==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JUN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 08-DEC-10 2Y1K . COMPND 2 MOLECULE: CHOLINESTERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR E.CARLETTI,J.P.COLLETIER,F.NACHON,M.WEIK . 525 2 3 3 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20536.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 335 63.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 44 8.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 32 6.1 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 . 3 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 65 12.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 136 25.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 2.1 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 1 1 2 2 0 0 3 1 0 2 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 1 1 2 1 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 PARALLEL BRIDGES PER LADDER . 2 0 1 2 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 ANTIPARALLEL BRIDGES PER LADDER . 0 1 0 0 0 0 0 0 0 1 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 3 A D 0 0 151 0, 0.0 13,-0.1 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 173.3 36.6 18.0 13.8 2 4 A I + 0 0 43 11,-0.2 11,-1.7 2,-0.0 2,-0.4 -0.477 360.0 164.7-159.4 76.4 33.1 17.7 15.3 3 5 A I E -A 12 0A 64 9,-0.2 2,-0.4 -2,-0.1 9,-0.2 -0.767 16.3-163.9 -87.0 137.6 29.9 18.1 13.2 4 6 A I E -A 11 0A 21 7,-2.5 7,-1.4 -2,-0.4 2,-0.9 -0.986 16.7-133.6-126.0 125.4 26.6 16.9 14.7 5 7 A A E -A 10 0A 64 -2,-0.4 5,-0.2 5,-0.2 2,-0.1 -0.657 29.5-179.1 -80.8 102.2 23.5 16.4 12.5 6 8 A T E > -A 9 0A 10 3,-1.6 3,-0.6 -2,-0.9 173,-0.1 -0.314 44.9 -98.2 -87.3 178.1 20.4 18.0 14.3 7 9 A K T 3 S+ 0 0 141 1,-0.2 3,-0.1 168,-0.1 -1,-0.1 0.921 126.7 49.0 -65.1 -40.6 16.8 18.0 12.9 8 10 A N T 3 S- 0 0 37 1,-0.3 42,-0.5 41,-0.1 -1,-0.2 0.585 128.1 -84.1 -71.0 -16.3 17.3 21.5 11.6 9 11 A G E < -A 6 0A 15 -3,-0.6 -3,-1.6 40,-0.1 -1,-0.3 -0.756 66.4 -29.3 131.5-175.8 20.7 20.6 9.9 10 12 A K E -A 5 0A 113 42,-0.4 44,-2.3 40,-0.3 2,-0.3 -0.311 49.0-169.6 -77.0 149.1 24.4 20.2 10.8 11 13 A V E -Ab 4 54A 0 -7,-1.4 -7,-2.5 42,-0.2 2,-0.4 -0.998 12.5-140.3-141.0 144.6 26.2 