==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER AMINOPEPTIDASE 22-NOV-97 1AZW . COMPND 2 MOLECULE: PROLINE IMINOPEPTIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: XANTHOMONAS CITRI; . AUTHOR F.J.MEDRANO,J.ALONSO,J.L.GARCIA,A.ROMERO,W.BODE,F.X.GOMIS- . 626 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24177.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 455 72.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 58 9.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 30 4.8 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 . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.3 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 . 36 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 104 16.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 202 32.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 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 3 0 1 1 2 4 2 0 2 0 4 0 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 4 6 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 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 0 0 0 0 0 0 2 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 1 A M 0 0 160 0, 0.0 299,-0.1 0, 0.0 302,-0.0 0.000 360.0 360.0 360.0 114.9 27.9 32.7 98.5 2 2 A R - 0 0 87 298,-0.1 2,-0.3 301,-0.1 301,-0.1 -0.139 360.0-151.7 -70.2 166.6 27.8 28.9 98.2 3 3 A T - 0 0 109 300,-0.1 2,-0.1 299,-0.1 -1,-0.1 -0.822 31.8 -73.2-134.8 172.7 30.9 26.7 97.6 4 4 A L - 0 0 27 -2,-0.3 51,-0.2 1,-0.1 3,-0.1 -0.424 56.6-108.3 -64.1 142.0 31.7 23.4 96.0 5 5 A Y - 0 0 37 49,-2.7 49,-0.1 1,-0.1 3,-0.1 -0.111 56.0 -69.8 -62.2 171.3 30.5 20.5 98.1 6 6 A P - 0 0 95 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 -0.315 62.5 -76.7 -70.8 155.3 33.3 18.5 99.8 7 7 A E - 0 0 170 -3,-0.1 2,-0.3 1,-0.0 44,-0.1 -0.196 59.8-176.5 -46.9 124.9 35.9 16.3 98.1 8 8 A I - 0 0 41 42,-0.2 45,-0.1 -3,-0.1 46,-0.1 -0.882 19.6-141.7-131.2 156.8 34.2 13.0 97.2 9 9 A T - 0 0 105 -2,-0.3 21,-0.4 44,-0.1 2,-0.2 -0.851 31.7-101.9-116.7 147.8 35.3 9.7 95.6 10 10 A P - 0 0 14 0, 0.0 19,-0.3 0, 0.0 3,-0.1 -0.514 13.2-150.0 -73.1 139.6 33.2 7.7 93.2 11 11 A Y S S+ 0 0 101 