==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER RECEPTOR/TOXIN 14-DEC-05 2C9T . COMPND 2 MOLECULE: SOLUBLE ACETYLCHOLINE RECEPTOR; . SOURCE 2 ORGANISM_SCIENTIFIC: APLYSIA CALIFORNICA; . AUTHOR C.ULENS,R.C.HOGG,P.H.CELIE,D.BERTRAND,V.TSETLIN,A.B.SMIT, . 2146 18 26 26 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 81175.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1381 64.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 70 3.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 728 33.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 10 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 10 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 15 0.7 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 . 182 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 198 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 128 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 26 1.2 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 7 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 10 0 0 10 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 . 23 14 16 2 18 0 20 0 0 0 10 5 5 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 10 0 0 0 0 10 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 Q > 0 0 91 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -28.0 14.8 -1.9 1.7 2 2 A A H > + 0 0 61 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.903 360.0 44.8 -58.2 -53.3 12.6 -3.5 4.5 3 3 A N H > S+ 0 0 49 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.886 114.6 49.8 -62.6 -39.0 14.6 -6.6 5.2 4 4 A L H > S+ 0 0 7 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.858 107.4 54.0 -70.2 -38.1 17.9 -4.7 5.2 5 5 A M H X S+ 0 0 40 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.950 110.4 47.0 -60.3 -47.4 16.5 -2.1 7.6 6 6 A R H X S+ 0 0 10 -4,-2.2 4,-3.3 2,-0.2 -2,-0.2 0.878 111.4 52.1 -58.2 -44.4 15.6 -4.9 10.1 7 7 A L H X S+ 0 0 0 -4,-2.0 4,-3.1 2,-0.2 -1,-0.2 0.919 113.3 42.3 -59.5 -49.1 19.0 -6.6 9.7 8 8 A K H X S+ 0 0 42 -4,-2.5 4,-2.3 2,-0.2 5,-0.5 0.883 114.8 50.9 -67.9 -39.8 20.9 -3.4 10.4 9 9 A S H X S+ 0 0 34 -4,-2.6 4,-2.5 -5,-0.2 5,-0.3 0.960 115.1 44.3 -59.5 -49.2 18.5 -2.5 13.3 10 10 A D H X S+ 0 0 8 -4,-3.3 4,-0.6 1,-0.2 -2,-0.2 0.929 118.0 42.5 -60.6 -46.1 19.1 -6.1 14.6 11 11 A L H < S+ 0 0 30 -4,-3.1 -1,-0.2 -5,-0.2 -2,-0.2 0.874 130.0 23.0 -71.0 -33.9 22.9 -6.1 14.2 12 12 A F H < S+ 0 0 44 -4,-2.3 -3,-0.2 -5,-0.2 -2,-0.2 0.765 120.0 47.2-108.8 -31.6 23.5 -2.5 15.4 13 13 A N H < S+ 0 0 125 -4,-2.5 -3,-0.2 -5,-0.5 -2,-0.1 0.449 102.9 57.9 -98.6 -0.6 20.7 -1.3 17.7 14 14 A R S < S+ 0 0 129 -4,-0.6 -1,-0.1 -5,-0.3 -3,-0.1 0.710 106.2 30.6-101.2 -25.2 20.2 -4.3 20.1 15 15 A S S S- 0 0 82 -4,-0.2 -1,-0.1 -5,-0.1 3,-0.1 -0.901 87.2 -93.8-136.4 158.6 23.6 -4.8 21.8 16 16 A P - 0 0 84 0, 0.0 -2,-0.1 0, 0.0 195,-0.1 -0.331 59.4 -84.1 -71.3 159.0 26.6 -2.6 22.7 17 17 A M - 0 0 108 1,-0.1 66,-0.1 2,-0.1 -5,-0.0 -0.169 54.0 -84.9 -61.9 155.1 29.4 -2.3 20.2 18 18 A Y - 0 0 29 1,-0.1 -1,-0.1 -3,-0.1 42,-0.0 -0.455 36.2-143.4 -50.2 129.2 32.0 -5.0 20.0 19 19 A P - 0 0 11 0, 0.0 264,-0.2 0, 0.0 -1,-0.1 0.259 48.2-100.4 -86.4 17.5 34.6 -3.8 22.6 20 20 A G - 0 0 2 264,-0.0 5,-0.0 2,-0.0 263,-0.0 0.063 54.1 -51.4 77.0 163.5 37.4 -5.0 20.4 21 21 A P - 0 0 4 0, 0.0 2,-0.3 0, 0.0 131,-0.1 -0.132 47.0-168.8 -71.9 164.4 39.4 -8.3 20.7 22 22 A T - 0 0 26 3,-0.9 3,-0.2 129,-0.2 260,-0.1 -0.810 44.6 -96.0-134.8 173.5 41.1 -9.7 23.8 23 23 A K S S+ 0 0 107 -2,-0.3 -1,-0.0 1,-0.2 128,-0.0 0.821 129.6 53.3 -62.0 -32.8 43.6 -12.5 24.3 24 24 A D S S+ 0 0 106 1,-0.2 -1,-0.2 -3,-0.0 127,-0.1 0.746 124.0 26.1 -67.7 -28.0 40.5 -14.6 25.2 25 25 A D S S- 0 0 59 -3,-0.2 -3,-0.9 -5,-0.0 -1,-0.2 -0.552 87.1-179.1-137.3 70.9 38.8 -13.6 21.9 26 26 A P - 0 0 79 0, 0.0 2,-0.3 0, 0.0 126,-0.2 -0.195 9.4-152.6 -72.7 164.8 41.6 -12.8 19.5 27 27 A L E -a 152 0A 14 124,-2.2 126,-2.8 33,-0.0 2,-0.5 -0.973 8.7-135.5-140.1 146.4 41.0 -11.7 15.9 28 28 A T E -a 153 0A 62 -2,-0.3 2,-0.4 124,-0.2 31,-0.4 -0.939 16.0-166.4-107.0 131.3 42.8 -11.9 12.6 29 29 A V E -a 154 0A 0 124,-2.8 126,-2.0 -2,-0.5 2,-0.5 -0.973 7.6-153.3-113.1 128.2 43.1 -8.9 10.4 30 30 A T E -aB 155 57A 12 27,-2.6 27,-1.7 -2,-0.4 2,-0.4 -0.912 16.0-169.1-104.2 128.0 44.2 -9.4 6.8 31 31 A L E + B 0 56A 2 124,-3.2 126,-0.3 -2,-0.5 2,-0.3 -0.910 12.6 162.0-121.6 136.5 45.9 -6.3 5.3 32 32 A G E - B 0 55A 4 23,-1.8 23,-2.1 -2,-0.4 2,-0.4 -0.979 22.5-136.2-148.9 163.7 46.9 -5.6 1.7 33 33 A F E - B 0 54A 2 -2,-0.3 129,-2.4 21,-0.2 2,-0.5 -0.944 8.2-165.0-124.4 138.8 47.8 -2.6 -0.4 34 34 A T E -cB 162 53A 0 19,-2.1 19,-2.1 -2,-0.4 2,-0.5 -0.956 25.3-147.5-114.7 106.6 46.9 -1.4 -3.9 35 35 A L E + B 0 52A 2 127,-1.7 17,-0.3 -2,-0.5 130,-0.2 -0.636 24.6 171.4 -82.9 119.3 49.4 1.3 -4.8 36 36 A Q E - 0 0 9 15,-2.4 131,-3.4 -2,-0.5 2,-0.3 0.777 60.8 -13.6 -92.5 -36.8 47.9 4.0 -7.0 37 37 A D E - B 0 51A 0 14,-2.1 14,-2.5 129,-0.2 2,-0.7 -0.942 36.9-139.7-169.2 138.1 50.8 6.6 -7.0 38 38 A I E + B 0 50A 0 134,-0.3 134,-0.4 -2,-0.3 133,-0.4 -0.955 38.8 175.4 -93.2 107.8 54.0 7.9 -5.5 39 39 A V E + 0 0 0 10,-2.2 