==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-MAR-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 04-OCT-10 3P3E . COMPND 2 MOLECULE: UDP-3-O-[3-HYDROXYMYRISTOYL] N-ACETYLGLUCOSAMINE . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA; . AUTHOR C.-J LEE,P.ZHOU . 297 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13763.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 194 65.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 23 7.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 54 18.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 1.0 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 . 20 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 50 16.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.0 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 1 0 0 0 0 2 1 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 2 0 1 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 PARALLEL BRIDGES PER LADDER . 2 0 1 4 3 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 ANTIPARALLEL BRIDGES PER LADDER . 1 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 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 86 0, 0.0 2,-0.6 0, 0.0 286,-0.3 0.000 360.0 360.0 360.0 155.7 6.3 -10.3 -9.5 2 2 A I - 0 0 21 284,-2.2 124,-2.8 124,-0.2 284,-0.3 -0.718 360.0-147.3 -75.7 122.6 3.6 -7.6 -9.1 3 3 A K E -A 125 0A 66 -2,-0.6 122,-0.2 122,-0.3 120,-0.1 -0.575 12.9-103.0 -97.7 154.8 2.6 -8.0 -5.5 4 4 A Q E - 0 0 7 120,-2.5 118,-2.7 118,-0.4 2,-0.4 -0.316 40.4-144.1 -64.6 157.5 -0.7 -7.6 -3.7 5 5 A R E +A 121 0A 21 116,-0.2 85,-1.9 82,-0.2 84,-1.6 -0.970 24.7 163.6-133.5 141.0 -1.1 -4.4 -1.7 6 6 A T E -A 120 0A 6 114,-2.5 114,-2.9 -2,-0.4 2,-0.2 -0.740 46.2 -72.1-134.8-171.6 -2.7 -3.4 1.5 7 7 A L E -A 119 0A 2 83,-0.5 112,-0.2 -2,-0.2 24,-0.1 -0.627 25.8-146.0 -86.6 150.2 -2.4 -0.4 3.9 8 8 A K S S+ 0 0 118 110,-2.1 2,-0.3 -2,-0.2 110,-0.1 0.749 81.0 13.3 -83.7 -26.5 0.6 0.0 6.2 9 9 A N S S- 0 0 93 109,-0.4 2,-0.2 20,-0.0 -1,-0.2 -0.959 82.0 -96.9-145.4 161.0 -1.4 1.5 9.0 10 10 A I - 0 0 88 -2,-0.3 2,-0.3 19,-0.1 19,-0.2 -0.575 44.4-176.2 -73.6 141.7 -4.9 2.0 10.3 11 11 A I E -B 28 0B 42 17,-2.2 17,-3.0 -2,-0.2 2,-0.3 -0.991 6.6-157.8-145.4 150.9 -6.4 5.4 9.4 12 12 A R E +B 27 0B 157 -2,-0.3 2,-0.3 15,-0.2 15,-0.2 -0.888 13.1 169.7-132.4 155.8 -9.6 7.2 10.3 13 13 A A E -B 26 0B 19 13,-2.1 13,-2.9 -2,-0.3 2,-0.3 -0.968 17.5-143.4-153.0 164.6 -11.9 10.0 9.1 14 14 A T E +B 25 0B 72 -2,-0.3 2,-0.3 11,-0.2 11,-0.2 -0.934 31.3 131.5-128.3 155.8 -15.4 11.3 