17,-1.5 2,-0.3 1,-0.2 18,-0.1 0.574 89.3 26.4 -78.8 -11.9 31.5 4.6 94.5 12 12 A Q E -A 28 0A 53 16,-1.2 16,-2.5 2,-0.0 2,-0.3 -0.978 63.4-179.7-154.2 138.3 32.0 3.1 91.0 13 13 A Q E +A 27 0A 117 -2,-0.3 14,-0.2 14,-0.2 2,-0.2 -0.952 22.8 141.4-133.7 150.1 34.5 3.6 88.2 14 14 A G E -A 26 0A 21 12,-2.4 12,-0.7 -2,-0.3 2,-0.3 -0.802 39.8-106.5-162.3-157.9 34.4 1.8 84.9 15 15 A S E -A 25 0A 88 -2,-0.2 2,-0.4 10,-0.2 10,-0.2 -0.963 18.6-161.5-154.2 140.8 34.9 1.6 81.1 16 16 A L E -A 24 0A 26 8,-2.0 8,-2.6 -2,-0.3 2,-0.9 -0.997 15.9-140.2-132.0 129.7 32.4 1.3 78.3 17 17 A K E +A 23 0A 172 -2,-0.4 6,-0.2 6,-0.2 3,-0.1 -0.856 23.9 175.0 -90.4 104.4 33.1 0.1 74.8 18 18 A V - 0 0 16 4,-1.4 2,-0.3 -2,-0.9 -1,-0.2 0.721 68.1 -9.1 -82.5 -27.1 31.1 2.5 72.6 19 19 A D S S- 0 0 46 3,-1.3 -1,-0.2 -3,-0.1 3,-0.1 -0.946 89.3 -78.6-159.0 171.9 32.4 1.1 69.4 20 20 A D S S+ 0 0 172 -2,-0.3 3,-0.1 1,-0.2 -3,-0.0 0.465 128.5 30.7 -59.9 3.9 35.2 -1.2 68.2 21 21 A R S S+ 0 0 107 1,-0.2 2,-0.4 61,-0.1 -1,-0.2 0.658 106.8 68.0-129.8 -35.2 37.8 1.6 68.7 22 22 A H - 0 0 0 -3,-0.1 -4,-1.4 60,-0.0 -3,-1.3 -0.815 48.6-174.3-104.0 135.3 36.7 3.8 71.6 23 23 A T E -AB 17 75A 36 52,-2.3 52,-2.0 -2,-0.4 2,-0.4 -0.959 16.6-150.9-128.3 107.7 36.5 2.9 75.3 24 24 A L E -A 16 0A 3 -8,-2.6 -8,-2.0 -2,-0.5 2,-0.4 -0.659 6.3-139.5 -86.2 129.9 35.0 5.6 77.5 25 25 A Y E +A 15 0A 27 -2,-0.4 42,-2.1 -10,-0.2 2,-0.3 -0.688 31.7 171.5 -82.8 134.8 36.0 6.0 81.2 26 26 A F E -AC 14 66A 9 -12,-0.7 -12,-2.4 -2,-0.4 2,-0.3 -0.868 11.6-176.7-138.7 168.8 33.0 6.7 83.4 27 27 A E E -AC 13 65A 0 38,-2.1 38,-2.5 -2,-0.3 2,-0.4 -0.978 16.0-137.4-161.5 159.6 32.3 7.0 87.1 28 28 A Q E +AC 12 64A 11 -16,-2.5 -17,-1.5 -2,-0.3 -16,-1.2 -0.991 18.7 179.1-130.3 135.8 29.5 7.6 89.6 29 29 A C E + C 0 63A 0 34,-2.2 34,-2.4 -2,-0.4 2,-0.1 -0.870 43.5 18.3-127.3 162.5 29.4 9.7 92.7 30 30 A G E S+ C 0 62A 17 -21,-0.4 32,-0.2 -2,-0.3 29,-0.1 -0.385 105.7 1.3 85.0-157.7 26.8 10.5 95.3 31 31 A N > - 0 0 52 30,-1.1 3,-3.9 26,-0.3 -2,-0.1 -0.664 58.7-149.3 -77.8 107.0 23.5 8.9 96.3 32 32 A P T 3 S+ 0 0 57 0, 0.0 -1,-0.2 0, 0.0 30,-0.1 0.625 101.4 40.2 -50.0 -18.3 23.2 5.8 94.0 33 33 A H T 3 S+ 0 