22.1 13.4 12 14 A R E -Ab 3 55A 68 42,-3.1 44,-2.4 -2,-0.3 -9,-0.2 -0.856 18.3-173.5-107.1 136.0 29.9 22.6 14.4 13 15 A G - 0 0 4 -11,-1.7 2,-0.4 -2,-0.4 13,-0.2 -0.444 18.1-120.5-111.8-173.9 31.3 22.7 17.9 14 16 A M E -C 25 0B 55 11,-2.8 11,-2.9 42,-0.3 2,-0.2 -0.996 19.1-118.3-136.1 141.1 34.7 23.4 19.4 15 17 A Q E -C 24 0B 96 -2,-0.4 2,-0.4 9,-0.2 9,-0.2 -0.532 27.5-161.8 -73.4 136.5 37.0 21.3 21.7 16 18 A L E -C 23 0B 35 7,-3.1 7,-2.1 -2,-0.2 2,-0.6 -0.949 16.5-133.0-120.1 141.1 37.9 22.7 25.2 17 19 A T E +C 22 0B 122 -2,-0.4 2,-0.4 5,-0.2 5,-0.3 -0.830 36.2 168.2 -89.0 125.4 40.8 21.6 27.4 18 20 A V E > -C 21 0B 5 3,-3.0 3,-0.6 -2,-0.6 -2,-0.1 -0.948 62.1 -22.5-144.5 121.5 39.4 21.1 30.9 19 21 A F T 3 S- 0 0 65 -2,-0.4 3,-0.1 1,-0.3 -1,-0.1 0.903 127.2 -46.6 48.0 54.3 41.2 19.5 33.7 20 22 A G T 3 S+ 0 0 81 1,-0.2 -1,-0.3 0, 0.0 2,-0.2 0.808 130.6 74.1 60.0 32.4 43.6 17.6 31.5 21 23 A G E < S-C 18 0B 16 -3,-0.6 -3,-3.0 2,-0.0 2,-0.4 -0.817 79.3 -93.6-157.5-168.8 40.7 16.5 29.3 22 24 A T E -C 17 0B 52 77,-0.4 77,-1.5 -5,-0.3 2,-0.4 -0.967 20.0-174.4-132.7 131.9 38.3 17.7 26.7 23 25 A V E -CD 16 98B 0 -7,-2.1 -7,-3.1 -2,-0.4 2,-0.6 -0.918 21.7-138.4-115.5 147.4 34.8 19.1 26.6 24 26 A T E -CD 15 97B 5 73,-2.8 73,-2.7 -2,-0.4 2,-0.4 -0.943 21.5-161.3-105.1 124.4 33.0 19.7 23.3 25 27 A A E -CD 14 96B 0 -11,-2.9 -11,-2.8 -2,-0.6 2,-0.5 -0.864 16.8-170.1-108.0 139.8 31.1 23.0 23.3 26 28 A F E - D 0 95B 0 69,-2.6 69,-2.8 -2,-0.4 2,-0.5 -0.942 20.4-175.7-121.6 100.1 28.3 24.0 21.0 27 29 A L E +m 57 0C 9 29,-2.8 31,-0.9 -2,-0.5 67,-0.2 -0.901 56.7 13.2-107.0 126.1 27.7 27.6 21.6 28 30 A G E + 0 0 4 -2,-0.5 -1,-0.2 65,-0.4 66,-0.2 0.944 66.4 170.9 83.7 52.9 24.9 29.6 20.0 29 31 A I E - D 0 93B 0 64,-3.4 64,-2.5 -3,-0.3 -1,-0.2 -0.863 33.2-127.9 -92.4 121.9 22.6 27.1 18.4 30 32 A P E + D 0 92B 5 0, 0.0 62,-0.2 0, 0.0 3,-0.1 -0.408 30.8 174.1 -66.0 146.4 19.4 28.8 17.2 31 33 A Y + 0 0 7 60,-2.1 16,-0.5 1,-0.3 2,-0.3 0.469 62.3 28.0-132.4 -9.5 16.2 27.1 18.5 32 34 A A B S-N 46 0D 2 59,-0.9 -1,-0.3 14,-0.2 14,-0.2 -0.941 92.0 -85.6-141.0 160.1 13.6 29.4 17.3 33 35 A Q - 0 0 63 12,-2.7 12,-0.4 -2,-0.3 14,-0.1 -0.562 64.4 -93.2 -57.3 131.9 12.9 31.9 14.5 34 36 A P - 0 0 43 0, 0.0 