==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT 16-MAR-08 2VQI . COMPND 2 MOLECULE: OUTER MEMBRANE USHER PROTEIN PAPC; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR H.REMAUT,C.TANG,N.S.HENDERSON,J.S.PINKNER,T.WANG, . 954 11 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 46861.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 739 77.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 599 62.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 10 1.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 20 2.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 3 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 91 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 3.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 18 1.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 0.6 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 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 2 0 0 0 5 3 10 7 3 13 8 3 4 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 1 146 A L 0 0 99 0, 0.0 479,-2.1 0, 0.0 30,-0.2 0.000 360.0 360.0 360.0 103.2 -29.1 -2.3 -38.1 2 147 A X E -AB 30 479A 118 28,-1.4 28,-2.1 477,-0.2 2,-0.3 -0.345 360.0-163.7 -78.5 155.8 -28.3 -2.2 -34.3 3 148 A L E -AB 29 478A 30 475,-2.4 475,-1.6 26,-0.2 2,-0.4 -0.989 8.4-166.3-137.0 143.0 -28.5 0.8 -31.9 4 149 A D E -AB 28 477A 87 24,-0.8 24,-0.9 -2,-0.3 473,-0.2 -0.770 20.4-172.2-133.2 85.7 -26.9 1.1 -28.5 5 150 A Y E -AB 27 476A 66 471,-0.9 471,-0.8 -2,-0.4 2,-0.3 -0.425 13.5-176.5 -81.6 154.5 -28.4 4.1 -26.8 6 151 A N E -AB 26 475A 26 20,-0.6 20,-2.1 469,-0.2 2,-0.3 -0.913 13.5-176.4-150.7 117.9 -27.3 5.7 -23.6 7 152 A L E -A 25 0A 64 467,-3.4 467,-0.4 -2,-0.3 2,-0.3 -0.902 11.6-177.4-124.6 152.6 -29.4 8.6 -22.2 8 153 A N E +A 24 0A 3 16,-2.5 16,-2.4 -2,-0.3 2,-0.3 -0.996 5.2 171.1-147.0 141.0 -29.2 11.0 -19.2 9 154 A G E +AC 23 472A 22 463,-2.5 463,-2.9 -2,-0.3 2,-0.3 -0.983 2.1 174.2-151.6 137.3 -31.4 13.7 -18.0 10 155 A T E -AC 22 471A 25 12,-2.6 12,-1.6 -2,-0.3 2,-0.3 -0.992 8.7-170.4-147.9 140.2 -31.4 15.8 -14.9 11 156 A V E +AC 21 470A 59 459,-3.0 459,-2.6 -2,-0.3 2,-0.3 -0.947 16.8 168.9-125.8 147.0 -33.5 18.8 -13.6 12 157 A S E -AC 20 469A 