==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-JAN-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER BIOSYNTHETIC PROTEIN 11-JAN-11 2Y4Y . COMPND 2 MOLECULE: PILP PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA PAO1; . AUTHOR J.P.DERRICK,J.BERRY . 317 11 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18192.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 208 65.6 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 . 132 41.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 12 3.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.6 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 . 38 12.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 11.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.3 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 0 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 . 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 . 0 4 0 1 7 0 7 1 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 4 4 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 83 A I 0 0 108 0, 0.0 75,-0.0 0, 0.0 69,-0.0 0.000 360.0 360.0 360.0 120.3 42.0 51.5 7.7 2 84 A K - 0 0 156 73,-0.0 3,-0.0 68,-0.0 74,-0.0 -0.869 360.0 -83.0-170.2 152.0 45.0 49.3 8.7 3 85 A P - 0 0 16 0, 0.0 2,-0.7 0, 0.0 52,-0.0 -0.203 40.7-121.6 -56.0 135.7 45.8 46.3 10.7 4 86 A D - 0 0 86 1,-0.1 3,-0.2 2,-0.0 51,-0.0 -0.726 27.7-168.7 -77.1 110.3 46.3 46.9 14.5 5 87 A E S S+ 0 0 165 -2,-0.7 -1,-0.1 1,-0.2 0, 0.0 0.650 78.0 47.3 -88.6 -9.3 49.9 45.6 14.9 6 88 A T S S+ 0 0 128 2,-0.1 -1,-0.2 0, 0.0 -2,-0.0 0.549 81.3 106.6-107.9 -7.2 50.0 45.6 18.7 7 89 A R S S- 0 0 45 -3,-0.2 2,-0.7 1,-0.1 0, 0.0 -0.387 79.4-114.3 -65.7 151.4 46.6 43.9 19.6 8 90 A V - 0 0 106 1,-0.0 -1,-0.1 -2,-0.0 -2,-0.1 -0.783 36.7-125.2 -91.3 116.2 47.2 40.4 20.9 9 91 A K - 0 0 104 -2,-0.7 2,-0.1 1,-0.1 -1,-0.0 -0.337 22.2-119.0 -63.7 148.4 45.5 38.1 18.2 10 92 A Q > - 0 0 26 1,-0.1 3,-1.7 171,-0.0 4,-0.2 -0.359 24.4-104.4 -86.5 162.3 42.9 35.7 19.2 11 93 A F G > S+ 0 0 34 1,-0.3 3,-2.2 2,-0.2 -1,-0.1 0.917 117.7 55.4 -53.0 -46.8 43.1 31.9 18.9 12 94 A L G > S+ 0 0 9 1,-0.3 40,-2.3 38,-0.2 3,-0.7 0.553 92.5 74.5 -71.8 -0.8 40.7 31.6 15.9 13 95 A E G < S+ 0 0 8 -3,-1.7 -1,-0.3 38,-0.3 -2,-0.2 0.539 82.5 71.1 -79.9 -6.5 42.9 34.1 14.0 14 96 A G G < S+ 0 0 39 -3,-2.2 2,-0.3 -4,-0.2 -1,-0.2 0.275 94.9 60.3 -92.1 15.2 45.5 31.3 13.6 15 97 A F S < S- 0 0 44 -3,-0.7 2,-0.3 -4,-0.0 38,-0.2 -0.932 95.0 -91.1-142.3 156.9 43.3 29.4 11.0 16 98 A N > - 0 0 54 -2,-0.3 3,-2.3 36,-0.2 36,-0.1 -0.516 30.8-137.2 -73.2 127.8 41.8 30.0 7.6 17 99 