==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 14-SEP-05 2B0Q . COMPND 2 MOLECULE: AMINOGLYCOSIDE 3'-PHOSPHOTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROCOCCUS FAECALIS; . AUTHOR D.H.FONG,A.M.BERGHUIS . 263 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13499.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 181 68.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 41 15.6 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 1.1 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 . 1 0.4 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 . 19 7.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 82 31.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 0 0 0 0 1 2 2 0 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 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 1 0 3 1 1 1 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 2 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 2 A A 0 0 156 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-161.9 47.1 -3.6 -261.4 2 3 A K - 0 0 110 1,-0.1 81,-0.1 44,-0.0 2,-0.1 -0.781 360.0-124.6-164.3-152.5 50.6 -5.0 -262.1 3 4 A M - 0 0 95 79,-0.6 79,-0.1 -2,-0.2 -1,-0.1 -0.221 17.3-127.7-142.1-127.1 54.2 -5.2 -260.8 4 5 A R + 0 0 147 1,-0.3 77,-0.2 -2,-0.1 2,-0.2 -0.147 59.3 18.9-160.0-100.1 57.6 -4.5 -262.2 5 6 A I - 0 0 36 1,-0.1 -1,-0.3 75,-0.1 39,-0.0 -0.592 61.1-117.9-100.0 158.8 60.9 -6.5 -262.3 6 7 A S > - 0 0 6 -2,-0.2 4,-0.8 1,-0.1 5,-0.1 -0.250 33.9-103.3 -82.2 171.6 61.7 -10.2 -262.0 7 8 A P H > S+ 0 0 85 0, 0.0 4,-0.8 0, 0.0 3,-0.3 0.923 119.7 52.4 -62.2 -46.9 64.0 -11.8 -259.3 8 9 A E H >> S+ 0 0 126 1,-0.3 3,-1.8 2,-0.2 4,-1.4 0.963 114.0 41.9 -52.3 -58.7 67.0 -12.2 -261.6 9 10 A L H 3> S+ 0 0 2 1,-0.3 4,-1.5 2,-0.2 -1,-0.3 0.659 107.7 63.2 -65.0 -16.8 66.8 -8.5 -262.6 10 11 A K H 3< S+ 0 0 119 -4,-0.8 4,-0.5 -3,-0.3 -1,-0.3 0.654 100.6 54.6 -81.6 -15.4 66.1 -7.7 -258.9 11 12 A K H XX S+ 0 0 117 -3,-1.8 4,-1.8 -4,-0.8 3,-0.7 0.949 108.8 43.5 -79.3 -56.1 69.6 -9.1 -258.2 12 13 A L H 3X S+ 0 0 54 -4,-1.4 4,-1.7 1,-0.2 -2,-0.2 0.900 112.3 53.4 -56.5 -44.8 71.6 -7.0 -260.6 13 14 A I H 3< S+ 0 0 29 -4,-1.5 -1,-0.2 1,-0.2 5,-0.2 0.784 109.5 49.9 -62.3 -27.6 69.6 -3.8 -259.6 14 15 A E H <4 S+ 0 0 131 -3,-0.7 -1,-0.2 -4,-0.5 -2,-0.2 0.824 107.4 53.8 -78.3 -34.4 70.5 -4.6 -255.9 15 16 A K H < S+ 0 0 162 -4,-1.8 2,-0.3 -3,-0.1 -2,-0.2 0.775 110.9 52.0 -70.5 -29.5 74.2 -5.0 -256.8 16 17 A Y S < S- 0 0 42 -4,-1.7 2,-0.6 -5,-0.2 19,-0.2 -0.831 96.9-109.2-106.9 149.0 