2,-2.0 0, 0.0 5,-0.2 -0.272 36.9-127.8 -49.2 126.9 14.4 35.2 15.6 35 37 A P + 0 0 4 0, 0.0 2,-0.3 0, 0.0 6,-0.2 -0.313 60.6 137.6 -83.1 58.4 11.4 37.0 17.2 36 38 A L > - 0 0 77 -2,-2.0 3,-1.6 4,-0.1 2,-0.3 -0.720 57.6 -17.3-105.9 149.6 11.8 40.2 15.1 37 39 A G G > S+ 0 0 46 1,-0.3 3,-1.8 -2,-0.3 0, 0.0 -0.429 136.4 15.5 71.5-125.6 9.3 42.4 13.4 38 40 A R G 3 S+ 0 0 164 1,-0.3 -1,-0.3 -2,-0.3 4,-0.1 0.822 132.4 54.6 -45.7 -37.0 5.9 40.8 12.9 39 41 A L G X S+ 0 0 12 -3,-1.6 3,-1.8 -5,-0.2 -1,-0.3 0.514 73.4 119.5 -81.9 -13.1 7.1 38.3 15.5 40 42 A R T < S+ 0 0 11 -3,-1.8 -4,-0.1 1,-0.3 3,-0.1 -0.471 87.3 11.2 -61.3 130.8 8.1 40.6 18.4 41 43 A F T 3 S+ 0 0 1 108,-0.4 121,-0.4 1,-0.4 -1,-0.3 0.116 105.9 112.6 88.7 -14.9 5.9 39.7 21.4 42 44 A K S < S- 0 0 39 -3,-1.8 -1,-0.4 118,-0.1 117,-0.1 -0.411 80.1 -85.9 -81.6 162.9 4.7 36.5 19.9 43 45 A K - 0 0 71 115,-0.3 2,-0.2 1,-0.1 -1,-0.1 -0.306 61.8 -83.7 -58.1 149.1 5.5 33.0 21.0 44 46 A P - 0 0 17 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.427 48.5-139.1 -66.9 131.7 8.7 31.5 19.5 45 47 A Q - 0 0 69 -12,-0.4 -12,-2.7 -2,-0.2 3,-0.1 -0.647 30.0 -86.0 -97.3 147.9 8.1 30.1 16.0 46 48 A S B -N 32 0D 97 -2,-0.3 -14,-0.2 -14,-0.2 2,-0.1 -0.272 55.6-101.6 -54.6 130.9 9.6 26.8 14.8 47 49 A L - 0 0 18 -16,-0.5 -1,-0.1 -14,-0.1 -14,-0.0 -0.319 30.0-117.7 -66.0 127.0 13.1 27.5 13.3 48 50 A T - 0 0 99 -2,-0.1 2,-0.3 -3,-0.1 -1,-0.1 0.709 43.0-116.6 -23.3 -73.4 13.4 27.6 9.4 49 51 A K - 0 0 157 2,-0.1 2,-0.2 -41,-0.0 -40,-0.1 -0.797 32.4-155.6 137.8 172.9 15.7 24.7 8.5 50 52 A W - 0 0 48 -42,-0.5 -40,-0.3 -2,-0.3 2,-0.1 -0.624 21.5-149.1 169.2 136.3 19.1 24.7 6.8 51 53 A S S S+ 0 0 110 -2,-0.2 -2,-0.1 -42,-0.1 -43,-0.0 -0.295 70.6 51.6 -82.8-179.8 21.8 23.1 4.8 52 54 A D S S- 0 0 81 -2,-0.1 2,-0.5 2,-0.0 -42,-0.4 0.124 99.2 -68.6 58.2 169.9 25.5 24.0 5.3 53 55 A I - 0 0 60 -44,-0.1 2,-0.5 -42,-0.1 -42,-0.2 -0.810 38.2-140.2 -99.6 125.9 27.1 23.8 8.8 54 56 A W E -b 11 0A 90 -44,-2.3 -42,-3.1 -2,-0.5 2,-0.9 -0.724 18.7-134.1 -78.4 123.6 26.1 26.3 11.5 55 57 A N E -b 12 0A 91 -2,-0.5 2,-0.8 -44,-0.2 3,-0.3 -0.739 23.6-179.5 -81.4 109.6 29.2 27.3 13.6 56 58 A A + 0 0 0 -44,-2.4 -29,-2.8 -2,-0.9 -42,-0.3 -0.614 42.7 122.7-104.5 65.1 