0 175 28,-0.1 29,-0.1 2,-0.1 -2,-0.1 0.172 98.5 111.1-117.7 15.0 19.4 6.3 94.2 34 34 A G S < S- 0 0 12 -3,-3.9 27,-0.3 1,-0.2 26,-0.1 -0.154 86.1 -61.0 -82.9 176.7 19.5 10.1 94.0 35 35 A K E -d 61 0A 44 25,-3.2 27,-3.1 1,-0.1 2,-0.2 -0.407 63.7-121.1 -58.5 125.1 18.4 12.4 91.1 36 36 A P E +d 62 0A 32 0, 0.0 69,-2.4 0, 0.0 2,-0.3 -0.536 36.7 172.7 -76.3 139.0 20.6 11.4 88.1 37 37 A V E -de 63 105A 0 25,-2.2 27,-3.2 67,-0.2 2,-0.5 -0.988 21.0-146.3-145.5 134.6 22.8 14.0 86.4 38 38 A V E -de 64 106A 0 67,-2.8 69,-2.4 -2,-0.3 2,-0.7 -0.888 14.5-141.1-105.5 131.1 25.4 13.6 83.6 39 39 A M E -de 65 107A 0 25,-2.6 27,-0.7 -2,-0.5 2,-0.7 -0.805 11.2-163.8 -94.8 112.2 28.5 15.9 83.7 40 40 A L E - e 0 108A 1 67,-2.8 69,-1.0 -2,-0.7 72,-0.1 -0.790 14.1-148.7 -95.8 114.1 29.7 17.2 80.3 41 41 A H - 0 0 2 -2,-0.7 7,-0.1 25,-0.4 4,-0.1 -0.324 13.8-118.8 -75.7 167.8 33.3 18.5 80.4 42 42 A G S >>S+ 0 0 19 5,-0.2 4,-1.6 69,-0.2 5,-0.5 -0.032 72.7 59.7 -91.8-162.0 34.6 21.3 78.3 43 43 A G T 45S- 0 0 3 1,-0.2 68,-0.2 2,-0.2 2,-0.2 -0.959 94.4-105.8 119.6-103.4 37.3 21.6 75.7 44 44 A P T 45S+ 0 0 1 0, 0.0 186,-0.3 0, 0.0 -1,-0.2 0.412 117.5 28.8 -62.2 155.0 36.4 19.5 73.7 45 45 A G T 45S+ 0 0 2 -3,-0.3 27,-0.4 -2,-0.2 -2,-0.2 0.549 87.0 114.3 97.6 13.6 39.0 17.1 74.8 46 46 A G T <5 - 0 0 16 -4,-1.6 -3,-0.2 25,-0.1 180,-0.1 0.920 57.9-151.8 -82.8 -43.4 39.4 18.2 78.4 47 47 A G < - 0 0 13 -5,-0.5 -5,-0.2 19,-0.1 25,-0.1 0.143 29.8 -72.1 82.0 149.8 38.1 15.2 80.4 48 48 A C - 0 0 14 23,-0.1 2,-0.3 -7,-0.1 19,-0.1 -0.311 44.8-153.9 -73.6 161.6 36.5 15.5 83.8 49 49 A N > - 0 0 71 1,-0.1 3,-0.8 -2,-0.1 4,-0.3 -0.800 32.9 -99.7-129.3 171.3 38.4 16.4 87.0 50 50 A D G > S+ 0 0 104 -2,-0.3 3,-2.1 1,-0.2 4,-0.4 0.925 117.6 62.5 -59.6 -42.2 37.9 15.6 90.7 51 51 A K G > S+ 0 0 95 1,-0.3 3,-1.4 2,-0.2 -1,-0.2 0.766 89.7 68.6 -53.8 -31.5 36.4 19.1 91.2 52 52 A M G X S+ 0 0 22 -3,-0.8 3,-0.7 1,-0.3 -1,-0.3 0.638 86.4 67.6 -67.7 -13.7 33.5 18.4 88.9 53 53 A R G X S+ 0 0 23 -3,-2.1 3,-0.6 -4,-0.3 -1,-0.3 0.727 91.9 67.2 -75.3 -19.9 32.0 15.9 91.3 54 54 A R G < + 0 0 48 -3,-1.4 -49,-2.7 -4,-0.4 -1,-0.2 0.300 69.3 84.2 -88.9 5.9 31.3 18.7 93.7 55 55 A F G < S+ 0 0 2 -3,-0.7 2,-0.3 -51,-0.2 -1,-0.2 0.665 88.9 61.8 -82.9 -14.0 28.6 20.9 92.1 56 56 A H S < S- 0 0 1 -3,-0.6 7,-0.1 -4,-0.1 -51,-0.1 -0.869 92.1-105.0-117.6 151.5 25.8 18.6 93.3 57 57 A D >> - 0 0 25 -2,-0.3 4,-2.5 1,-0.2 3,-1.8 -0.571 26.5-149.6 -70.6 109.9 24.6 17.6 96.7 58 58 A P T 34 S+ 0 0 41 0, 0.0 -1,-0.2 0, 0.0 -24,-0.1 0.433 95.1 58.6 -62.6 1.6 25.8 14.0 97.2 59 59 A A T 34 S+ 0 0 61 -29,-0.1 -2,-0.1 -28,-0.1 3,-0.0 0.701 118.5 26.1 -99.7 -28.8 22.8 13.2 99.3 60 60 A K T <4 S+ 0 0 87 -3,-1.8 -25,-3.2 -26,-0.1 2,-0.4 0.600 112.1 72.6-109.6 -15.1 20.3 14.1 96.6 61 61 A Y E < - d 0 35A 0 -4,-2.5 -30,-1.1 -27,-0.3 2,-1.0 -0.907 56.7-153.3-119.0 132.8 22.2 13.5 93.4 62 62 A R E -Cd 30 36A 45 -27,-3.1 -25,-2.2 -2,-0.4 2,-0.8 -0.848 32.9-155.5 -92.3 100.5 23.4 10.4 91.5 63 63 A I E -Cd 29 37A 1 -34,-2.4 -34,-2.2 -2,-1.0 2,-0.5 -0.762 11.5-169.5 -89.9 109.1 26.3 12.1 89.8 64 64 A V E +Cd 28 38A 0 -27,-3.2 -25,-2.6 -2,-0.8 2,-0.3 -0.796 9.7 175.9 -99.3 128.0 27.4 10.5 86.5 65 65 A L E +Cd 27 39A 0 -38,-2.5 -38,-2.1 -2,-0.5 2,-0.3 -0.940 2.4 168.4-128.8 156.4 30.7 11.6 84.9 66 66 A F E -C 26 0A 3 -27,-0.7 -25,-0.4 -2,-0.3 2,-0.3 -0.973 33.7-115.4-165.2 148.6 32.7 10.5 81.9 67 67 A D - 0 0 1 -42,-2.1 2,-0.2 -2,-0.3 -42,-0.1 -0.674 36.2-128.3 -86.3 138.7 35.6 11.4 79.6 68 68 A Q > - 0 0 3 -2,-0.3 3,-2.6 1,-0.2 6,-0.2 -0.496 51.5 -53.4 -83.9 161.3 34.6 12.0 76.1 69 69 A R T 3 S- 0 0 5 1,-0.3 -1,-0.2 -2,-0.2 3,-0.1 0.068 123.1 -2.4 -39.3 126.3 36.3 10.3 73.2 70 70 A G T 3 S+ 0 0 0 1,-0.2 8,-3.3 -3,-0.1 2,-0.4 0.441 107.0 119.5 71.1 2.4 40.1 10.6 73.1 71 71 A S S X S- 0 0 0 -3,-2.6 3,-1.0 6,-0.2 2,-0.5 -0.820 77.3 -38.3-108.6 138.3 40.1 12.7 76.2 72 72 A G T 3 S- 0 0 33 -2,-0.4 -25,-0.1 -27,-0.4 5,-0.1 -0.418 128.4 -4.5 64.0-110.5 41.6 12.1 79.6 73 73 A R T 3 S+ 0 0 94 -2,-0.5 2,-0.3 -48,-0.1 -1,-0.2 -0.044 108.4 102.1-110.4 27.9 41.3 8.5 80.5 74 74 A S S < S- 0 0 1 -3,-1.0 -50,-0.2 -6,-0.2 -6,-0.1 -0.716 74.8 -79.0-101.0 157.6 39.2 7.4 77.5 75 75 A T B S+B 23 0A 70 -52,-2.0 -52,-2.3 -2,-0.3 2,-0.1 -0.953 102.3 24.4-134.8 151.0 41.0 5.5 74.7 76 76 A P S > S- 0 0 44 0, 0.0 3,-1.0 0, 0.0 -1,-0.2 0.492 91.2-129.8 -78.3 143.3 42.7 5.8 72.4 77 77 A H T 3 S+ 0 0 55 1,-0.2 -6,-0.2 -2,-0.1 -2,-0.1 -0.307 83.8 7.6 -58.1 139.9 44.0 9.1 73.8 78 78 A A T 3 S+ 0 0 13 -8,-3.3 2,-0.6 1,-0.2 -1,-0.2 0.816 89.2 167.7 57.0 39.7 43.9 12.2 71.5 79 79 A D < + 0 0 21 -3,-1.0 -1,-0.2 1,-0.1 -8,-0.1 -0.727 28.0 180.0 -96.5 126.2 42.0 10.3 68.8 80 80 A L > + 0 0 34 -2,-0.6 3,-1.2 2,-0.1 2,-0.4 0.540 52.4 105.5 -93.9 -8.1 40.4 12.2 65.9 81 81 A V T 3 S- 0 0 66 1,-0.3 3,-0.1 -60,-0.0 -2,-0.1 -0.606 103.2 -8.8 -78.0 124.3 38.9 9.1 64.1 82 82 A D T 3 S+ 0 0 90 -2,-0.4 2,-0.7 1,-0.2 -1,-0.3 0.865 96.1 138.6 54.1 37.5 35.1 9.0 64.7 83 83 A N < + 0 0 1 -3,-1.2 2,-0.3 4,-0.1 -1,-0.2 -0.910 28.7 136.5-112.5 96.7 35.5 11.9 67.2 84 84 A T >> - 0 0 29 -2,-0.7 4,-2.6 -3,-0.1 3,-1.2 -0.984 68.0-107.9-146.4 151.5 32.5 14.0 66.2 85 85 A T H 3> S+ 0 0 0 -2,-0.3 4,-1.9 1,-0.3 5,-0.1 0.853 120.3 47.4 -48.1 -42.1 29.7 15.9 67.9 86 86 A W H 3> S+ 0 0 82 2,-0.2 4,-1.6 1,-0.2 -1,-0.3 0.731 109.5 52.7 -78.0 -19.4 27.1 13.3 66.8 87 87 A D H <> S+ 0 0 36 -3,-1.2 4,-2.8 2,-0.2 3,-0.3 0.964 111.8 46.4 -75.0 -51.9 29.2 10.5 68.0 88 88 A L H X S+ 0 0 4 -4,-2.6 4,-1.5 1,-0.3 -2,-0.2 0.826 111.1 52.8 -57.5 -33.3 29.6 12.2 71.4 89 89 A V H X S+ 0 0 4 -4,-1.9 4,-1.1 -5,-0.3 -1,-0.3 0.912 110.4 48.0 -69.3 -37.5 25.8 12.8 71.3 90 90 A A H >X S+ 0 0 28 -4,-1.6 4,-1.8 -3,-0.3 3,-0.8 0.945 106.3 57.1 -65.9 -48.3 25.3 9.1 70.7 91 91 A D H 3X S+ 0 0 1 -4,-2.8 4,-2.8 1,-0.3 5,-0.3 0.846 99.7 58.6 -50.4 -41.6 27.7 8.1 73.5 92 92 A I H 3X S+ 0 0 0 -4,-1.5 4,-2.4 1,-0.2 -1,-0.3 0.922 108.7 46.8 -57.5 -39.5 25.6 10.1 76.0 93 93 A E H S+ 0 0 29 -4,-2.4 5,-1.9 -5,-0.3 4,-0.2 0.951 116.1 41.6 -55.1 -55.0 22.2 6.6 79.8 97 97 A T H ><5S+ 0 0 97 -4,-2.6 3,-1.1 1,-0.2 -2,-0.2 0.904 114.3 52.6 -60.8 -43.8 20.8 3.3 78.4 98 98 A H H 3<5S+ 0 0 104 -4,-3.1 -1,-0.2 -5,-0.3 -2,-0.2 0.813 111.4 45.5 -64.1 -37.3 23.7 1.3 79.9 99 99 A L T 3<5S- 0 0 25 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.386 111.0-124.0 -86.1 -1.7 23.1 2.7 83.4 100 100 A G T < 5 + 0 0 59 -3,-1.1 2,-0.3 -4,-0.2 -3,-0.2 0.683 58.4 146.2 69.2 20.1 19.4 2.2 83.0 101 101 A V < - 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