==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-AUG-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 28-AUG-12 4GSU . COMPND 2 MOLECULE: PROBABLE CONSERVED LIPOPROTEIN LPPS; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR H.S.KIM,J.KIM,H.N.IM,J.Y.YOON,D.R.AN,H.J.YOON,J.Y.KIM,H.K.MI . 538 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22517.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 364 67.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 47 8.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 136 25.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 6 1.1 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 . 61 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 45 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 39 7.2 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+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 3 1 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 7 3 3 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 PARALLEL BRIDGES PER LADDER . 4 2 0 6 1 7 4 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 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 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 1 141 A L 0 0 105 0, 0.0 430,-2.6 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 138.9 9.8 -2.4 6.1 2 142 A T B -a 431 0A 49 428,-0.2 430,-0.2 430,-0.0 2,-0.1 -0.929 360.0-122.1-107.5 122.4 6.3 -3.6 5.2 3 143 A F - 0 0 5 428,-2.9 2,-0.5 -2,-0.5 430,-0.5 -0.343 21.5-156.9 -64.6 137.2 5.1 -2.6 1.7 4 144 A Q - 0 0 22 96,-0.1 86,-0.1 -2,-0.1 457,-0.1 -0.974 15.2-129.1-115.7 123.3 1.9 -0.6 1.4 5 145 A T + 0 0 22 -2,-0.5 2,-0.3 431,-0.1 455,-0.2 -0.366 39.1 173.2 -60.2 148.4 -0.2 -0.6 -1.8 6 146 A S - 0 0 31 453,-1.5 5,-0.1 512,-0.1 455,-0.0 -0.974 31.1-149.9-157.1 166.7 -1.1 2.9 -3.1 7 147 A S > - 0 0 44 -2,-0.3 3,-2.1 453,-0.1 512,-0.1 -0.989 31.0-123.2-139.4 138.5 -2.6 5.1 -5.8 8 148 A P T 3 S+ 0 0 9 0, 0.0 3,-0.5 0, 0.0 510,-0.1 0.738 113.0 56.4 -57.3 -22.1 -1.6 8.8 -6.6 9 149 A A T 3 S+ 0 0 62 1,-0.2 325,-0.0 508,-0.2 324,-0.0 0.591 110.9 42.8 -81.5 -9.0 -5.2 9.9 -6.0 10 150 A H S < S+ 0 0 94 -3,-2.1 88,-2.2 87,-0.1 2,-0.3 0.008 94.4 94.0-127.6 25.3 -5.2 8.5 -2.4 11 151 A L E -f 98 0B 7 -3,-0.5 2,-0.4 86,-0.2 88,-0.2 -0.918 46.2-169.9-123.5 145.8 -1.8 9.5 -1.0 12 152 A T E -f 99 0B 0 86,-1.9 88,-2.2 -2,-0.3 89,-0.4 -1.000 11.7-147.4-137.3 136.2 -0.7 12.5 1.1 13 153 A M - 0 0 30 -2,-0.4 22,-1.4 86,-0.2 2,-0.3 -0.834 11.7-135.2-104.5 136.9 2.8 13.5 1.9 14 154 A P E -H 34 0C 2 0, 0.0 2,-0.4 0, 0.0 20,-0.2 -0.682 