==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-APR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 04-FEB-13 3ZLT . COMPND 2 MOLECULE: ACETYLCHOLINESTERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR E.ARTURSSON,P.O.ANDERSSON,C.AKFUR,A.LINUSSON,S.BORJEGREN,F.E . 1069 4 6 4 2 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 38173.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 680 63.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 100 9.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 64 6.0 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 . 0 0.0 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-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 . 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 . 62 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 125 11.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 279 26.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 17 1.6 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 6 3 6 2 3 1 1 5 0 2 1 1 4 0 0 0 2 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 3 4 2 4 1 3 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 . 3 0 0 6 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 . 3 2 0 0 0 0 0 0 0 1 1 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 E 0 0 169 0, 0.0 4,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 178.0 31.1 15.0 55.6 2 2 A G + 0 0 64 2,-0.0 0, 0.0 0, 0.0 0, 0.0 -0.317 360.0 38.7 151.2 -57.9 28.4 15.6 58.2 3 3 A R S S+ 0 0 251 2,-0.1 2,-0.1 3,-0.0 0, 0.0 0.265 94.0 102.7-105.4 8.3 26.3 18.6 57.1 4 4 A E S S- 0 0 66 1,-0.1 5,-0.1 2,-0.0 -2,-0.0 -0.356 86.4 -81.5 -87.8 171.7 26.2 17.8 53.4 5 5 A D > - 0 0 47 1,-0.1 3,-1.8 -2,-0.1 4,-0.2 -0.620 33.5-144.6 -75.4 120.3 23.3 16.3 51.4 6 6 A P G > S+ 0 0 109 0, 0.0 3,-0.7 0, 0.0 -1,-0.1 0.700 97.1 59.4 -55.4 -25.4 23.4 12.5 51.8 7 7 A Q G 3 S+ 0 0 44 1,-0.2 100,-0.1 3,-0.0 -2,-0.0 0.575 98.5 58.8 -82.9 -7.7 22.2 11.9 48.2 8 8 A L G < S+ 0 0 19 -3,-1.8 11,-2.7 11,-0.1 2,-0.6 0.323 83.3 90.2-104.9 7.0 25.3 13.8 46.8 9 9 A L E < +A 18 0A 34 -3,-0.7 2,-0.4 9,-0.2 9,-0.2 -0.918 51.2 163.0-110.0 116.7 28.0 11.6 48.2 10 10 A V E -A 17 0A 9 7,-2.4 7,-3.8 -2,-0.6 2,-0.4 -0.975 27.4-144.1-134.3 144.6 29.1 8.7 46.0 11 11 A R E +A 16 0A 162 -2,-0.4 2,-0.3 5,-0.2 5,-0.2 -0.923 20.0 177.3-106.5 135.5 32.1 6.4 45.9 12 12 A V E > -A 15 0A 7 3,-3.3 3,-2.2 -2,-0.4 174,-0.1 -0.818 49.7 -84.5-124.2 171.8 33.6 5.0 42.7 13 13 A R T 3 S+ 0 0 163 1,-0.3 3,-0.1 -2,-0.3 169,-0.0 0.773 127.5 44.0 -45.2 -37.6 36.6 2.8 42.0 14 