==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 04-JAN-09 3FP9 . COMPND 2 MOLECULE: PROTEASOME-ASSOCIATED ATPASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR H.LI,T.WANG . 1684 23 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 80334.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1112 66.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 60 3.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 630 37.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 24 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 36 2.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 12 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 . 103 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 166 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 110 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 0.7 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 0 2 0 0 12 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 12 12 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 . 5 19 10 54 22 10 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 0 0 0 0 0 0 0 0 0 0 4 0 0 0 0 0 0 0 0 0 0 0 1 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 98 A P 0 0 53 0, 0.0 2,-0.3 0, 0.0 739,-0.2 0.000 360.0 360.0 360.0 148.2 19.8 -35.4 3.4 2 99 A S E -A 739 0A 21 737,-1.8 737,-1.5 45,-0.1 2,-0.2 -0.760 360.0-149.7-120.6 148.3 16.5 -35.8 5.4 3 100 A G E -AB 738 46A 5 43,-2.3 43,-3.1 -2,-0.3 2,-0.3 -0.672 10.6-131.8-108.8-175.2 15.3 -33.7 8.3 4 101 A Y E + B 0 45A 32 733,-0.6 17,-0.4 41,-0.3 2,-0.3 -0.894 19.8 175.0-134.9 156.2 13.2 -34.6 11.3 5 102 A G E - B 0 44A 6 39,-2.2 39,-2.5 -2,-0.3 2,-0.5 -0.960 34.1-102.7-148.5 176.2 10.3 -33.2 13.2 6 103 A V E -CB 19 43A 7 13,-2.2 13,-3.0 -2,-0.3 2,-0.5 -0.899 35.0-123.0-104.2 130.2 8.0 -34.0 16.0 7 104 A L E +C 18 0A 0 35,-3.6 34,-3.2 -2,-0.5 11,-0.2 -0.561 35.1 170.8 -75.4 118.0 4.5 -35.3 15.1 8 105 A L E - 0 0 17 9,-3.3 2,-0.3 -2,-0.5 10,-0.2 0.838 60.9 -8.2 -93.6 -41.2 1.9 -32.9 16.7 9 106 A A E -C 17 0A 21 8,-1.4 8,-2.3 31,-0.1 -1,-0.4 -0.979 58.8-136.4-160.6 148.6 -1.4 -34.0 15.2 10 107 A T E -C 16 0A 60 -2,-0.3 2,-0.3 6,-0.2 6,-0.2 -0.830 17.1-169.5-110.2 151.9 -2.7 -36.4 12.5 11 108 A H - 0 0 62 4,-1.6 3,-0.5 -2,-0.3 4,-0.2 -0.916 30.8-119.3-133.5 170.7 -5.5 -35.7 10.0 12 109 A D S S+ 0 0 160 -2,-0.3 4,-0.1 1,-0.2 23,-0.0 0.318 98.1 79.4 -97.4 10.2 -7.4 -37.9 7.5 13 110 A D S S- 0 0 73 2,-0.2 -1,-0.2 0, 0.0 3,-0.1 0.044 118.4 -96.1-100.2 25.9 -6.3 -36.1 4.4 14 111 A D S S+ 0 0 102 -3,-0.5 15,-2.3 1,-0.3 2,-0.3 0.764 94.7 113.5 66.1 19.6 -2.9 -37.8 4.4 15 