -3,-0.2 -1,-0.2 -0.230 79.0 141.6 -83.3 52.1 -10.5 19.2 13.2 593 298 B I 0 0 40 -2,-2.0 -3,-0.0 -3,-0.5 -29,-0.0 -0.792 360.0 360.0 -93.5 134.5 -7.2 19.0 11.3 594 299 B K 0 0 205 -2,-0.4 -1,-0.1 -30,-0.0 -2,-0.0 0.544 360.0 360.0-115.9 360.0 -4.0 19.3 13.4