14 A G T 3 S- 0 0 9 1,-0.2 42,-2.7 22,-0.1 2,-0.3 0.560 124.0 -75.4 -90.4 -9.4 39.0 5.8 42.0 15 15 A G E < -A 12 0A 9 -3,-2.2 -3,-3.3 40,-0.2 2,-0.3 -0.988 66.0 -26.5 150.8-161.7 37.6 7.5 45.0 16 16 A Q E -Ab 11 59A 53 42,-1.0 44,-3.1 -2,-0.3 2,-0.4 -0.738 46.1-161.6 -99.3 140.1 34.9 9.6 46.6 17 17 A L E -Ab 10 60A 1 -7,-3.8 -7,-2.4 -2,-0.3 2,-0.5 -0.950 11.6-158.6-123.1 140.2 32.7 12.1 44.7 18 18 A R E -Ab 9 61A 65 42,-2.3 44,-2.6 -2,-0.4 -9,-0.2 -0.972 22.7-172.8-111.7 118.1 30.5 15.1 45.8 19 19 A G - 0 0 3 -11,-2.7 2,-0.4 -2,-0.5 13,-0.2 -0.156 18.6-110.2 -94.0-168.1 27.8 15.9 43.3 20 20 A I E -C 31 0B 55 11,-2.7 11,-2.7 42,-0.3 2,-0.6 -0.959 15.0-126.8-130.2 143.3 25.3 18.8 43.0 21 21 A R E -C 30 0B 131 -2,-0.4 2,-0.3 9,-0.2 9,-0.2 -0.823 35.9-166.7 -87.9 117.9 21.6 18.9 43.4 22 22 A L E -C 29 0B 32 7,-2.9 7,-2.3 -2,-0.6 2,-0.6 -0.779 18.7-119.8-109.2 154.0 20.2 20.6 40.2 23 23 A K E -C 28 0B 134 -2,-0.3 113,-0.1 5,-0.2 7,-0.0 -0.823 27.7-179.2 -95.4 121.6 16.8 22.0 39.5 24 24 A A E > -C 27 0B 2 3,-2.3 3,-1.6 -2,-0.6 113,-0.1 -0.733 45.3-100.8-105.7 164.2 14.8 20.5 36.6 25 25 A P T 3 S+ 0 0 55 0, 0.0 -1,-0.1 0, 0.0 112,-0.0 0.877 121.6 37.0 -56.4 -38.2 11.4 21.8 35.7 26 26 A G T 3 S- 0 0 56 1,-0.2 -3,-0.0 111,-0.1 111,-0.0 0.234 131.7 -50.2 -98.2 13.6 9.5 19.0 37.5 27 27 A G E < S-C 24 0B 13 -3,-1.6 -3,-2.3 2,-0.0 -1,-0.2 -0.845 76.1 -44.5 142.4 178.6 11.8 18.6 40.4 28 28 A P E -C 23 0B 32 0, 0.0 77,-0.7 0, 0.0 2,-0.3 -0.428 42.0-166.9 -82.8 153.5 15.5 18.1 41.4 29 29 A V E -CD 22 104B 0 -7,-2.3 -7,-2.9 75,-0.2 2,-0.4 -0.922 23.2-116.6-128.5 160.7 18.1 15.8 39.9 30 30 A S E -CD 21 103B 0 73,-3.1 73,-2.5 -2,-0.3 2,-0.4 -0.840 30.7-169.4 -94.9 134.9 21.5 14.6 41.0 31 31 A A E -CD 20 102B 0 -11,-2.7 -11,-2.7 -2,-0.4 2,-0.6 -0.984 15.6-171.8-130.4 127.7 24.5 15.6 38.9 32 32 A F E - D 0 101B 0 69,-3.3 69,-2.9 -2,-0.4 2,-0.4 -0.918 23.6-174.7-116.0 101.6 28.1 14.4 39.1 33 33 A L E +m 63 0C 10 29,-2.7 31,-0.7 -2,-0.6 67,-0.2 -0.797 52.6 13.6-110.1 137.3 30.1 16.6 36.7 34 34 A G E + 0 0 4 65,-0.4 -1,-0.2 -2,-0.4 66,-0.2 0.917 68.8 171.1 72.0 44.4 33.7 16.5 35.7 35 35 A I E - D 0 99B 0 64,-3.0 64,-2.5 -3,-0.3 2,-0.2 -0.761 32.1-128.2 -83.6 122.2 34.6 13.0 36.9 36 36 A P E + D 0 98B 7 0, 0.0 62,-0.2 0, 0.0 -22,-0.1 -0.531 33.0 170.9 -77.3 135.9 38.0 12.0 35.6 37 37 A F + 0 0 5 60,-1.3 16,-1.1 -2,-0.2 2,-0.3 0.439 63.3 35.1-117.6 -4.0 38.2 8.6 33.9 38 38 A A B S-N 52 0D 3 59,-0.9 -1,-0.1 14,-0.3 59,-0.1 -0.969 87.9 -93.9-144.4 157.0 41.7 8.8 32.5 39 39 A E - 0 0 27 12,-4.0 12,-0.4 -2,-0.3 14,-0.1 -0.554 66.2 -86.8 -65.8 137.3 45.2 10.1 33.3 40 40 A P - 0 0 33 0, 0.0 2,-2.8 0, 0.0 55,-0.2 -0.305 38.2-134.4 -52.0 116.7 45.5 13.6 31.7 41 41 A P + 0 0 3 0, 0.0 6,-0.2 0, 0.0 2,-0.2 -0.224 61.4 128.3 -77.2 55.1 46.6 12.8 28.1 42 42 A V > - 0 0 61 -2,-2.8 3,-2.7 3,-0.1 2,-0.1 -0.501 55.1 -0.6-107.8 172.1 49.3 15.5 28.2 43 43 A G G > S+ 0 0 47 1,-0.3 3,-1.6 2,-0.2 0, 0.0 -0.283 137.4 4.3 54.1-122.3 53.0 15.8 27.6 44 44 A S G 3 S+ 0 0 91 1,-0.3 -1,-0.3 -2,-0.1 224,-0.0 0.580 128.2 68.2 -66.4 -10.6 54.5 12.5 26.6 45 45 A R G X S+ 0 0 63 -3,-2.7 3,-1.9 -5,-0.1 -1,-0.3 0.580 70.5 118.9 -88.2 -10.6 50.9 11.1 26.7 46 46 A R T < S+ 0 0 13 -3,-1.6 -4,-0.1 1,-0.3 222,-0.1 -0.352 84.0 10.4 -58.3 133.5 49.8 13.2 23.6 47 47 A F T 3 S+ 0 0 2 109,-0.5 122,-0.5 1,-0.3 -1,-0.3 0.257 107.5 117.5 76.9 -5.7 48.6 10.9 20.7 48 48 A M S < S- 0 0 8 -3,-1.9 -1,-0.3 119,-0.1 3,-0.1 -0.566 76.4 -92.6 -92.8 153.0 48.7 7.9 23.1 49 49 A P - 0 0 45 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.231 56.8 -94.7 -52.3 148.9 45.9 5.6 24.2 50 50 A P - 0 0 21 0, 0.0 3,-0.0 0, 0.0 -12,-0.0 -0.492 30.4-141.7 -75.5 140.1 44.4 6.8 27.5 51 51 A E - 0 0 90 -12,-0.4 -12,-4.0 -2,-0.2 3,-0.1 -0.879 33.2-102.0 -93.6 133.8 45.6 5.4 30.8 52 52 A P B -N 38 0D 86 0, 0.0 -14,-0.3 0, 0.0 2,-0.1 -0.190 47.4 -91.9 -53.0 140.8 42.8 4.8 33.3 53 53 A K - 0 0 66 -16,-1.1 3,-0.1 -14,-0.1 -14,-0.1 -0.346 38.4-127.2 -62.9 127.0 42.7 7.4 36.1 54 54 A R - 0 0 166 -2,-0.1 -1,-0.1 1,-0.1 -40,-0.1 -0.515 39.9 -88.3 -72.7 142.3 44.7 6.6 39.1 55 55 A P - 0 0 85 0, 0.0 2,-0.2 0, 0.0 -40,-0.2 -0.117 43.5-147.9 -54.4 146.1 42.8 6.8 42.4 56 56 A W - 0 0 50 -42,-2.7 2,-0.3 2,-0.1 -40,-0.2 -0.662 10.0-119.5-110.6 167.7 42.6 10.1 44.2 57 57 A S S S+ 0 0 118 -2,-0.2 2,-0.1 -42,-0.1 -42,-0.0 -0.821 70.8 10.7-108.5 154.2 42.5 10.9 47.9 58 58 A G S S- 0 0 50 -2,-0.3 -42,-1.0 2,-0.1 2,-0.7 -0.277 106.8 -41.8 80.6-169.6 39.7 12.8 49.6 59 59 A V E -b 16 0A 52 -44,-0.1 2,-0.3 -2,-0.1 -42,-0.2 -0.880 58.1-140.1-100.6 115.4 36.4 13.8 48.2 60 60 A L E -b 17 0A 52 -44,-3.1 -42,-2.3 -2,-0.7 2,-0.7 -0.604 18.6-121.9 -75.0 130.7 36.7 15.0 44.6 61 61 A D E +b 18 0A 75 -2,-0.3 3,-0.2 -44,-0.2 -42,-0.1 -0.663 35.6 172.3 -76.3 115.8 34.4 17.9 43.8 62 62 A A + 0 0 0 -44,-2.6 -29,-2.7 -2,-0.7 -42,-0.3 -0.409 42.7 107.3-120.7 54.4 32.2 16.9 40.9 63 63 A T B S+m 33 0C 30 -31,-0.2 2,-0.3 -44,-0.2 -1,-0.1 0.376 72.3 45.8-116.4 -1.2 29.8 19.9 40.8 64 64 A T S S- 0 0 78 -31,-0.7 -1,-0.1 -3,-0.2 2,-0.1 -0.987 87.0 -95.0-141.0 156.0 31.0 21.6 37.6 65 65 A F - 0 0 38 -2,-0.3 3,-0.1 64,-0.1 2,-0.1 -0.364 