9.9 15 15 A G E -B 24 0B 18 9,-1.9 9,-3.0 -2,-0.3 2,-0.3 -0.918 47.2 -84.6-171.4-163.0 -18.1 12.8 7.8 16 16 A V E -B 23 0B 57 -2,-0.3 86,-2.7 7,-0.3 87,-0.4 -0.936 38.2-107.3-124.4 150.5 -21.9 12.6 7.0 17 17 A G > - 0 0 1 5,-1.9 4,-1.9 -2,-0.3 191,-0.1 -0.556 20.5-141.9 -72.8 138.3 -23.8 10.3 4.7 18 18 A L T 4 S+ 0 0 32 82,-0.5 190,-2.7 -2,-0.2 191,-0.7 0.949 100.1 34.8 -63.1 -52.4 -25.1 12.0 1.6 19 19 A H T 4 S+ 0 0 48 187,-0.2 188,-1.8 188,-0.2 187,-0.3 0.939 131.3 30.4 -67.7 -47.8 -28.4 10.2 1.5 20 20 A S T 4 S- 0 0 44 186,-0.2 -2,-0.2 187,-0.1 -1,-0.1 0.751 85.6-140.2 -90.7 -28.7 -29.0 10.0 5.3 21 21 A G < + 0 0 30 -4,-1.9 2,-0.3 1,-0.3 -3,-0.1 0.518 53.4 145.8 76.5 6.1 -27.2 13.1 6.6 22 22 A E - 0 0 102 1,-0.1 -5,-1.9 -6,-0.1 -1,-0.3 -0.575 55.3-116.3 -82.6 131.8 -26.0 10.9 9.5 23 23 A K E -B 16 0B 123 -2,-0.3 2,-0.4 -7,-0.2 -7,-0.3 -0.459 41.3-172.0 -62.5 136.6 -22.6 11.5 11.1 24 24 A V E -B 15 0B 1 -9,-3.0 -9,-1.9 -2,-0.1 2,-0.5 -0.993 23.2-138.8-140.0 140.2 -20.4 8.5 10.5 25 25 A Y E -B 14 0B 128 -2,-0.4 71,-1.4 -11,-0.2 2,-0.4 -0.863 21.9-162.6 -96.1 130.1 -17.0 7.3 11.6 26 26 A L E -BC 13 95B 1 -13,-2.9 -13,-2.1 -2,-0.5 2,-0.4 -0.939 8.1-176.6-116.1 134.2 -14.9 5.6 8.9 27 27 A T E -BC 12 94B 10 67,-2.1 67,-2.5 -2,-0.4 2,-0.4 -0.997 9.1-162.2-129.5 130.3 -11.8 3.4 9.6 28 28 A L E -BC 11 93B 1 -17,-3.0 -17,-2.2 -2,-0.4 65,-0.2 -0.939 18.9-179.8-109.2 132.8 -9.5 1.8 7.0 29 29 A K E - C 0 92B 54 63,-2.8 63,-2.2 -2,-0.4 -22,-0.2 -0.943 31.2-101.2-132.4 151.2 -7.4 -1.1 8.1 30 30 A P - 0 0 47 0, 0.0 61,-0.2 0, 0.0 62,-0.1 -0.254 39.7-167.2 -58.2 156.2 -4.7 -3.4 6.7 31 31 A A - 0 0 7 59,-0.5 59,-0.1 -24,-0.1 3,-0.1 -0.983 22.1 -96.1-146.8 155.6 -5.9 -6.9 5.7 32 32 A P > - 0 0 76 0, 0.0 3,-1.4 0, 0.0 4,-0.3 -0.092 56.6 -70.3 -66.8 167.4 -4.2 -10.2 4.8 33 33 A V T 3 S+ 0 0 48 1,-0.2 -27,-0.0 2,-0.1 90,-0.0 -0.215 118.4 16.4 -53.6 144.3 -3.5 -11.5 1.3 34 34 A D T 3 S+ 0 0 104 -3,-0.1 -1,-0.2 1,-0.1 56,-0.0 0.641 91.0 114.3 65.3 17.5 -6.6 -12.6 -0.7 35 35 A T < - 0 0 39 -3,-1.4 -2,-0.1 1,-0.2 55,-0.1 0.849 54.2-165.5 -80.3 -36.5 -9.0 -10.8 1.6 36 36 A G - 0 0 21 -4,-0.3 55,-2.2 -5,-0.1 2,-0.5 -0.442 49.2 -41.0 72.4-160.1 -10.2 -8.2 -0.9 37 37 A I E -d 91 0B 11 15,-0.3 15,-3.1 53,-0.2 2,-0.5 -0.900 62.7-173.7-101.4 126.4 -12.1 -5.3 0.6 38 38 A V E -dE 92 51B 12 53,-2.1 55,-2.6 -2,-0.5 2,-0.3 -0.985 11.8-149.1-123.2 124.6 -14.6 -6.1 3.4 39 39 A F E -dE 93 50B 0 11,-2.5 11,-2.8 -2,-0.5 2,-0.4 -0.685 12.0-162.0 -87.3 142.7 -16.9 -3.6 5.0 40 40 A S E -dE 94 49B 9 53,-2.8 55,-2.7 -2,-0.3 