11.9-160.1 -88.0 148.0 3.9 15.2 5.1 15 155 A Y E -H 33 0C 42 18,-2.0 18,-3.1 -2,-0.3 2,-0.4 -0.997 11.9-154.3-125.3 123.9 6.3 18.2 5.0 16 156 A V E -H 32 0C 27 -2,-0.4 16,-0.2 16,-0.2 4,-0.1 -0.788 10.9-126.6-104.4 140.3 8.1 18.9 8.2 17 157 A M E S+H 31 0C 82 14,-2.9 14,-2.8 -2,-0.4 2,-0.2 -0.966 76.2 40.5-127.6 153.1 9.5 22.2 9.5 18 158 A P S S- 0 0 0 0, 0.0 3,-0.1 0, 0.0 13,-0.1 0.629 94.4-105.4 -79.5 176.0 12.0 23.4 10.4 19 159 A G > - 0 0 19 -2,-0.2 3,-1.9 1,-0.1 -2,-0.1 -0.183 40.2 -85.4 -65.6 154.5 14.6 21.7 8.2 20 160 A D T 3 S+ 0 0 116 1,-0.3 87,-0.2 -4,-0.1 -1,-0.1 -0.363 114.9 12.7 -57.8 131.0 16.9 18.9 9.2 21 161 A G T 3 S+ 0 0 56 85,-3.0 -1,-0.3 1,-0.2 86,-0.2 0.308 93.4 141.4 80.9 -6.6 20.1 20.3 10.8 22 162 A E < - 0 0 79 -3,-1.9 86,-2.2 84,-0.4 2,-0.5 -0.291 46.5-141.8 -71.4 150.9 18.7 23.9 11.2 23 163 A V E -k 108 0D 83 84,-0.2 2,-0.3 86,-0.1 86,-0.2 -0.970 32.5-180.0-104.9 123.7 19.4 26.0 14.3 24 164 A V E -k 109 0D 1 84,-2.9 86,-3.4 -2,-0.5 208,-0.2 -0.804 26.7 -92.9-123.9 169.3 16.2 28.0 15.2 25 165 A G > - 0 0 0 206,-2.4 3,-1.5 -2,-0.3 208,-0.2 -0.147 43.4 -97.6 -75.1 173.5 14.9 30.5 17.8 26 166 A V T 3 S+ 0 0 0 85,-0.4 50,-2.6 1,-0.3 207,-0.2 0.526 118.7 57.2 -74.7 -6.6 13.1 29.7 21.1 27 167 A G T 3 S+ 0 0 0 205,-2.4 -1,-0.3 48,-0.2 205,-0.1 0.438 74.9 122.2-103.4 1.8 9.7 30.3 19.6 28 168 A E < - 0 0 12 -3,-1.5 2,-0.2 204,-0.2 -4,-0.1 -0.497 45.9-158.3 -72.6 114.7 9.9 27.8 16.8 29 169 A P - 0 0 6 0, 0.0 2,-0.4 0, 0.0 42,-0.2 -0.529 26.4-107.9 -79.9 160.3 7.1 25.2 16.8 30 170 A V E - I 0 70C 0 40,-2.4 40,-2.0 -2,-0.2 2,-0.4 -0.763 41.8-162.6 -76.7 132.2 7.5 21.9 15.1 31 171 A A E -HI 17 69C 7 -14,-2.8 -14,-2.9 -2,-0.4 2,-0.5 -0.982 17.8-173.7-126.5 130.8 5.2 22.0 12.0 32 172 A I E -HI 16 68C 0 36,-2.6 36,-2.4 -2,-0.4 2,-0.5 -0.980 11.5-174.7-121.0 115.2 3.9 19.1 10.0 33 173 A R E -HI 15 67C 30 -18,-3.1 -18,-2.0 -2,-0.5 34,-0.2 -0.948 9.8-152.4-116.0 126.2 2.0 20.2 6.9 34 174 A F E -H 14 0C 0 32,-3.0 4,-0.1 -2,-0.5 -22,-0.0 -0.624 21.2-127.6 -95.7 154.6 0.3 17.7 4.7 35 175 A D S S+ 0 0 0 -22,-1.4 2,-0.3 -2,-0.2 271,-0.2 0.443 94.2 40.1 -83.8 2.8 -0.3 18.2 1.0 36 176 A E S S- 0 0 42 -23,-0.2 -2,-0.2 30,-0.1 2,-0.1 -0.975 99.3 -89.1-139.4 154.2 -4.1 17.4 1.5 37 177 A N - 0 0 104 -2,-0.3 2,-0.5 1,-0.1 29,-0.2 -0.413 46.0-134.4 -56.9 136.2 -6.7 18.1 4.1 38 178 A I - 0 0 3 27,-2.2 3,-0.2 1,-0.2 56,-0.1 -0.866 21.1-173.0-102.3 126.2 -6.6 15.4 6.8 39 179 A A S S+ 0 0 13 54,-1.0 2,-1.3 -2,-0.5 55,-0.2 0.896 81.9 50.8 -83.6 -44.4 -9.8 13.8 8.0 40 180 A D > + 0 0 49 53,-2.5 4,-1.5 1,-0.2 -1,-0.2 -0.660 63.0 164.6 -96.9 83.8 -8.4 11.7 10.8 41 181 A R H > S+ 0 0 33 226,-1.3 4,-2.0 -2,-1.3 227,-0.3 0.852 73.8 58.3 -69.1 -33.8 -6.4 14.2 12.7 42 182 A G H > S+ 0 0 3 225,-2.1 4,-2.1 -3,-0.2 -1,-0.2 0.905 104.9 51.5 -59.1 -42.0 -6.1 12.0 15.7 43 183 A A H > S+ 0 0 21 224,-0.3 4,-1.2 1,-0.2 -2,-0.2 0.896 108.2 51.6 -64.6 -39.3 -4.5 9.3 13.6 44 184 A A H < S+ 0 0 0 -4,-1.5 4,-0.4 1,-0.2 3,-0.3 0.911 110.2 48.6 -60.8 -43.7 -1.9 11.8 12.2 45 185 A E H >< S+ 0 0 28 -4,-2.0 3,-1.6 1,-0.2 -2,-0.2 0.903 108.0 53.4 -63.2 -44.5 -1.0 12.9 15.7 46 186 A K H 3< S+ 0 0 158 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.757 105.4 57.1 -62.6 -27.6 -0.5 9.3 16.9 47 187 A A T 3< S+ 0 0 13 -4,-1.2 40,-2.3 -3,-0.3 2,-0.5 0.572 93.7 80.6 -78.1 -12.7 1.8 8.8 13.9 48 188 A I E < -L 86 0D 11 -3,-1.6 2,-0.5 -4,-0.4 38,-0.2 -0.861 58.5-168.3-108.3 128.2 4.1 11.6 15.0 49 189 A K E -L 85 0D 131 36,-2.6 36,-2.5 -2,-0.5 2,-0.5 -0.962 3.3-173.9-120.8 118.8 6.8 11.1 17.6 50 190 A I E -L 84 0D 23 -2,-0.5 2,-0.4 34,-0.2 34,-0.2 -0.956 3.3-178.1-116.3 127.6 8.6 14.1 19.0 51 191 A T E -L 83 0D 60 32,-2.4 32,-2.9 -2,-0.5 2,-0.3 -0.965 5.4-165.3-124.9 143.6 11.5 13.7 21.4 52 192 A T E -L 82 0D 21 -2,-0.4 30,-0.2 30,-0.2 28,-0.0 -0.932 15.2-128.9-130.4 152.6 13.5 16.5 23.1 53 193 A N E S+L 81 0D 108 28,-2.2 28,-3.2 1,-0.3 -2,-0.0 -0.922 108.6 31.3-147.0 111.5 16.8 16.7 25.0 54 194 A P S S- 0 0 58 0, 0.0 -1,-0.3 0, 0.0 23,-0.1 0.578 117.7-120.5 -60.7 144.7 16.6 18.1 27.7 55 195 A P + 0 0 112 0, 0.0 2,-0.3 0, 0.0 -2,-0.1 -0.408 37.7 177.9 -71.4 137.8 13.0 16.7 27.7 56 196 A V - 0 0 65 -2,-0.1 2,-0.2 -3,-0.0 -4,-0.1 -0.992 33.2-106.8-139.5 143.8 10.2 19.1 27.9 57 197 A E + 0 0 124 -2,-0.3 16,-0.6 2,-0.0 2,-0.3 -0.471 48.0 165.0 -66.4 134.4 6.4 18.5 27.9 58 198 A G E -J 72 0C 22 14,-0.2 2,-0.3 -2,-0.2 -8,-0.0 -0.919 18.3-155.5-143.0 176.4 4.7 19.6 24.6 59 199 A A E -J 71 0C 13 12,-1.8 12,-1.7 -2,-0.3 2,-0.3 -0.990 18.7-111.5-154.6 158.6 1.4 19.1 22.8 60 200 A F E +J 70 0C 29 -2,-0.3 2,-0.3 10,-0.2 10,-0.2 -0.686 28.5 175.3 -93.1 141.4 -0.1 19.2 19.3 61 201 A Y E -J 69 0C 37 8,-2.6 8,-2.8 -2,-0.3 2,-0.5 -0.984 25.8-129.1-143.9 135.7 -2.6 21.7 18.0 62 202 A W E -J 68 0C 6 -2,-0.3 6,-0.2 6,-0.2 3,-0.1 -0.736 12.0-168.7 -87.5 121.0 -4.0 22.0 14.5 63 203 A L S S- 0 0 12 4,-1.9 2,-0.2 -2,-0.5 -1,-0.1 0.818 77.3 -28.9 -68.1 -36.1 -3.8 25.4 12.7 64 204 A N S S- 0 0 71 3,-1.2 3,-0.5 0, 0.0 -1,-0.2 -0.883 85.8 -70.3-164.0-173.6 -6.2 24.1 10.0 65 205 A N S S+ 0 0 68 -2,-0.2 -27,-2.2 1,-0.2 3,-0.1 0.585 128.7 44.0 -71.5 -12.8 -7.0 20.8 8.4 66 206 A R S