15 8,-1.7 8,-1.3 -2,-0.3 2,-0.3 -0.992 21.9-147.7-160.2 153.5 -32.7 20.8 -10.5 13 158 A R E -AC 19 468A 136 455,-2.5 455,-1.8 -2,-0.3 6,-0.2 -0.873 16.8-133.9-121.4 154.7 -33.5 24.0 -8.5 14 159 A N E - C 0 467A 60 4,-2.1 453,-0.2 -2,-0.3 452,-0.1 -0.585 18.8-127.8 -99.5 163.7 -31.4 26.2 -6.3 15 160 A Y S S+ 0 0 71 451,-0.6 776,-0.1 -2,-0.2 452,-0.1 0.545 113.7 51.2 -88.2 -6.8 -32.5 27.5 -2.9 16 161 A Q S S- 0 0 53 774,-0.2 669,-0.4 450,-0.1 -1,-0.2 0.656 132.0 -81.7-101.0 -22.2 -31.5 30.9 -4.1 17 162 A G S S+ 0 0 37 1,-0.3 -3,-0.1 667,-0.1 34,-0.1 -0.150 78.9 125.7 167.4 -52.6 -33.6 30.7 -7.3 18 163 A G - 0 0 6 -5,-0.2 -4,-2.1 1,-0.1 2,-0.3 0.094 31.8-165.1 -71.3 144.5 -32.1 28.9 -10.2 19 164 A D E -AD 13 50A 36 31,-1.0 31,-2.3 -6,-0.2 2,-0.3 -0.746 13.3-176.9 -99.6 164.8 -33.4 26.1 -12.4 20 165 A S E -AD 12 49A 22 -8,-1.3 -8,-1.7 -2,-0.3 2,-0.3 -0.957 12.8-152.3-160.6 147.5 -31.2 24.1 -14.7 21 166 A H E -AD 11 48A 67 27,-2.3 27,-1.7 -2,-0.3 2,-0.3 -0.895 8.6-175.0-121.2 150.4 -31.6 21.2 -17.3 22 167 A Q E +AD 10 47A 36 -12,-1.6 -12,-2.6 -2,-0.3 2,-0.4 -0.910 8.3 167.1-151.5 116.5 -29.1 18.6 -18.4 23 168 A F E +AD 9 46A 92 23,-2.1 23,-2.9 -2,-0.3 2,-0.3 -1.000 7.1 168.1-134.1 129.2 -29.7 16.1 -21.1 24 169 A S E +AD 8 45A 5 -16,-2.4 -16,-2.5 -2,-0.4 2,-0.3 -0.967 5.4 177.4-138.8 154.8 -26.9 13.9 -22.6 25 170 A Y E +AD 7 44A 53 19,-2.8 19,-3.4 -2,-0.3 2,-0.3 -0.985 5.3 166.6-157.4 148.6 -26.9 10.9 -24.9 26 171 A N E +AD 6 43A 21 -20,-2.1 -20,-0.6 -2,-0.3 2,-0.3 -0.958 15.7 133.2-159.5 155.1 -24.3 8.7 -26.7 27 172 A G E -AD 5 42A 12 15,-2.2 15,-2.4 -2,-0.3 2,-0.4 -0.977 40.5 -98.5 176.9-173.9 -24.4 5.4 -28.4 28 173 A T E -AD 4 41A 25 -24,-0.9 -24,-0.8 -2,-0.3 2,-0.5 -0.990 12.4-146.9-141.4 135.9 -23.4 3.4 -31.4 29 174 A V E -AD 3 40A 20 11,-2.9 11,-2.7 -2,-0.4 2,-0.4 -0.824 22.3-168.3 -97.1 133.8 -25.0 2.3 -34.7 30 175 A G E +A 2 0A 10 -28,-2.1 -28,-1.4 -2,-0.5 2,-0.3 -0.941 7.4 176.6-124.4 147.1 -24.0 -1.1 -36.0 31 176 A G - 0 0 7 7,-0.4 7,-1.9 -2,-0.4 2,-0.5 -1.000 20.0-152.3-151.0 148.5 -24.6 -2.7 -39.4 32 177 A N B E 37 0A 115 -2,-0.3 5,-0.2 5,-0.2 -2,-0.0 -0.969 360.0 360.0-124.3 116.5 -23.7 -5.8 -41.3 33 178 A L 0 0 175 3,-2.6 3,-1.2 -2,-0.5 -2,-0.0 -0.882 360.0 360.0-102.0 360.0 -23.6 -5.6 -45.2 34 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 35 180 A P 0 0 102 0, 0.0 2,-0.5 0, 0.0 -3,-0.0 0.000 360.0 360.0 360.0 19.6 -17.7 -9.1 -44.6 36 181 A W - 0 0 90 -3,-1.2 -3,-2.6 34,-0.1 34,-0.2 -0.908 360.0-173.7-115.5 102.7 -18.4 -5.4 -44.5 37 182 A R E -EF 32 69A 93 32,-2.6 32,-1.9 -2,-0.5 2,-0.3 -0.552 9.2-143.3-100.4 160.2 -19.1 -4.4 -41.0 38 183 A L E + F 0 68A 59 -7,-1.9 -7,-0.4 30,-0.2 2,-0.2 -0.847 18.5 172.3-125.3 154.5 -20.3 -1.1 -39.6 39 184 A R E + F 0 67A 56 28,-1.1 28,-2.1 -2,-0.3 2,-0.5 -0.691 2.3 175.0-165.8 110.8 -19.7 1.1 -36.5 40 185 A A E -DF 29 66A 7 -11,-2.7 -11,-2.9 26,-0.3 2,-0.6 -0.960 11.2-162.8-123.8 115.9 -20.9 4.6 -35.8 41 186 A D E +DF 28 65A 19 24,-3.3 24,-1.2 -2,-0.5 2,-0.3 -0.862 13.6 179.2-100.3 122.6 -20.3 6.3 -32.5 42 187 A Y E +D 27 0A 34 -15,-2.4 -15,-2.2 -2,-0.6 2,-0.3 -0.869 4.7 176.7-121.1 153.6 -22.5 9.4 -31.8 43 188 A Q E +DF 26 62A 17 19,-2.2 19,-2.0 -2,-0.3 2,-0.3 -0.960 6.0 159.5-157.1 137.5 -22.6 11.7 -28.7 44 189 A G E -DF 25 61A 5 -19,-3.4 -19,-2.8 -2,-0.3 2,-0.3 -0.994 10.4-174.9-156.7 161.7 -24.5 14.8 -27.8 45 190 A S E -DF 24 60A 29 15,-2.9 15,-3.3 -2,-0.3 2,-0.4 -0.993 9.1-161.1-158.3 155.9 -25.7 17.0 -24.9 46 191 A Q E -DF 23 59A 106 -23,-2.9 -23,-2.1 -2,-0.3 2,-0.4 -0.985 12.3-176.3-143.2 126.0 -27.7 20.1 -24.1 47 192 A E E -DF 22 58A 42 11,-2.4 11,-1.9 -2,-0.4 2,-0.3 -0.982 1.6-180.0-128.9 140.1 -27.6 22.2 -20.9 48 193 A Q E -DF 21 57A 47 -27,-1.7 -27,-2.3 -2,-0.4 2,-0.3 -0.975 1.3-178.1-137.5 148.5 -29.6 25.2 -19.8 49 194 A S E -DF 20 56A 48 7,-1.9 7,-2.2 -2,-0.3 2,-0.4 -0.995 9.3-161.7-147.5 146.5 -29.7 27.4 -16.7 50 195 A R E +DF 19 55A 98 -31,-2.3 -31,-1.0 -2,-0.3 5,-0.3 -0.972 19.8 158.9-134.2 117.9 -31.7 30.3 -15.5 51 196 A Y - 0 0 98 3,-2.4 -32,-0.0 -2,-0.4 -34,-0.0 -0.390 63.7 -49.2-117.8-161.6 -30.6 32.7 -12.7 52 197 A N S S- 0 0 135 1,-0.2 3,-0.1 -2,-0.1 632,-0.0 0.850 129.3 -16.0 -37.4 -53.6 -31.6 36.2 -11.7 53 198 A G S S+ 0 0 28 1,-0.2 2,-0.5 490,-0.1 491,-0.5 0.676 120.4 74.6-125.0 -39.3 -31.3 37.6 -15.3 54 199 A E - 0 0 100 489,-0.2 -3,-2.4 487,-0.1 2,-0.4 -0.761 45.1-172.0 -99.3 122.0 -29.3 35.1 -17.4 55 200 A K E -FG 50 542A 