2,-1.1 -0.992 17.0-148.5-128.6 127.9 -17.9 -4.0 8.6 41 41 A R E > +dE 95 48B 23 7,-2.7 7,-1.1 -2,-0.4 3,-1.0 -0.787 22.3 177.2 -89.0 93.6 -20.9 -2.3 10.4 42 42 A T T 3 S+ 0 0 59 53,-1.7 54,-0.2 -2,-1.1 -1,-0.2 0.559 70.5 68.7 -80.9 -7.8 -19.3 -2.0 13.8 43 43 A D T 3 S+ 0 0 76 52,-0.8 -1,-0.2 5,-0.1 2,-0.1 0.709 88.1 84.4 -78.6 -20.4 -22.3 -0.2 15.2 44 44 A L S < S- 0 0 51 -3,-1.0 53,-0.0 4,-0.1 0, 0.0 -0.420 82.5-113.9 -86.4 158.3 -24.4 -3.4 15.0 45 45 A D S S+ 0 0 162 1,-0.2 2,-0.2 -2,-0.1 -3,-0.0 -0.916 111.3 27.2-137.1 106.4 -24.5 -6.3 17.5 46 46 A P S S- 0 0 98 0, 0.0 -1,-0.2 0, 0.0 2,-0.1 0.530 110.7-117.2 -71.2 162.6 -23.4 -8.7 16.2 47 47 A V - 0 0 75 -2,-0.2 2,-0.5 -5,-0.1 -5,-0.2 -0.463 28.9-142.0 -65.1 137.4 -21.0 -6.8 13.9 48 48 A V E -E 41 0B 28 -7,-1.1 -7,-2.7 -2,-0.1 2,-0.4 -0.914 11.0-158.8-112.0 129.2 -21.9 -7.5 10.2 49 49 A E E -E 40 0B 104 -2,-0.5 -9,-0.2 -9,-0.2 -11,-0.0 -0.855 7.4-174.8-106.0 139.3 -19.3 -8.0 7.5 50 50 A I E -E 39 0B 0 -11,-2.8 -11,-2.5 -2,-0.4 18,-0.1 -0.925 20.6-136.3-135.1 111.0 -20.0 -7.5 3.8 51 51 A P E -E 38 0B 48 0, 0.0 2,-1.9 0, 0.0 -13,-0.3 -0.372 25.7-117.1 -60.4 139.4 -17.3 -8.3 1.2 52 52 A A + 0 0 7 -15,-3.1 2,-0.3 14,-0.1 -15,-0.3 -0.587 67.6 131.9 -80.3 80.8 -17.1 -5.7 -1.6 53 53 A R > - 0 0 111 -2,-1.9 3,-2.1 196,-0.1 4,-0.2 -0.948 69.6-113.4-134.5 153.6 -18.1 -8.0 -4.4 54 54 A A G > S+ 0 0 3 194,-2.0 3,-1.5 -2,-0.3 218,-0.1 0.829 112.9 62.1 -54.7 -36.0 -20.6 -7.7 -7.3 55 55 A E G 3 S+ 0 0 161 1,-0.3 -1,-0.3 193,-0.2 -3,-0.1 0.594 100.5 54.5 -70.2 -10.4 -22.7 -10.5 -5.9 56 56 A N G < S+ 0 0 38 -3,-2.1 11,-2.8 192,-0.1 2,-0.4 0.354 79.0 114.7-105.4 4.1 -23.4 -8.5 -2.7 57 57 A V B < +F 66 0C 19 -3,-1.5 9,-0.2 -4,-0.2 3,-0.1 -0.614 33.5 164.6 -75.6 128.6 -24.7 -5.4 -4.5 58 58 A G + 0 0 40 7,-2.8 -1,-0.1 -2,-0.4 8,-0.1 0.503 54.1 27.3-103.6-103.2 -28.4 -4.8 -3.7 59 59 A E - 0 0 92 1,-0.1 6,-1.9 5,-0.1 -1,-0.4 -0.271 51.0-174.6 -65.8 142.4 -29.8 -1.4 -4.5 60 60 A T + 0 0 39 4,-0.2 2,-0.8 -3,-0.1 205,-0.3 -0.602 24.8 149.3-133.6 72.8 -28.4 0.8 -7.3 61 61 A T S S- 0 0 81 2,-0.2 3,-0.1 -2,-0.1 -2,-0.1 -0.812 90.9 -45.7-108.2 88.5 -30.3 4.0 -7.0 62 62 A M S S+ 0 0 162 -2,-0.8 2,-0.3 1,-0.1 -1,-0.1 0.564 137.6 51.0 60.4 9.1 -27.9 6.7 -8.2 63 63 A S S S- 0 0 3 14,-0.0 2,-0.5 2,-0.0 -2,-0.2 -0.963 88.9-104.6-159.7 170.5 -25.4 4.9 -5.9 64 64 A T - 0 0 0 -2,-0.3 12,-1.9 -4,-0.2 2,-0.4 -0.929 33.7-170.4-110.0 125.3 -24.0 1.4 -5.2 65 65 A T - 0 0 1 -6,-1.9 -7,-2.8 -2,-0.5 2,-0.4 -0.954 13.2-148.3-119.1 128.6 -25.2 -0.3 -2.0 66 66 A L E -FG 57 73C 0 