28.2 27.1 17.2 57 59 A T B +m 27 0C 56 -2,-0.8 2,-0.3 -31,-0.2 -1,-0.2 0.436 65.1 31.4-113.9 -5.7 31.6 28.2 18.2 58 60 A K S S- 0 0 164 -31,-0.9 -1,-0.1 -3,-0.3 2,-0.1 -0.971 93.3 -84.7-150.3 157.2 30.9 31.3 20.3 59 61 A Y - 0 0 51 -2,-0.3 3,-0.1 63,-0.1 -32,-0.1 -0.437 50.0-130.5 -63.5 140.4 28.2 32.5 22.6 60 62 A A - 0 0 21 1,-0.2 62,-0.1 -2,-0.1 -1,-0.1 -0.201 39.9 -57.1 -87.0 174.2 25.3 34.2 20.7 61 63 A N - 0 0 45 28,-0.3 2,-0.3 -33,-0.1 25,-0.2 -0.179 51.5-131.1 -44.0 140.9 23.5 37.5 21.2 62 64 A S B -o 86 0E 0 23,-3.1 25,-1.7 22,-0.1 27,-0.1 -0.791 35.1 -94.9 -92.6 148.6 21.9 38.0 24.6 63 65 A a - 0 0 3 -2,-0.3 25,-0.2 23,-0.2 56,-0.1 -0.251 49.0 -84.0 -63.4 144.4 18.3 39.2 24.7 64 66 A C + 0 0 10 23,-0.3 82,-0.5 22,-0.1 2,-0.2 -0.071 68.5 140.1 -43.4 146.8 17.4 42.9 25.0 65 67 A Q - 0 0 4 -3,-0.1 2,-0.2 80,-0.1 53,-0.1 -0.814 53.0 -92.1 169.3 142.2 17.4 44.0 28.5 66 68 A N - 0 0 55 51,-0.4 2,-0.3 -2,-0.2 81,-0.0 -0.454 42.6-128.9 -69.2 144.0 18.3 46.9 30.8 67 69 A I - 0 0 63 -2,-0.2 2,-0.9 14,-0.1 -1,-0.1 -0.759 16.1-112.2-100.1 142.3 21.7 46.8 32.4 68 70 A D + 0 0 39 -2,-0.3 3,-0.2 9,-0.1 13,-0.1 -0.634 40.0 167.6 -67.3 105.4 22.7 47.2 36.1 69 71 A Q + 0 0 155 -2,-0.9 -1,-0.1 1,-0.1 9,-0.0 0.079 44.2 105.0-105.4 20.5 24.6 50.6 36.2 70 72 A S S S+ 0 0 62 1,-0.2 -1,-0.1 7,-0.0 -2,-0.0 0.855 92.7 24.8 -72.9 -30.8 24.7 51.0 40.0 71 73 A F S > S- 0 0 37 -3,-0.2 3,-2.2 3,-0.1 7,-0.3 -0.544 75.4-168.6-130.0 72.8 28.4 50.0 40.3 72 74 A P T 3 S+ 0 0 103 0, 0.0 3,-0.1 0, 0.0 -3,-0.1 -0.384 81.0 19.2 -56.1 134.5 30.3 50.6 37.1 73 75 A G T 3 S+ 0 0 69 1,-0.2 2,-0.6 2,-0.0 -2,-0.0 0.336 95.5 121.3 90.8 -6.7 33.7 48.9 37.4 74 76 A F <> - 0 0 31 -3,-2.2 4,-2.6 1,-0.1 3,-0.4 -0.807 53.7-153.7-103.2 123.0 32.6 46.6 40.3 75 77 A H H > S+ 0 0 116 -2,-0.6 4,-2.3 1,-0.2 5,-0.1 0.821 88.8 68.9 -64.4 -32.9 32.9 42.9 39.7 76 78 A G H 4 S+ 0 0 0 1,-0.2 -1,-0.2 2,-0.2 4,-0.1 0.906 117.3 20.5 -49.7 -51.0 30.1 42.1 42.2 77 79 A S H >> S+ 0 0 0 -3,-0.4 3,-1.7 -6,-0.2 4,-0.6 0.845 120.2 59.9 -88.8 -37.0 27.4 43.6 40.0 78 80 A E H >< S+ 0 0 78 -4,-2.6 3,-1.2 1,-0.3 -3,-0.2 0.836 88.4 71.5 -72.1 -25.3 29.1 43.5 36.7 79 81 A M T 3< S+ 0 0 28 -4,-2.3 -1,-0.3 1,-0.3 46,-0.3 0.720 100.8 51.4 -54.6 -24.3 29.6 39.7 36.7 80 82 A W T <4 S+ 0 0 59 -3,-1.7 -1,-0.3 -5,-0.1 -2,-0.2 0.653 87.3 98.5 -86.6 -22.0 25.8 39.7 36.1 81 83 A N S << S- 0 0 26 -3,-1.2 -14,-0.1 -4,-0.6 39,-0.1 -0.360 91.7 -83.9 -67.9 149.7 25.6 42.1 33.2 82 84 A P - 0 0 25 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 -0.187 34.4-163.2 -48.4 138.6 25.3 40.6 29.7 83 85 A N S S+ 0 0 83 -3,-0.1 2,-0.3 2,-0.1 -2,-0.0 -0.012 71.0 56.1-121.5 20.4 28.7 39.7 28.3 84 86 A T S S- 0 0 31 39,-0.0 -22,-0.1 0, 0.0 -24,-0.1 -0.948 102.5 -73.0-138.8 160.0 27.5 39.4 24.7 85 87 A D - 0 0 124 -2,-0.3 -23,-3.1 1,-0.1 2,-0.3 -0.087 47.2-123.4 -44.9 139.3 25.7 41.9 22.4 86 88 A L B +o 62 0E 67 -25,-0.2 2,-0.3 -4,-0.1 -23,-0.2 -0.673 45.7 146.2 -86.1 145.9 22.1 42.5 23.1 87 89 A S - 0 0 32 -25,-1.7 -23,-0.3 -2,-0.3 0, 0.0 -0.913 59.5-121.0-172.1 145.3 19.7 41.9 20.3 88 90 A E S S+ 0 0 33 -2,-0.3 2,-2.1 -25,-0.2 3,-0.3 0.731 104.8 83.6 -58.5 -24.9 16.2 40.7 19.9 89 91 A D + 0 0 42 1,-0.2 -28,-0.3 -55,-0.2 -1,-0.2 -0.577 60.8 115.9 -81.5 82.0 17.9 38.1 17.8 90 92 A a + 0 0 0 -2,-2.1 2,-2.3 -30,-0.1 53,-0.3 0.442 17.7 122.0-135.0 1.8 18.7 36.1 20.9 91 93 A L + 0 0 2 -3,-0.3 -60,-2.1 -29,-0.1 -59,-0.9 -0.407 47.1 128.1 -78.1 75.6 16.9 32.7 20.8 92 94 A Y E -D 30 0B 24 -2,-2.3 51,-3.2 -62,-0.2 2,-0.3 -0.865 39.5-158.7-127.0 159.6 19.9 30.5 21.1 93 95 A L E -DE 29 142B 0 -64,-2.5 -64,-3.4 -2,-0.3 -65,-0.4 -0.941 8.6-137.1-140.8 162.1 21.2 27.7 23.2 94 96 A N E - E 0 141B 2 47,-3.8 47,-1.5 -2,-0.3 2,-0.4 -0.901 8.7-162.6-120.2 143.4 24.4 26.0 24.3 95 97 A V E -DE 26 140B 0 -69,-2.8 -69,-2.6 -2,-0.3 2,-0.5 -0.994 2.6-170.5-128.6 126.5 25.5 22.3 24.7 96 98 A W E -DE 25 139B 2 43,-2.4 43,-1.7 -2,-0.4 -71,-0.2 -0.984 15.3-179.7-110.3 127.0 28.5 21.0 26.6 97 99 A I E -D 24 0B 4 -73,-2.7 -73,-2.8 -2,-0.5 41,-0.1 -0.938 28.3-110.1-127.9 142.1 29.1 17.4 26.0 98 100 A P E -D 23 0B 2 0, 0.0 -75,-0.2 0, 0.0 35,-0.1 -0.407 40.7 -99.4 -70.6 152.2 31.8 15.2 27.4 99 101 A A S S+ 0 0 23 -77,-1.5 -77,-0.4 2,-0.1 2,-0.1 -0.973 110.2 48.2-108.2 130.9 34.6 13.9 25.3 100 102 A P S S- 0 0 100 0, 0.0 -1,-0.1 0, 0.0 -76,-0.0 0.507 115.7-100.5 -74.6 152.7 34.5 11.3 24.3 101 103 A K - 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