A I G > S+ 0 0 8 -2,-0.3 3,-1.7 1,-0.3 -1,-0.2 0.782 100.9 69.3 -58.0 -29.7 38.2 31.5 8.0 18 100 A E G 3 S+ 0 0 123 1,-0.3 -1,-0.3 3,-0.0 239,-0.1 0.593 90.4 60.5 -66.1 -7.1 37.0 29.2 5.2 19 101 A T G < S+ 0 0 50 -3,-2.3 2,-0.3 2,-0.0 -1,-0.3 0.340 90.8 91.6 -97.3 6.1 37.5 26.2 7.5 20 102 A F < - 0 0 8 -3,-1.7 2,-0.4 18,-0.1 18,-0.2 -0.757 56.4-161.8-104.6 143.7 34.9 27.6 10.0 21 103 A E E -A 37 0A 14 16,-2.2 16,-3.1 -2,-0.3 2,-0.7 -0.995 20.4-131.0-121.8 138.2 31.2 26.9 10.2 22 104 A M E +A 36 0A 2 -2,-0.4 62,-0.5 60,-0.4 14,-0.2 -0.775 32.4 172.1 -80.3 114.2 28.5 28.9 12.0 23 105 A V E - 0 0 52 12,-2.7 2,-0.3 -2,-0.7 13,-0.1 0.397 51.5 -54.2-110.3 0.9 26.6 26.2 13.9 24 106 A G E -A 35 0A 12 11,-0.8 11,-3.2 2,-0.0 2,-0.4 -0.973 49.4 -92.0 159.5-170.7 24.3 28.3 16.1 25 107 A T E -A 34 0A 79 -2,-0.3 2,-0.4 9,-0.3 9,-0.2 -0.984 24.0-163.4-135.6 147.3 23.9 31.1 18.7 26 108 A L E -A 33 0A 50 7,-2.7 7,-3.1 -2,-0.4 2,-0.4 -0.998 3.1-169.8-130.4 136.6 23.9 30.9 22.5 27 109 A S E +A 32 0A 80 -2,-0.4 5,-0.2 5,-0.2 2,-0.2 -0.978 16.6 157.1-123.2 132.6 22.6 33.6 24.7 28 110 A N E > -A 31 0A 60 3,-2.7 3,-1.1 -2,-0.4 -2,-0.0 -0.678 61.7 -65.8-137.6-166.8 23.1 33.5 28.5 29 111 A A T 3 S+ 0 0 98 1,-0.2 3,-0.1 -2,-0.2 -2,-0.0 0.788 131.4 51.1 -57.9 -23.5 23.2 36.0 31.5 30 112 A Q T 3 S- 0 0 155 1,-0.3 2,-0.3 0, 0.0 -1,-0.2 0.662 118.7 -96.8 -89.0 -17.6 26.4 37.5 30.0 31 113 A G E < -A 28 0A 30 -3,-1.1 -3,-2.7 2,-0.0 2,-0.4 -0.971 56.2 -29.3 139.5-147.1 25.1 38.1 26.4 32 114 A T E -A 27 0A 69 -2,-0.3 15,-0.4 -5,-0.2 2,-0.4 -0.866 44.0-175.9-120.0 140.0 25.1 36.6 23.0 33 115 A F E -A 26 0A 30 -7,-3.1 -7,-2.7 -2,-0.4 2,-0.4 -0.958 21.9-135.0-131.5 145.2 27.7 34.3 21.4 34 116 A A E -AB 25 45A 0 11,-3.1 11,-3.0 -2,-0.4 2,-0.7 -0.809 25.0-132.2 -89.6 143.8 28.0 32.8 17.9 35 117 A L E -AB 24 44A 35 -11,-3.2 -12,-2.7 -2,-0.4 -11,-0.8 -0.844 26.1-169.3-100.5 116.6 29.0 29.1 18.0 36 118 A V E -AB 22 43A 0 7,-2.6 7,-2.7 -2,-0.7 2,-0.7 -0.924 13.5-150.9-112.6 120.9 31.8 28.6 15.5 37 119 A K E +AB 21 42A 47 -16,-3.1 -16,-2.2 -2,-0.6 2,-0.3 -0.783 49.3 111.3 -90.1 115.8 32.9 25.1 14.7 38 120 A G E > + B 0 41A 6 3,-2.5 3,-1.1 -2,-0.7 -18,-0.1 -0.971 50.9 36.7-177.3 161.7 36.6 25.3 13.8 39 121 A A T 3 S- 0 0 32 -2,-0.3 3,-0.1 1,-0.3 244,-0.1 0.828 128.7 -54.8 47.9 38.6 40.1 24.4 14.8 40 122 A G T 3 S+ 0 0 55 243,-0.3 2,-0.3 1,-0.2 160,-0.3 0.743 124.2 51.2 79.4 19.6 38.9 21.0 16.2 41 123 A G E < S-B 38 0A 21 -3,-1.1 -3,-2.5 158,-0.1 2,-0.4 -0.952 84.7 -95.0-161.7-172.9 36.3 22.4 18.5 42 124 A V E -B 37 0A 61 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.988 