83 487,-1.4 487,-1.9 -2,-0.5 2,-0.3 -0.843 20.2-164.1 -84.5 144.7 -30.4 31.9 -18.9 56 201 A T E -FG 49 541A 39 -7,-2.2 -7,-1.9 -2,-0.4 2,-0.4 -0.960 9.3-167.6-129.9 152.8 -27.4 30.0 -20.5 57 202 A T E -FG 48 540A 33 483,-2.7 483,-2.6 -2,-0.3 2,-0.5 -0.985 8.8-176.6-143.4 128.9 -27.3 27.1 -23.0 58 203 A N E +FG 47 539A 39 -11,-1.9 -11,-2.4 -2,-0.4 2,-0.4 -0.993 17.0 178.9-124.7 120.5 -24.4 24.9 -24.1 59 204 A R E +FG 46 538A 117 479,-2.8 479,-2.0 -2,-0.5 2,-0.3 -0.985 2.5 174.2-128.3 131.2 -25.4 22.4 -26.7 60 205 A N E +FG 45 537A 38 -15,-3.3 -15,-2.9 -2,-0.4 2,-0.3 -0.996 7.9 166.4-141.6 142.8 -23.2 19.9 -28.5 61 206 A F E +F 44 0A 99 475,-0.9 2,-0.3 -2,-0.3 -17,-0.2 -0.986 12.1 146.0-149.0 142.5 -23.4 17.0 -31.0 62 207 A T E -F 43 0A 49 -19,-2.0 -19,-2.2 -2,-0.3 2,-1.1 -0.967 49.6-115.1-163.6 152.7 -21.0 15.0 -33.1 63 208 A W E - 0 0 106 -2,-0.3 -21,-0.2 -21,-0.2 3,-0.2 -0.799 29.8-163.5 -84.5 88.7 -20.2 11.6 -34.6 64 209 A S E S- 0 0 14 -2,-1.1 2,-0.3 1,-0.2 -1,-0.2 0.876 70.3 -21.2 -33.0 -52.5 -17.0 11.0 -32.6 65 210 A R E +F 41 0A 24 -24,-1.2 -24,-3.3 -3,-0.1 2,-0.3 -0.926 58.9 177.8-167.6 136.6 -16.1 8.3 -35.2 66 211 A F E +FH 40 83A 103 17,-0.7 17,-2.3 -2,-0.3 2,-0.3 -0.946 20.5 149.9-148.6 128.5 -17.8 6.1 -37.7 67 212 A Y E -FH 39 82A 28 -28,-2.1 -28,-1.1 -2,-0.3 2,-0.4 -0.889 40.3-112.2-150.4 169.4 -16.1 3.6 -40.1 68 213 A L E -FH 38 81A 72 13,-4.0 13,-3.4 -2,-0.3 2,-0.3 -0.890 32.3-179.3-110.4 142.9 -16.4 0.3 -42.0 69 214 A F E -FH 37 80A 50 -32,-1.9 -32,-2.6 -2,-0.4 2,-0.4 -0.998 5.7-172.1-144.5 145.5 -14.3 -2.7 -41.0 70 215 A R E - H 0 79A 91 9,-2.9 9,-2.3 -2,-0.3 2,-0.2 -0.999 19.2-128.7-142.6 135.8 -14.1 -6.2 -42.4 71 216 A A E - H 0 78A 46 -2,-0.4 7,-0.2 7,-0.2 -2,-0.0 -0.479 16.7-149.3 -81.8 152.4 -12.3 -9.4 -41.3 72 217 A I >> - 0 0 31 5,-1.4 4,-0.6 -2,-0.2 3,-0.6 -0.990 7.0-144.7-127.8 132.1 -10.0 -11.4 -43.5 73 218 A P T 34 S+ 0 0 98 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.783 88.5 38.1 -55.9 -34.7 -9.6 -15.1 -43.2 74 219 A R T 34 S+ 0 0 208 1,-0.2 0, 0.0 2,-0.1 0, 0.0 0.230 112.2 43.4-133.9 -2.9 -6.1 -15.5 -44.0 75 220 A W T <4 S- 0 0 183 -3,-0.6 -1,-0.2 2,-0.2 3,-0.1 0.226 93.0-129.3-120.1 4.4 -3.9 -12.8 -42.7 76 