74.3 -1.6 -258.5 17 18 A R E -A 34 0A 190 17,-2.3 17,-1.6 -2,-0.3 2,-0.4 -0.662 40.8-141.3 -75.7 120.9 73.1 1.6 -256.8 18 19 A C E -A 33 0A 57 -2,-0.6 2,-0.4 -5,-0.2 15,-0.2 -0.718 20.3-175.0 -94.5 135.4 69.9 2.5 -258.6 19 20 A V E -A 32 0A 61 13,-2.5 13,-2.8 -2,-0.4 2,-0.6 -0.990 24.3-126.7-125.6 131.0 68.8 6.1 -259.5 20 21 A K E -A 31 0A 127 -2,-0.4 11,-0.2 11,-0.2 13,-0.0 -0.689 23.8-134.6 -86.6 116.9 65.5 7.0 -261.1 21 22 A D - 0 0 50 9,-2.8 9,-0.2 -2,-0.6 -1,-0.1 0.009 20.7-175.9 -57.8 166.2 65.6 9.0 -264.3 22 23 A T + 0 0 139 7,-0.1 -1,-0.1 9,-0.0 3,-0.1 0.035 66.1 88.2-154.1 21.4 63.4 12.1 -264.9 23 24 A E + 0 0 101 1,-0.1 2,-0.8 7,-0.1 -2,-0.0 0.267 65.1 93.0-106.5 5.3 64.4 12.9 -268.5 24 25 A G + 0 0 29 1,-0.1 4,-0.1 6,-0.1 -1,-0.1 -0.682 46.0 180.0-109.0 83.6 61.9 10.6 -270.1 25 26 A M + 0 0 159 -2,-0.8 -1,-0.1 2,-0.1 -2,-0.0 0.515 61.8 94.9 -55.0 -2.9 58.6 12.4 -270.9 26 27 A S S S- 0 0 50 2,-0.1 -2,-0.1 1,-0.1 28,-0.0 -0.124 96.6 -99.3 -84.9-178.9 57.4 9.1 -272.2 27 28 A P S S+ 0 0 30 0, 0.0 19,-0.5 0, 0.0 2,-0.2 0.335 92.8 102.9 -82.1 6.6 55.4 6.3 -270.6 28 29 A A - 0 0 10 17,-0.1 2,-0.5 -4,-0.1 17,-0.2 -0.616 69.5-133.7 -93.4 153.2 58.6 4.4 -269.9 29 30 A K E - B 0 44A 87 15,-2.4 15,-2.2 -2,-0.2 2,-0.5 -0.893 22.7-162.5-104.4 131.7 60.4 4.2 -266.6 30 31 A V E + B 0 43A 29 -2,-0.5 -9,-2.8 13,-0.2 2,-0.4 -0.963 9.9 179.1-124.0 124.6 64.1 4.8 -266.8 31 32 A Y E -AB 20 42A 56 11,-3.0 11,-2.9 -2,-0.5 2,-0.4 -0.974 20.3-144.2-127.8 138.4 66.7 3.8 -264.2 32 33 A K E -AB 19 41A 73 -13,-2.8 -13,-2.5 -2,-0.4 2,-0.8 -0.816 12.2-149.7 -94.3 132.8 70.4 4.3 -264.1 33 34 A L E -AB 18 40A 0 7,-3.9 7,-1.2 -2,-0.4 -15,-0.2 -0.684 14.7-154.0-106.7 77.6 72.2 1.4 -262.4 34 35 A V E +AB 17 39A 49 -17,-1.6 -17,-2.3 -2,-0.8 2,-0.3 -0.278 23.9 177.1 -51.6 120.9 75.3 3.1 -261.0 35 36 A G - 0 0 20 3,-1.4 -19,-0.1 -19,-0.2 -1,-0.0 -0.846 42.4-123.1-130.5 166.9 78.0 0.5 -260.7 36 37 A E S S+ 0 0 195 -2,-0.3 -1,-0.1 1,-0.2 3,-0.1 0.930 115.0 32.4 -71.6 -47.3 81.7 0.1 -259.6 37 38 A N S S- 0 0 128 1,-0.1 2,-0.3 -3,-0.1 -1,-0.2 0.639 137.8 -42.2 -84.0 -16.9 82.9 -1.3 -262.9 38 39 A E - 0 0 79 -5,-0.1 -3,-1.4 2,-0.0 2,-0.3 -0.933 63.0 -89.9-179.9-161.3 80.4 0.6 -265.0 39 40 A N E -B 34 0A 33 -2,-0.3 52,-1.2 -5,-0.2 2,-0.3 -0.981 29.6-160.4-138.6 146.6 76.8 1.8 -265.2 40 41 A L E -BC 33 90A 11 -7,-1.2 -7,-3.9 -2,-0.3 2,-0.4 -0.835 10.7-135.6-123.5 163.8 73.8 -0.0 -266.7 41 42 A Y E -BC 32 89A 65 48,-3.2 48,-2.9 -2,-0.3 2,-0.4 -0.984 11.2-165.6-128.8 129.4 70.4 1.3 -267.8 42 43 A L E -BC 