39.7-160.7-117.1 128.7 33.3 24.7 18.9 43 125 A H E -B 36 0A 10 -7,-2.7 -7,-2.6 -2,-0.4 2,-0.8 -0.840 20.5-130.3-112.8 148.7 34.0 28.2 20.2 44 126 A R E -B 35 0A 126 -2,-0.3 2,-0.4 -9,-0.2 -9,-0.2 -0.875 35.3-169.7 -94.1 109.5 31.8 30.8 21.8 45 127 A V E -B 34 0A 2 -11,-3.0 -11,-3.1 -2,-0.8 2,-0.2 -0.850 4.0-159.0-111.6 132.6 32.6 34.0 19.7 46 128 A R > - 0 0 96 -2,-0.4 3,-2.4 -13,-0.2 12,-0.3 -0.649 34.9 -85.5-104.3 162.8 31.4 37.5 20.7 47 129 A V T 3 S+ 0 0 87 -15,-0.4 12,-0.2 1,-0.3 3,-0.1 -0.485 122.1 34.5 -58.9 128.4 30.9 40.7 18.8 48 130 A G T 3 S+ 0 0 33 10,-2.8 -1,-0.3 1,-0.4 11,-0.1 0.252 94.5 113.8 99.7 -11.2 34.3 42.3 18.8 49 131 A D < - 0 0 3 -3,-2.4 9,-3.2 9,-0.1 -1,-0.4 -0.291 62.5-122.5 -74.8 173.2 36.1 38.9 18.6 50 132 A Y E -C 57 0B 39 7,-0.2 2,-0.4 -3,-0.1 -38,-0.2 -0.935 20.4-169.1-128.3 148.9 38.2 38.0 15.5 51 133 A L E > +C 56 0B 0 5,-2.4 5,-0.6 -2,-0.3 3,-0.3 -1.000 49.2 0.3-137.9 130.2 38.1 35.1 13.0 52 134 A G T 5S- 0 0 0 -40,-2.3 3,-0.5 -2,-0.4 -36,-0.2 -0.083 89.3 -63.6 89.0 177.2 40.6 34.2 10.4 53 135 A R T 5S+ 0 0 147 1,-0.2 -1,-0.2 -38,-0.2 -37,-0.1 0.433 115.1 67.0 -88.6 2.9 44.0 35.4 9.1 54 136 A N T 5S- 0 0 62 -3,-0.3 16,-2.2 17,-0.0 -1,-0.2 -0.227 115.8 -93.3-118.6 43.5 42.9 38.8 7.8 55 137 A D T 5 - 0 0 17 -3,-0.5 2,-1.1 1,-0.2 13,-0.1 0.842 56.7-175.2 53.7 35.1 41.9 40.7 11.0 56 138 A G E < -C 51 0B 0 -5,-0.6 -5,-2.4 -4,-0.2 2,-0.4 -0.483 5.7-163.0 -67.1 98.0 38.3 39.6 10.5 57 139 A K E -CD 50 68B 92 11,-2.2 11,-2.1 -2,-1.1 2,-0.5 -0.665 19.2-126.1 -87.6 128.7 36.5 41.4 13.4 58 140 A V E + D 0 67B 1 -9,-3.2 -10,-2.8 -2,-0.4 9,-0.3 -0.627 35.2 170.0 -71.2 119.7 33.0 40.1 14.2 59 141 A V E + 0 0 68 7,-2.6 2,-0.3 -2,-0.5 8,-0.2 0.513 59.9 18.6-113.0 -8.2 30.7 43.1 14.0 60 142 A G E - D 0 66B 17 6,-1.4 6,-2.8 -14,-0.1 2,-0.4 -0.958 46.1-169.8-163.8 143.9 27.3 41.4 14.3 61 143 A I E D 0 65B 28 -2,-0.3 4,-0.2 4,-0.2 -14,-0.1 -0.976 360.0 360.0-131.5 119.2 25.6 38.2 15.3 62 144 A S 0 0 128 2,-2.5 -2,-0.0 -2,-0.4 -28,-0.0 -0.907 360.0 360.0-175.0 360.0 21.9 37.9 14.3 63 ! 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 64 147 A K 0 0 109 0, 0.0 -2,-2.5 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 140.9 24.5 34.9 10.6 65 148 A I E -DE 61 81B 0 16,-2.6 16,-1.7 -4,-0.2 2,-0.5 -0.933 360.0-153.5-106.5 127.5 27.8 36.2 11.7 66 149 A D E -DE 60 80B 57 -6,-2.8 -7,-2.6 -2,-0.5 -6,-1.4 -0.886 16.4-178.9-103.5 130.9 29.0 39.4 10.0 67 150 A V E -DE 58 79B 1 12,-2.8 12,-2.4 -2,-0.5 2,-0.5 -0.929 18.7-152.1-125.7 144.1 32.8 40.0 9.9 68 151 A I E -DE 57 78B 51 -11,-2.1 -11,-2.2 -2,-0.3 2,-0.2 -0.963 18.1-167.8-121.1 112.9 34.8 42.8 8.4 69 152 A E E - E 0 77B 1 8,-2.7 8,-2.7 -2,-0.5 2,-0.5 -0.528 17.1-134.7 -87.8 163.6 38.3 41.8 7.3 70 153 A I E + E 0 76B 29 -16,-2.2 6,-0.2 6,-0.2 -14,-0.1 -0.986 34.7 167.9-118.5 124.0 41.1 44.2 6.4 71 154 A V E E 0 75B 9 4,-2.3 4,-2.8 -2,-0.5 -17,-0.0 -0.912 360.0 360.0-136.5 157.5 42.9 43.2 3.1 72 155 A P 0 0 130 0, 0.0 -1,-0.0 0, 0.0 0, 0.0 -0.355 360.0 360.0 -60.0 360.0 45.4 44.8 0.7 73 ! 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 74 161 A W 0 0 158 0, 0.0 2,-0.3 0, 0.0 -4,-0.0 0.000 360.0 360.0 360.0 157.1 44.2 48.6 2.9 75 162 A L E -E 71 0B 85 -4,-2.8 -4,-2.3 2,-0.0 2,-0.4 -0.919 360.0-113.1-130.7 165.3 40.5 48.1 2.5 76 163 A E E -E 70 0B 116 -2,-0.3 -6,-0.2 -6,-0.2 -8,-0.0 -0.782 29.7-172.8 -95.6 133.3 37.5 46.7 4.5 77 164 A R E -E 69 0B 99 -8,-2.7 -8,-2.7 -2,-0.4 2,-0.1 -0.932 12.9-145.8-133.2 105.2 36.0 43.6 3.1 78 165 A P E +E 68 0B 100 0, 0.0 2,-0.3 0, 0.0 -10,-0.2 -0.365 23.2 170.6 -67.7 148.4 32.8 42.2 4.7 79 166 A R E -E 67 0B 75 -12,-2.4 -12,-2.8 -2,-0.1 2,-0.3 -0.947 12.9-155.1-147.5 167.5 32.2 38.5 4.9 80 167 A S E -E 66 0B 62 -2,-0.3 2,-0.4 -14,-0.2 -14,-0.2 -0.973 13.2-150.1-144.4 160.6 29.7 36.3 6.6 81 168 A L E -E 65 0B 15 -16,-1.7 -16,-2.6 -2,-0.3 2,-0.4 -0.998 26.7-161.7-128.4 128.5 29.2 32.8 8.0 82 169 A T - 0 0 65 -2,-0.4 -60,-0.4 -18,-0.2 2,-0.3 -0.886 19.6-114.5-120.0 145.6 25.6 31.6 7.9 83 170 A L 0 0 96 -2,-0.4 -60,-0.1 1,-0.1 -62,-0.0 -0.561 360.0 360.0 -70.8 138.7 23.8 28.8 9.6 84 171 A K 0 0 92 -62,-0.5 -1,-0.1 -2,-0.3 168,-0.1 -0.133 360.0 360.0 -66.9 360.0 22.6 25.9 7.4 85 !* 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 86 89 B R 0 0 138 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 137.9 32.8 -10.4 22.0 87 90 B V - 0 0 138 1,-0.1 0, 0.0 0, 0.0 0, 0.0 -0.642 360.0-123.1 -76.9 121.7 30.1 -7.6 22.3 88 91 B K - 0 0 125 -2,-0.4 2,-0.3 1,-0.1 -1,-0.1 -0.210 17.8-131.6 -71.7 154.7 32.0 -4.3 21.5 89 92 B Q > - 0 0 63 1,-0.1 3,-1.9 0, 0.0 4,-0.2 -0.778 18.4-118.1-107.5 154.2 32.1 -1.4 23.9 90 93 B F G > S+ 0 0 144 -2,-0.3 3,-2.0 1,-0.3 -1,-0.1 0.870 111.3 60.7 -57.3 -43.1 31.4 2.3 22.9 91 94 B L G > S+ 0 0 18 1,-0.3 40,-2.1 38,-0.2 3,-0.5 0.525 87.4 74.7 -72.9 2.8 34.9 3.4 23.9 92 95 B E G < S+ 0 0 12 -3,-1.9 -1,-0.3 38,-0.2 -2,-0.2 0.490 80.0 74.7 -81.6 -5.1 36.4 1.1 21.3 93 96 B G G < S+ 0 0 41 -3,-2.0 2,-0.3 -4,-0.2 -1,-0.2 0.023 90.7 66.7 -95.5 28.5 35.3 3.6 18.6 94 97 B F S < S- 0 0 55 -3,-0.5 2,-0.2 24,-0.0 38,-0.1 -0.991 93.0 -98.4-141.3 150.6 38.1 6.1 19.5 95 98 B N > - 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