7,-2.7 7,-2.6 -2,-0.4 2,-0.3 -0.759 24.2-171.1 -89.5 141.9 -23.8 -3.5 -0.5 67 67 A V E + G 0 72C 36 -11,-2.8 2,-0.3 -2,-0.4 5,-0.2 -0.978 25.9 177.2-136.3 146.2 -26.4 -5.7 1.3 68 68 A K E > S- G 0 71C 107 3,-2.5 3,-2.0 -2,-0.3 2,-0.3 -0.827 74.5 -52.0-144.5 106.2 -26.5 -8.7 3.5 69 69 A G T 3 S- 0 0 65 -2,-0.3 -1,-0.1 1,-0.3 0, 0.0 -0.484 122.6 -19.3 62.8-124.1 -30.0 -9.5 4.6 70 70 A D T 3 S+ 0 0 166 -2,-0.3 2,-0.4 -3,-0.1 -1,-0.3 0.368 118.6 98.7 -94.7 3.8 -31.5 -6.4 6.1 71 71 A V E < -G 68 0C 29 -3,-2.0 -3,-2.5 2,-0.0 2,-0.3 -0.793 53.3-174.5 -99.1 132.7 -28.1 -4.8 6.7 72 72 A K E -G 67 0C 90 -2,-0.4 2,-0.4 -5,-0.2 -5,-0.2 -0.901 26.4-161.5-127.2 151.6 -26.8 -2.2 4.1 73 73 A V E -G 66 0C 1 -7,-2.6 -7,-2.7 -2,-0.3 3,-0.3 -0.947 30.6-159.4-125.6 110.1 -23.7 -0.2 3.4 74 74 A D B +h 99 0D 31 24,-2.5 26,-2.3 -2,-0.4 -9,-0.2 -0.543 56.8 16.4 -94.3 153.1 -24.6 2.6 1.1 75 75 A T + 0 0 4 -11,-0.3 4,-0.3 -2,-0.2 3,-0.3 0.926 64.2 152.7 60.2 56.5 -22.6 4.8 -1.3 76 76 A V > + 0 0 0 -12,-1.9 4,-2.4 -3,-0.3 5,-0.2 0.598 45.1 91.1 -88.0 -10.1 -19.5 2.7 -1.6 77 77 A E H > S+ 0 0 7 -13,-0.3 4,-1.6 1,-0.2 -1,-0.2 0.789 82.8 46.7 -66.7 -36.1 -18.5 3.8 -5.0 78 78 A H H > S+ 0 0 8 -3,-0.3 4,-1.6 2,-0.2 -1,-0.2 0.917 115.7 45.2 -75.8 -40.8 -16.2 6.8 -4.3 79 79 A L H > S+ 0 0 1 -4,-0.3 4,-2.1 1,-0.2 -2,-0.2 0.926 114.1 49.6 -63.0 -45.6 -14.2 5.1 -1.6 80 80 A L H X S+ 0 0 2 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.844 105.1 58.6 -64.6 -31.1 -13.9 2.0 -3.8 81 81 A S H X S+ 0 0 0 -4,-1.6 4,-2.7 -5,-0.2 -1,-0.2 0.921 106.9 47.4 -62.0 -42.9 -12.7 4.1 -6.7 82 82 A A H X S+ 0 0 0 -4,-1.6 4,-1.9 2,-0.2 -2,-0.2 0.903 110.8 51.4 -64.4 -42.8 -9.8 5.4 -4.6 83 83 A M H <>S+ 0 0 0 -4,-2.1 5,-2.7 1,-0.2 4,-0.4 0.927 113.6 44.9 -58.8 -46.0 -9.0 1.8 -3.6 84 84 A A H ><5S+ 0 0 12 -4,-2.6 3,-1.0 1,-0.2 -2,-0.2 0.924 111.6 52.1 -64.0 -45.1 -9.0 0.7 -7.2 85 85 A G H 3<5S+ 0 0 26 -4,-2.7 -1,-0.2 1,-0.3 96,-0.2 0.806 114.3 42.1 -64.9 -31.3 -7.0 3.7 -8.4 86 86 A L T 3<5S- 0 0 18 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.368 113.4-116.3 -98.1 2.2 -4.2 3.2 -5.8 87 87 A G T < 5 + 0 0 1 -3,-1.0 2,-0.8 -4,-0.4 -3,-0.2 0.877 50.1 167.3 69.0 40.6 -4.1 -0.6 -6.3 88 88 A I < + 0 0 0 -5,-2.7 -1,-0.2 1,-0.2 -82,-0.2 -0.802 8.9 174.8 -88.5 111.9 -5.3 -1.6 -2.8 89 89 A D + 0 0 10 -84,-1.6 2,-0.4 -2,-0.8 -83,-0.2 0.860 64.5 35.0 -80.8 -40.5 -6.1 -5.4 -3.0 90 90 A N + 0 0 3 -85,-1.9 -83,-0.5 -59,-0.1 -59,-0.5 -0.967 67.7 129.9-129.9 128.2 -6.8 -6.0 0.7 91 91 A A E - 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