31 88A 2 -11,-2.9 -11,-3.0 -2,-0.4 2,-0.4 -0.884 7.7-178.8-109.6 140.0 67.1 -0.2 -267.2 43 44 A K E -BC 30 87A 20 44,-1.9 44,-2.8 -2,-0.4 2,-0.4 -0.995 4.5-173.8-139.7 132.7 63.9 0.9 -269.1 44 45 A M E -BC 29 86A 3 -15,-2.2 -15,-2.4 -2,-0.4 2,-0.4 -0.983 10.4-171.4-134.6 138.0 60.4 -0.5 -268.6 45 46 A T E - C 0 85A 1 40,-2.0 40,-2.7 -2,-0.4 -17,-0.1 -0.986 24.4-125.5-126.4 137.2 57.0 -0.1 -270.3 46 47 A D E > - C 0 84A 16 -19,-0.5 3,-1.8 -2,-0.4 4,-0.3 -0.361 33.1 -98.5 -77.8 161.3 53.7 -1.4 -269.0 47 48 A S G > S+ 0 0 53 36,-2.4 3,-2.9 1,-0.3 37,-0.1 0.785 109.3 79.5 -44.6 -44.5 51.4 -3.6 -271.0 48 49 A R G 3 S+ 0 0 142 1,-0.3 -1,-0.3 35,-0.2 102,-0.1 0.792 101.9 40.3 -39.5 -34.0 49.0 -0.8 -272.1 49 50 A Y G X S+ 0 0 19 -3,-1.8 3,-2.6 -22,-0.1 6,-0.6 0.488 81.1 137.9 -99.1 -2.8 51.6 0.1 -274.7 50 51 A K T < S+ 0 0 100 -3,-2.9 3,-0.1 1,-0.3 -4,-0.0 0.016 77.4 15.4 -39.9 147.7 52.7 -3.4 -275.9 51 52 A G T 3 S+ 0 0 61 1,-0.2 -1,-0.3 2,-0.0 2,-0.1 0.404 106.5 109.6 64.7 -6.4 53.1 -3.6 -279.7 52 53 A T S X S- 0 0 3 -3,-2.6 3,-0.6 1,-0.1 6,-0.2 -0.346 90.2-100.5 -88.8 175.3 53.0 0.2 -279.8 53 54 A T T 3 S+ 0 0 4 1,-0.2 158,-0.1 -2,-0.1 -3,-0.1 0.277 122.4 59.7 -83.5 14.0 56.2 2.2 -280.6 54 55 A Y T 3 S+ 0 0 27 -5,-0.4 2,-0.3 155,-0.1 -1,-0.2 0.619 76.5 109.2-105.6 -24.3 56.7 2.9 -277.0 55 56 A D X> - 0 0 8 -6,-0.6 3,-2.0 -3,-0.6 4,-1.4 -0.359 62.5-151.6 -55.9 113.7 56.9 -0.8 -276.1 56 57 A V H 3> S+ 0 0 0 1,-0.3 4,-3.6 -2,-0.3 5,-0.3 0.756 92.6 76.2 -61.4 -22.9 60.6 -1.4 -275.2 57 58 A E H 3> S+ 0 0 24 1,-0.2 4,-1.1 2,-0.2 -1,-0.3 0.869 104.9 37.4 -53.7 -34.2 60.0 -5.0 -276.5 58 59 A R H <> S+ 0 0 24 -3,-2.0 4,-2.4 -6,-0.2 -1,-0.2 0.830 110.9 57.0 -85.4 -38.7 60.3 -3.2 -279.9 59 60 A E H X S+ 0 0 3 -4,-1.4 4,-1.9 1,-0.2 -2,-0.2 0.875 108.4 51.8 -60.4 -34.7 62.9 -0.8 -278.9 60 61 A K H X S+ 0 0 26 -4,-3.6 4,-2.4 2,-0.2 -1,-0.2 0.909 105.4 52.0 -68.0 -46.7 65.0 -3.9 -278.0 61 62 A D H X S+ 0 0 42 -4,-1.1 4,-2.2 -5,-0.3 3,-0.3 0.966 114.4 44.2 -54.6 -51.8 64.5 -5.6 -281.3 62 63 A M H X S+ 0 0 0 -4,-2.4 4,-1.1 1,-0.2 -1,-0.2 0.843 110.3 54.8 -61.6 -35.6 65.6 -2.4 -283.1 63 64 A M H < S+ 0 0 0 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.853 109.3 48.5 -67.2 -34.2 68.5 -2.0 -280.6 64 65 A L H >< S+ 0 0 74 -4,-2.4 3,-1.4 -3,-0.3 -2,-0.2 0.913 107.9 55.6 -69.7 -43.1 69.7 -5.5 -281.5 65 66 A W H 3< S+ 0 0 32 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.687 97.6 62.7 -64.0 -23.1 69.4 -4.9 -285.2 66 67 A L T >X + 0 0 0 -4,-1.1 3,-2.6 -3,-0.2 4,-2.1 0.414 69.5 130.2 -87.3 4.1 71.7 -1.8 -285.2 67 68 A E T <4 S+ 0 0 82 -3,-1.4 -3,-0.0 1,-0.3 7,-0.0 -0.333 85.2 4.9 -57.7 134.3 74.7 -3.8 -284.0 68 69 A G T 34 S+ 0 0 92 2,-0.3 -1,-0.3 1,-0.1 -2,-0.1 0.688 126.8 73.5 62.9 16.2 77.6 -2.9 -286.3 69 70 A K T <4 S+ 0 0 71 -3,-2.6 -2,-0.2 1,-0.6 -1,-0.1 0.655 105.0 2.6-120.7 -58.0 75.4 -0.4 -288.0 70 71 A L S < S- 0 0 14 -4,-2.1 2,-1.3 135,-0.0 -1,-0.6 -0.857 84.6 -93.4-128.6 162.7 75.0 2.6 -285.7 71 72 A P + 0 0 50 0, 0.0 134,-1.9 0, 0.0 -4,-0.1 -0.673 66.2 151.3 -79.8 94.4 76.4 3.4 -282.2 72 73 A V - 0 0 27 -2,-1.3 134,-0.1 132,-0.2 -4,-0.1 -0.833 49.0 -87.7-122.8 163.0 73.7 2.0 -280.0 73 74 A P - 0 0 6 0, 0.0 2,-0.6 0, 0.0 -1,-0.1 -0.112 46.8-103.7 -62.7 168.4 73.7 0.5 -276.5 74 75 A K - 0 0 93 -7,-0.0 16,-1.3 1,-0.0 2,-0.8 -0.869 27.5-124.7-101.1 123.1 74.3 -3.2 -276.0 75 76 A V E +D 89 0A 17 -2,-0.6 14,-0.2 14,-0.2 3,-0.1 -0.530 39.2 166.5 -66.3 104.4 71.2 -5.3 -275.2 76 77 A L E - 0 0 81 12,-1.9 2,-0.4 -2,-0.8 13,-0.2 0.944 61.0 -1.5 -86.5 -58.4 72.2 -7.1 -271.9 77 78 A H E -D 88 0A 52 11,-1.7 11,-3.9 2,-0.0 2,-0.4 -0.997 59.3-177.4-138.8 140.6 68.9 -8.5 -270.6 78 79 A F E +D 87 0A 43 -2,-0.4 2,-0.3 9,-0.2 9,-0.2 -0.998 12.8 156.1-137.3 146.6 65.3 -8.4 -271.8 79 80 A E E -D 86 0A 21 7,-2.1 7,-3.0 -2,-0.4 2,-0.6 -0.996 39.5-132.9-163.2 161.7 62.1 -9.8 -270.4 80 81 A R E +D 85 0A 167 -2,-0.3 2,-0.5 5,-0.2 5,-0.2 -0.934 37.3 169.7-120.7 99.2 58.3 -9.6 -270.1 81 82 A H - 0 0 44 3,-1.9 -78,-0.2 -2,-0.6 -2,-0.0 -0.930 65.3 -18.4-123.8 111.1 57.5 -9.8 -266.4 82 83 A D S S- 0 0 81 -2,-0.5 -79,-0.6 1,-0.2 -35,-0.2 0.819 128.8 -47.0 67.8 38.6 53.9 -9.1 -265.2 83 84 A G S S+ 0 0 21 1,-0.3 -36,-2.4 -81,-0.1 2,-0.4 0.916 115.8 117.0 71.7 41.5 52.8 -7.4 -268.3 84 85 A W E -C 46 0A 13 -38,-0.2 -3,-1.9 -37,-0.1 2,-0.8 -0.992 60.4-141.1-142.7 132.2 55.9 -5.2 -268.4 85 86 A S E -CD 45 80A 1 -40,-2.7 -40,-2.0 -2,-0.4 2,-0.5 -0.860 27.1-170.9 -95.5 112.9 58.6 -5.1 -271.1 86 87 A N E -CD 44 79A 0 -7,-3.0 -7,-2.1 -2,-0.8 2,-0.5 -0.927 6.3-170.6-111.4 126.4 61.9 -4.7 -269.2 87 88 A L E -CD 43 78A 0 -44,-2.8 -44,-1.9 -2,-0.5 2,-0.5 -0.961 7.5-163.8-119.7 125.9 65.2 -3.9 -270.9 88 89 A L E +CD 42 77A 4 -11,-3.9 -12,-1.9 -2,-0.5 -11,-1.7 -0.918 25.4 167.1-103.9 127.5 68.6 -4.0 -269.3 89 90 A M E -CD 41 75A 14 -48,-2.9 -48,-3.2 -2,-0.5 -14,-0.2 -0.889 35.0 -99.5-138.7 169.3 71.2 -2.2 -271.4 90 91 A S E -C 40 0A 32 -16,-1.3 2,-0.4 -2,-0.3 -50,-0.2 -0.517 49.6 -90.3 -86.7 156.9 74.8 -0.8 -271.2 91 92 A E - 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