42.1-135.7 -67.2 147.3 31.9 20.8 34.1 66 66 A Q - 0 0 66 1,-0.2 63,-0.1 30,-0.1 -1,-0.1 -0.260 39.8 -49.0 -95.1-176.5 35.5 20.2 33.3 67 67 A N - 0 0 27 28,-0.3 2,-0.4 1,-0.1 -1,-0.2 -0.035 51.5-123.2 -51.1 150.0 37.8 21.4 30.5 68 68 A V E -o 92 0E 0 23,-2.6 25,-2.5 -3,-0.1 3,-0.1 -0.796 38.0 -96.8 -93.0 141.0 36.8 21.0 26.9 69 69 A a E -o 93 0E 1 -2,-0.4 25,-0.2 57,-0.3 57,-0.1 -0.325 52.8 -88.4 -60.4 137.5 39.3 19.0 24.7 70 70 A Y S S+ 0 0 49 23,-1.0 83,-0.3 22,-0.1 2,-0.3 -0.216 71.0 145.4 -53.8 127.2 41.6 21.2 22.8 71 71 A Q - 0 0 3 -3,-0.1 54,-0.1 83,-0.1 2,-0.1 -0.986 52.5 -77.0-159.6 163.3 40.0 22.2 19.5 72 72 A Y - 0 0 75 52,-0.8 2,-0.5 -2,-0.3 52,-0.0 -0.435 43.9-140.3 -61.1 136.9 39.3 24.6 16.6 73 73 A V - 0 0 59 -2,-0.1 14,-0.1 14,-0.1 -1,-0.0 -0.930 18.9-118.1-108.8 123.7 36.8 27.3 17.6 74 74 A D + 0 0 23 -2,-0.5 13,-0.0 9,-0.1 9,-0.0 -0.317 37.1 166.6 -65.5 138.7 34.3 28.3 14.9 75 75 A T + 0 0 88 3,-0.1 -1,-0.1 -2,-0.0 9,-0.0 0.277 39.5 111.8-133.3 6.2 34.4 31.9 13.8 76 76 A L S S+ 0 0 68 1,-0.3 -2,-0.0 7,-0.0 -1,-0.0 0.869 94.8 19.5 -56.3 -41.4 32.3 31.9 10.6 77 77 A Y S > S- 0 0 34 3,-0.1 3,-2.0 4,-0.0 -1,-0.3 -0.667 84.3-149.2-133.8 80.1 29.5 34.1 12.3 78 78 A P T 3 S+ 0 0 109 0, 0.0 3,-0.1 0, 0.0 -3,-0.1 -0.255 82.4 6.2 -51.9 114.0 30.8 35.9 15.4 79 79 A G T 3 S+ 0 0 67 1,-0.3 2,-0.4 -2,-0.1 -4,-0.0 0.165 92.8 132.4 99.7 -16.1 28.1 36.4 18.0 80 80 A F X> - 0 0 30 -3,-2.0 4,-2.5 1,-0.1 3,-1.2 -0.562 51.4-147.7 -75.1 123.6 25.5 34.3 16.1 81 81 A E H 3> S+ 0 0 117 -2,-0.4 4,-2.1 1,-0.3 5,-0.2 0.848 92.5 67.7 -63.8 -34.2 23.7 31.8 18.4 82 82 A G H 34 S+ 0 0 0 1,-0.2 -1,-0.3 2,-0.2 351,-0.1 0.778 115.9 26.6 -57.9 -28.1 23.3 29.3 15.6 83 83 A T H X4 S+ 0 0 1 -3,-1.2 3,-1.5 -6,-0.3 4,-0.4 0.779 116.3 60.7 -98.9 -36.5 27.0 28.7 15.5 84 84 A E H >< S+ 0 0 65 -4,-2.5 3,-1.9 1,-0.3 -2,-0.2 0.826 89.3 70.2 -63.7 -35.1 28.0 29.7 19.1 85 85 A M T 3< S+ 0 0 31 -4,-2.1 47,-0.3 1,-0.3 -1,-0.3 0.714 101.6 47.5 -56.8 -21.8 25.8 26.9 20.7 86 86 A W T < S+ 0 0 23 -3,-1.5 -1,-0.3 -5,-0.2 40,-0.2 0.546 92.8 103.2 -95.3 -10.7 28.3 24.4 19.3 87 87 A N S < S- 0 0 20 -3,-1.9 -14,-0.1 -4,-0.4 40,-0.0 -0.371 87.9 -82.7 -75.8 151.8 31.4 26.3 20.6 88 88 A P - 0 0 30 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 -0.175 36.9-169.7 -53.0 142.9 33.4 25.3 23.7 89 89 A N + 0 0 55 2,-0.1 2,-0.3 -3,-0.1 -2,-0.0 0.207 67.4 46.8-125.3 12.5 31.8 26.5 26.9 90 90 A R S S- 0 0 110 1,-0.0 -23,-0.1 0, 0.0 -24,-0.1 -0.889 106.4 -61.8-140.1 169.2 34.6 25.7 29.3 91 91 A E - 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