S+ 0 0 29 -29,-0.2 -32,-3.0 1,-0.2 2,-0.4 0.603 109.2 54.1 -98.7 -21.7 -3.6 20.6 6.7 67 207 A E E -I 33 0C 8 -3,-0.5 -4,-1.9 -34,-0.2 -3,-1.2 -0.973 53.2-172.5-134.3 125.3 -1.2 21.6 9.3 68 208 A V E -IJ 32 62C 0 -36,-2.4 -36,-2.6 -2,-0.4 2,-0.3 -0.862 10.5-159.3-113.0 145.5 -0.4 20.5 12.9 69 209 A R E -IJ 31 61C 7 -8,-2.8 -8,-2.6 -2,-0.3 2,-0.4 -0.912 3.8-162.6-122.2 150.9 2.0 22.2 15.3 70 210 A W E +IJ 30 60C 22 -40,-2.0 -40,-2.4 -2,-0.3 -10,-0.2 -0.999 22.3 148.4-132.4 130.0 3.8 21.0 18.4 71 211 A R E - J 0 59C 4 -12,-1.7 -12,-1.8 -2,-0.4 4,-0.1 -0.985 41.3-107.3-147.8 164.2 5.3 23.2 21.1 72 212 A P E - J 0 58C 3 0, 0.0 -14,-0.2 0, 0.0 4,-0.1 -0.282 42.2-101.8 -77.4 178.2 6.1 23.3 24.8 73 213 A E S S+ 0 0 87 -16,-0.6 2,-0.3 2,-0.1 185,-0.1 0.850 105.6 29.5 -66.9 -38.1 4.2 25.6 27.3 74 214 A H S S- 0 0 132 1,-0.2 3,-0.1 184,-0.0 180,-0.0 -0.785 107.6 -69.3-120.7 165.4 7.0 28.1 27.3 75 215 A F - 0 0 59 -2,-0.3 -48,-0.2 1,-0.1 -1,-0.2 -0.115 67.1 -88.7 -52.0 150.3 9.7 29.2 24.9 76 216 A W - 0 0 6 -50,-2.6 -1,-0.1 1,-0.1 -50,-0.1 -0.252 38.6-113.5 -59.8 147.2 12.3 26.5 24.2 77 217 A K > - 0 0 141 -23,-0.1 3,-1.8 -3,-0.1 32,-0.2 -0.714 42.1-103.7 -78.2 129.4 15.4 26.5 26.4 78 218 A P T 3 S+ 0 0 49 0, 0.0 32,-0.2 0, 0.0 33,-0.1 -0.232 106.5 31.9 -52.2 142.3 18.5 27.4 24.3 79 219 A G T 3 S+ 0 0 60 30,-2.5 31,-0.1 1,-0.3 32,-0.1 0.190 83.2 144.9 94.2 -15.7 20.6 24.4 23.4 80 220 A T < - 0 0 4 -3,-1.8 29,-2.1 30,-0.2 2,-0.4 -0.259 40.3-144.9 -60.7 134.3 17.7 21.9 23.2 81 221 A A E -LM 53 108D 22 -28,-3.2 -28,-2.2 27,-0.2 2,-0.4 -0.876 15.0-164.1 -99.7 137.3 17.9 19.2 20.6 82 222 A V E -LM 52 107D 0 25,-3.0 25,-2.4 -2,-0.4 2,-0.4 -0.980 6.7-167.5-125.5 132.4 14.6 18.1 19.0 83 223 A D E -LM 51 106D 67 -32,-2.9 -32,-2.4 -2,-0.4 2,-0.5 -0.966 4.2-167.9-119.0 134.4 13.9 14.9 16.9 84 224 A V E -LM 50 105D 4 21,-3.1 21,-2.3 -2,-0.4 2,-0.6 -0.984 5.8-175.9-127.8 122.6 10.8 14.5 14.9 85 225 A A E -LM 49 104D 15 -36,-2.5 -36,-2.6 -2,-0.5 2,-0.9 -0.965 5.5-168.2-117.9 113.0 9.8 11.2 13.4 86 226 A V E -LM 48 103D 0 17,-3.4 17,-1.9 -2,-0.6 2,-1.3 -0.851 5.8-175.4-103.4 98.7 6.7 11.4 11.2 87 227 A N E + M 0 102D 72 -40,-2.3 15,-0.2 -2,-0.9 12,-0.1 -0.471 32.9 134.2 -98.0 64.0 5.8 7.7 10.7 88 228 A T > + 0 0 0 -2,-1.3 3,-2.7 13,-0.5 11,-0.4 0.547 20.2 131.4 -93.3 -9.0 2.9 8.2 8.3 89 229 A Y T 3 S- 0 0 53 1,-0.3 11,-0.2 -3,-0.3 3,-0.1 -0.199 90.2 -8.0 -51.8 120.2 3.8 5.5 5.7 90 230 A G T 3 S+ 0 0 17 9,-2.6 2,-0.3 1,-0.2 -1,-0.3 0.550 95.2 148.2 68.5 6.0 0.7 3.5 5.0 91 231 A V < - 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