221 A R S < S+ 0 0 176 -4,-0.6 2,-0.3 1,-0.3 -2,-0.1 0.801 70.9 128.5 59.2 25.4 -5.7 -12.9 -39.3 77 222 A A - 0 0 1 -5,-0.4 -5,-1.4 26,-0.3 2,-0.4 -0.799 53.9-142.6-115.1 154.5 -5.8 -9.2 -40.0 78 223 A N E -HI 71 102A 71 24,-2.8 24,-2.2 -2,-0.3 2,-0.5 -0.953 8.5-150.3-119.9 136.2 -8.7 -6.7 -39.9 79 224 A L E -HI 70 101A 50 -9,-2.3 -9,-2.9 -2,-0.4 2,-0.4 -0.897 16.6-179.1-106.5 133.3 -9.2 -3.8 -42.3 80 225 A T E +HI 69 100A 14 20,-2.5 20,-1.9 -2,-0.5 2,-0.4 -0.992 2.9 176.3-135.8 128.5 -11.0 -0.7 -41.2 81 226 A L E +HI 68 99A 71 -13,-3.4 -13,-4.0 -2,-0.4 2,-0.3 -0.995 39.0 55.3-136.3 142.9 -11.7 2.4 -43.1 82 227 A G E S-HI 67 98A 21 16,-3.0 16,-3.1 -2,-0.4 2,-0.7 -0.974 98.9 -22.4 141.9-150.9 -13.7 5.6 -42.4 83 228 A E E S+HI 66 97A 53 -17,-2.3 -17,-0.7 -2,-0.3 14,-0.3 -0.857 81.7 137.0 -96.6 117.9 -13.3 8.1 -39.5 84 229 A N E - I 0 96A 14 12,-2.8 12,-2.5 -2,-0.7 2,-0.3 -0.541 49.0-105.5-137.4-159.6 -11.5 6.5 -36.6 85 230 A N E - I 0 95A 9 10,-0.3 10,-0.2 -2,-0.2 2,-0.2 -0.988 35.8-110.0-139.1 141.6 -8.9 7.0 -33.9 86 231 A I - 0 0 7 8,-2.5 2,-0.5 -2,-0.3 8,-0.1 -0.536 28.2-167.2 -76.7 139.9 -5.5 5.5 -33.8 87 232 A N + 0 0 66 -2,-0.2 2,-0.3 6,-0.1 5,-0.1 -0.954 18.6 167.2-128.1 108.0 -5.0 2.8 -31.2 88 233 A S - 0 0 17 -2,-0.5 69,-0.1 3,-0.4 5,-0.1 -0.928 41.4-149.5-128.2 150.9 -1.4 1.9 -30.7 89 234 A D S S+ 0 0 19 -2,-0.3 93,-0.2 1,-0.1 -1,-0.1 0.421 106.1 31.4 -91.3 -0.8 0.7 -0.0 -28.2 90 235 A I S S+ 0 0 11 1,-0.1 2,-0.2 2,-0.1 -1,-0.1 0.637 118.1 46.9-125.1 -36.3 3.7 2.2 -28.9 91 236 A F S S- 0 0 19 135,-0.1 -3,-0.4 1,-0.1 2,-0.2 -0.653 80.8-108.8-108.8 166.3 2.3 5.6 -29.9 92 237 A R - 0 0 71 -2,-0.2 2,-0.2 1,-0.1 206,-0.2 -0.470 43.9 -86.2 -95.1 171.4 -0.4 7.9 -28.4 93 238 A S + 0 0 21 -2,-0.2 2,-0.3 -5,-0.1 206,-0.1 -0.495 42.9 159.3 -94.1 138.0 -3.8 8.6 -29.8 94 239 A W - 0 0 3 -2,-0.2 -8,-2.5 -8,-0.1 2,-0.2 -0.978 37.8-110.5-141.4 159.6 -5.1 11.0 -32.3 95 240 A S E +I 85 0A 19 -2,-0.3 104,-2.5 104,-0.3 2,-0.3 -0.567 42.9 162.3 -90.8 151.0 -8.3 11.1 -34.4 96 241 A Y E -IJ 84 198A 4 -12,-2.5 -12,-2.8 102,-0.3 2,-0.5 -0.995 38.7-122.4-161.9 148.8 -8.2 10.6 -38.2 97 242 A T E +IJ 83 197A 57 100,-2.0 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