112 A T E - D 0 28A 20 13,-0.2 -4,-1.6 -4,-0.2 2,-0.3 -0.892 45.2-167.9-120.9 154.9 -1.4 -34.7 6.2 16 113 A V E -CD 10 27A 4 11,-2.5 11,-3.3 -2,-0.3 2,-0.5 -0.972 26.2-117.3-131.2 149.7 0.1 -34.3 9.7 17 114 A D E -CD 9 26A 9 -8,-2.3 -9,-3.3 -2,-0.3 -8,-1.4 -0.825 41.1-178.1 -83.0 134.8 1.0 -31.3 11.8 18 115 A V E -CD 7 25A 0 7,-2.9 7,-2.7 -2,-0.5 2,-0.7 -0.978 28.9-137.8-135.2 136.9 4.8 -31.4 12.5 19 116 A F E +CD 6 24A 36 -13,-3.0 -13,-2.2 -2,-0.4 2,-0.3 -0.878 46.6 146.0 -96.8 115.3 7.1 -29.3 14.6 20 117 A T E > + D 0 23A 5 3,-2.8 3,-2.4 -2,-0.7 -15,-0.1 -0.989 53.7 11.9-150.8 150.9 10.3 -28.9 12.5 21 118 A S T 3 S- 0 0 74 -17,-0.4 -1,-0.1 -2,-0.3 -16,-0.1 0.876 132.6 -54.4 44.0 39.4 13.0 -26.2 11.8 22 119 A G T 3 S+ 0 0 61 1,-0.1 2,-0.3 -3,-0.1 -1,-0.3 0.571 120.6 76.9 78.4 10.0 11.6 -24.3 14.7 23 120 A R E < S-D 20 0A 84 -3,-2.4 -3,-2.8 149,-0.0 2,-0.3 -0.992 80.3 -98.5-154.0 163.4 8.0 -24.1 13.6 24 121 A K E +D 19 0A 81 -2,-0.3 131,-0.5 -5,-0.2 2,-0.3 -0.598 44.4 177.3 -79.6 125.3 4.6 -25.8 13.2 25 122 A M E -D 18 0A 11 -7,-2.7 -7,-2.9 -2,-0.3 2,-0.7 -0.979 31.2-134.7-130.4 148.2 4.0 -27.0 9.6 26 123 A R E -DE 17 153A 32 127,-3.1 127,-1.6 -2,-0.3 2,-0.3 -0.916 39.5-176.2-101.9 116.4 1.2 -29.0 8.0 27 124 A L E -D 16 0A 0 -11,-3.3 -11,-2.5 -2,-0.7 2,-0.2 -0.860 23.8-122.9-121.7 146.1 3.0 -31.6 5.9 28 125 A T E -D 15 0A 69 -2,-0.3 24,-2.8 -13,-0.2 2,-0.4 -0.497 26.8-131.4 -81.5 155.1 1.9 -34.3 3.5 29 126 A C B -f 52 0A 16 -15,-2.3 24,-0.2 22,-0.2 22,-0.1 -0.861 14.4-116.8-107.8 143.2 2.8 -38.0 4.0 30 127 A S > - 0 0 16 22,-2.9 3,-2.5 -2,-0.4 -16,-0.0 -0.395 33.8-112.4 -62.1 146.6 4.2 -40.5 1.7 31 128 A P T 3 S+ 0 0 126 0, 0.0 -1,-0.1 0, 0.0 22,-0.1 0.766 115.1 74.1 -59.0 -16.9 1.9 -43.4 0.9 32 129 A N T 3 S+ 0 0 143 2,-0.1 2,-0.6 21,-0.0 21,-0.1 0.664 77.5 96.8 -63.3 -18.3 4.5 -45.5 2.9 33 130 A I < - 0 0 25 -3,-2.5 2,-0.8 19,-0.2 -4,-0.1 -0.718 69.6-147.4 -82.7 120.9 3.2 -43.9 6.1 34 131 A D > - 0 0 95 -2,-0.6 3,-1.9 1,-0.1 4,-0.3 -0.788 7.0-162.3 -83.6 100.1 0.6 -46.0 7.9 35 132 A A T 3 S+ 0 0 70 -2,-0.8 3,-0.2 1,-0.3 -1,-0.1 0.561 86.5 61.2 -68.3 -9.8 -1.8 -43.3 9.5 36 133 A A T 3 S+ 0 0 98 1,-0.2 -1,-0.3 3,-0.0 -2,-0.0 0.376 103.0 50.4 -95.8 2.1 -3.2 -45.9 12.0 37 134 A S S < S+ 0 0 55 -3,-1.9 2,-0.3 2,-0.0 -2,-0.2 0.351 82.3 114.5-117.5 0.1 0.2 -46.4 13.5 38 135 A L - 0 0 23 -4,-0.3 2,-0.4 -3,-0.2 -28,-0.1 -0.554 48.4-160.9 -77.0 135.3 1.1 -42.8 14.1 39 136 A K > - 0 0 102 -2,-0.3 3,-2.0 -30,-0.1 -32,-0.2 -0.970 26.6-109.6-119.4 130.5 1.4 -41.7 17.8 40 137 A K T 3 S+ 0 0 65 -2,-0.4 53,-2.0 1,-0.2 -32,-0.2 -0.318 105.5 28.0 -56.7 134.1 1.3 -38.0 18.8 41 138 A G T 3 S+ 0 0 0 -34,-3.2 18,-0.5 1,-0.3 -1,-0.2 0.163 90.0 133.1 97.6 -15.6 4.8 -36.9 20.0 42 139 A Q < - 0 0 15 -3,-2.0 -35,-3.6 -35,-0.1 -1,-0.3 -0.289 60.3-111.7 -71.3 156.7 6.7 -39.3 17.8 43 140 A T E -B 6 0A 16 14,-2.8 13,-3.3 -37,-0.2 2,-0.3 -0.620 33.6-169.7 -81.8 139.6 9.7 -38.2 15.6 44 141 A V E -BG 5 55A 0 -39,-2.5 -39,-2.2 -2,-0.3 2,-0.4 -0.919 17.1-130.0-127.7 157.3 9.1 -38.3 11.9 45 142 A R E -BG 4 54A 47 9,-2.7 8,-2.6 -2,-0.3 9,-1.4 -0.886 21.3-157.0-112.0 137.5 11.7 -38.0 9.1 46 143 A L E -BG 3 52A 2 -43,-3.1 -43,-2.3 -2,-0.4 6,-0.2 -0.889 8.9-134.4-116.5 144.3 11.1 -35.5 6.3 47 144 A N > - 0 0 54 4,-2.3 3,-2.2 -2,-0.3 -45,-0.1 -0.278 45.2 -86.0 -87.9-175.9 12.6 -35.5 2.8 48 145 A E T 3 S+ 0 0 156 1,-0.3 -1,-0.1 2,-0.1 -46,-0.1 0.823 132.2 54.6 -62.2 -28.6 14.0 -32.3 1.1 49 146 A A T 3 S- 0 0 66 2,-0.1 -1,-0.3 1,-0.0 3,-0.1 0.413 120.1-111.0 -78.9 2.2 10.4 -31.4 -0.1 50 147 A L < + 0 0 53 -3,-2.2 2,-0.4 1,-0.3 -22,-0.1 0.665 67.7 148.5 67.8 20.5 9.2 -31.7 3.6 51 148 A T - 0 0 30 -24,-0.1 -4,-2.3 -22,-0.1 2,-0.7 -0.674 55.9-115.8 -75.7 136.1 7.2 -34.8 2.9 52 149 A V E +fG 29 46A 1 -24,-2.8 -22,-2.9 -2,-0.4 -6,-0.2 -0.646 42.4 169.1 -73.2 116.4 6.9 -37.2 5.9 53 150 A V E + 0 0 30 -8,-2.6 2,-0.3 -2,-0.7 -7,-0.2 0.604 58.5 13.5-108.6 -16.2 8.8 -40.3 4.7 54 151 A E E - G 0 45A 87 -9,-1.4 -9,-2.7 -21,-0.1 2,-0.4 -0.986 59.9-138.9-164.2 149.7 9.1 -42.3 7.8 55 152 A A E + G 0 44A 33 -2,-0.3 -11,-0.2 -11,-0.2 2,-0.0 -0.942 29.8 170.9-120.7 140.1 7.9 -42.4 11.3 56 153 A G - 0 0 38 -13,-3.3 -12,-0.1 -2,-0.4 -1,-0.1 0.029 31.9 -69.2-125.6-146.6 10.1 -43.2 14.3 57 154 A T - 0 0 104 -15,-0.1 -14,-2.8 1,-0.1 2,-0.3 0.258 60.0 -73.6 -97.5-138.6 10.4 -43.3 18.0 58 155 A F - 0 0 55 -16,-0.2 -16,-0.1 -52,-0.1 -1,-0.1 -0.927 46.8 -87.7-128.9 150.6 10.4 -40.5 20.5 59 156 A E - 0 0 49 -18,-0.5 65,-0.1 -2,-0.3 3,-0.1 -0.314 41.0-175.6 -50.8 135.4 12.9 -37.8 21.6 60 157 A A + 0 0 24 1,-0.1 2,-0.3 741,-0.0 -1,-0.1 0.412 58.6 47.1-123.0 -4.3 15.0 -39.4 24.3 61 158 A V S S+ 0 0 25 728,-0.1 2,-0.3 63,-0.0 741,-0.2 -0.930 72.0 76.9-136.4 164.8 17.2 -36.5 25.5 62 159 A G E S-Y 801 0B 9 739,-2.3 739,-2.9 -2,-0.3 64,-0.1 -0.909 74.6 -7.0 134.3-166.3 16.5 -32.9 26.4 63 160 A E E -YZ 800 125B 35 62,-0.6 62,-2.9 -2,-0.3 2,-0.4 -0.285 52.7-142.3 -73.3 146.0 15.2 -30.8 29.2 64 161 A I E + Z 0 124B 7 735,-2.6 735,-0.5 60,-0.2 2,-0.3 -0.937 21.2 176.3-106.8 134.3 13.5 -32.2 32.3 65 162 A S E - Z 0 123B 4 58,-2.4 58,-3.2 -2,-0.4 2,-0.5 -0.925 29.9-112.4-128.9 159.8 10.5 -30.5 34.0 66 163 A T E -AZ 80 122B 57 14,-3.0 14,-2.6 -2,-0.3 2,-0.3 -0.789 27.6-122.4 -95.0 128.9 8.3 -31.4 36.9 67 164 A L E +A 79 0B 4 54,-3.2 53,-3.1 -2,-0.5 12,-0.2 -0.533 29.8 174.3 -62.6 125.5 4.7 -32.4 36.4 68 165 A R E - 0 0 55 10,-3.0 2,-0.3 1,-0.4 11,-0.2 0.876 65.2 -30.5 -91.3 -56.8 2.3 -30.2 38.4 69 166 A E E -A 78 0B 26 9,-1.3 9,-2.9 50,-0.1 -1,-0.4 -0.979 51.9-115.2-159.3 150.1 -1.0 -31.6 37.0 70 167 A I E -A 77 0B 63 -2,-0.3 7,-0.3 7,-0.2 2,-0.0 -0.721 47.4-116.3 -79.7 138.2 -2.5 -33.1 33.9 71 168 A L > - 0 0 14 5,-3.0 3,-2.4 -2,-0.4 5,-0.2 -0.348 29.6 -95.1 -77.9 166.3 -5.2 -30.7 32.7 72 169 A A T 3 S+ 0 0 102 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.774 121.3 62.8 -50.1 -34.0 -8.9 -31.5 32.5 73 170 A D T 3 S- 0 0 71 1,-0.1 -1,-0.3 3,-0.0 -2,-0.0 0.627 100.9-133.8 -70.5 -13.5 -8.7 -32.7 28.8 74 171 A G S < S+ 0 0 29 -3,-2.4 -2,-0.1 2,-0.2 -1,-0.1 0.447 88.5 79.7 80.1 -3.4 -6.3 -35.5 29.8 75 172 A H S S+ 0 0 86 -4,-0.1 16,-3.2 15,-0.0 2,-0.3 0.512 83.7 55.0-114.4 -11.5 -3.9 -34.7 26.9 76 173 A R E - B 0 90B 25 14,-0.3 -5,-3.0 -5,-0.2 2,-0.4 -0.902 63.7-154.2-123.1 155.0 -1.9 -31.6 28.2 77 174 A A E -AB 70 89B 0 12,-2.8 12,-2.4 -2,-0.3 2,-0.6 -0.977 16.5-133.3-130.2 145.1 0.1 -31.1 31.3 78 175 A L E -AB 69 88B 0 -9,-2.9 -10,-3.0 -2,-0.4 -9,-1.3 -0.879 36.9-176.8 -90.5 117.2 1.2 -28.1 33.4 79 176 A V E -AB 67 87B 1 8,-3.1 8,-2.3 -2,-0.6 2,-0.4 -0.887 19.4-144.3-120.9 154.7 4.9 -28.5 34.0 80 177 A V E -AB 66 86B 33 -14,-2.6 -14,-3.0 -2,-0.3 6,-0.2 -0.970 18.2-160.8-126.4 126.7 7.4 -26.5 36.1 81 178 A G > - 0 0 9 4,-3.1 3,-1.7 -2,-0.4 -16,-0.1 -0.171 39.3 -69.5-103.3-170.9 11.0 -26.0 35.0 82 179 A H T 3 S+ 0 0 69 -18,-0.3 716,-0.0 1,-0.3 -17,-0.0 0.867 127.2 39.3 -52.3 -52.6 14.2 -25.0 36.6 83 180 A A T 3 S- 0 0 50 1,-0.1 -1,-0.3 2,-0.0 3,-0.1 -0.051 127.5 -90.6 -90.6 33.4 13.7 -21.4 37.4 84 181 A D S < S+ 0 0 120 -3,-1.7 2,-0.3 1,-0.2 -2,-0.2 0.691 74.1 161.8 65.4 19.9 10.1 -22.1 38.3 85 182 A E - 0 0 36 -5,-0.1 -4,-3.1 149,-0.0 2,-0.4 -0.560 26.5-149.9 -70.4 128.8 9.0 -21.4 34.7 86 183 A E E +B 80 0B 36 129,-0.4 129,-2.2 -2,-0.3 2,-0.3 -0.837 22.7 165.3-104.7 139.1 5.5 -22.9 34.2 87 184 A R E -BC 79 214B 61 -8,-2.3 -8,-3.1 -2,-0.4 2,-0.4 -0.970 33.1-126.4-145.5 162.4 4.3 -24.2 30.8 88 185 A V E +BC 78 213B 0 125,-3.1 125,-2.4 -2,-0.3 2,-0.3 -0.926 32.8 177.1-111.5 132.8 1.6 -26.3 29.2 89 186 A V E -B 77 0B 0 -12,-2.4 -12,-2.8 -2,-0.4 42,-0.3 -0.939 32.1-110.9-129.3 155.8 2.7 -29.2 27.0 90 187 A W E -Bd 76 131B 62 40,-3.3 42,-2.4 -2,-0.3 2,-0.5 -0.603 34.3-124.4 -78.4 151.6 1.0 -32.0 25.1 91 188 A L E - 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