2,-0.3 -2,-0.7 11,-0.1 0.861 49.6 14.9 -89.8 -36.1 53.0 11.5 -5.7 40 40 A K E - B 0 49A 64 9,-1.1 9,-2.6 -3,-0.1 2,-0.4 -0.990 47.7-166.5-146.5 145.9 55.7 13.5 -4.1 41 41 A V E - B 0 48A 29 -2,-0.3 2,-0.5 7,-0.2 7,-0.2 -0.994 10.5-163.6-129.9 137.2 59.3 13.2 -2.8 42 42 A D E >>> + B 0 47A 36 5,-2.5 4,-1.5 -2,-0.4 5,-1.4 -0.894 11.9 179.0-130.8 105.2 60.9 15.8 -0.6 43 43 A S T 345S+ 0 0 77 -2,-0.5 -1,-0.1 1,-0.2 85,-0.1 0.573 82.7 60.7 -82.6 -12.2 64.7 15.7 -0.3 44 44 A S T 345S+ 0 0 67 1,-0.1 -1,-0.2 3,-0.1 -2,-0.0 0.663 123.3 20.9 -82.5 -18.5 64.7 18.7 2.1 45 45 A T T <45S- 0 0 4 -3,-0.6 332,-0.3 2,-0.2 -2,-0.2 0.489 98.5-122.8-122.8 -8.7 62.6 16.8 4.7 46 46 A N T <5 + 0 0 2 -4,-1.5 79,-2.3 1,-0.2 2,-0.4 0.928 64.8 139.0 51.0 50.3 63.1 13.1 3.7 47 47 A E E < -BD 42 124A 9 -5,-1.4 -5,-2.5 77,-0.2 2,-0.4 -0.962 34.8-166.3-117.9 140.5 59.4 12.6 3.3 48 48 A V E -BD 41 123A 0 75,-2.4 75,-2.1 -2,-0.4 2,-0.5 -0.981 11.9-143.2-122.9 138.3 57.6 10.6 0.5 49 49 A D E -BD 40 122A 8 -9,-2.6 -10,-2.2 -2,-0.4 -9,-1.1 -0.912 17.4-173.1-108.9 119.8 53.9 10.8 -0.3 50 50 A L E -BD 38 121A 2 71,-2.6 71,-2.0 -2,-0.5 2,-0.4 -0.794 14.4-156.2-105.1 147.7 51.9 7.6 -1.4 51 51 A V E +BD 37 120A 4 -14,-2.5 -15,-2.4 -2,-0.3 -14,-2.1 -1.000 36.4 142.2-120.0 122.2 48.4 7.3 -2.6 52 52 A Y E -BD 35 119A 1 67,-2.1 67,-3.1 -2,-0.4 2,-0.5 -0.968 51.2-114.7-148.4 164.2 47.0 3.7 -2.1 53 53 A Y E -BD 34 118A 12 -19,-2.1 -19,-2.1 -2,-0.3 2,-0.8 -0.943 28.1-149.5-100.4 128.9 43.9 1.7 -1.1 54 54 A E E -B 33 0A 2 63,-2.4 2,-0.3 -2,-0.5 -21,-0.2 -0.889 10.5-152.2-103.2 101.0 44.4 -0.2 2.2 55 55 A Q E -B 32 0A 30 -23,-2.1 -23,-1.8 -2,-0.8 2,-0.4 -0.578 16.8-177.5 -69.5 130.7 42.4 -3.4 2.1 56 56 A Q E +BE 31 115A 8 59,-1.8 59,-2.5 -2,-0.3 2,-0.4 -1.000 6.1 174.2-136.4 134.5 41.3 -4.6 5.5 57 57 A R E +BE 30 114A 82 -27,-1.7 -27,-2.6 -2,-0.4 2,-0.3 -0.999 9.7 146.8-141.3 138.6 39.4 -7.8 6.4 58 58 A W E - E 0 113A 6 55,-1.5 55,-3.0 -2,-0.4 2,-0.4 -0.916 34.2-123.5-157.7 174.3 38.4 -9.4 9.7 59 59 A K E - E 0 112A 107 -31,-0.4 2,-0.4 -2,-0.3 53,-0.3 -0.993 15.8-167.4-139.1 131.9 35.4 -11.4 11.0 60 60 A L > - 0 0 7 51,-3.3 3,-1.4 -2,-0.4 4,-0.1 -0.962 18.4-153.3-119.9 126.2 33.0 -10.8 13.9 61 61 A N G > S+ 0 0 101 -2,-0.4 3,-1.4 1,-0.3 -1,-0.1 0.832 100.8 62.1 -59.8 -35.8 30.6 -13.4 15.4 62 62 A S G 3 S+ 0 0 69 1,-0.2 -1,-0.3 49,-0.1 49,-0.1 0.592 101.3 53.8 -67.1 -9.8 28.4 -10.5 16.5 63 63 A L G < S+ 0 0 8 -3,-1.4 48,-0.5 48,-0.1 -1,-0.2 0.354 85.9 109.1-106.1 6.3 28.1 -9.6 12.8 64 64 A M < + 0 0 92 -3,-1.4 2,-0.3 46,-0.3 46,-0.2 -0.517 39.9 171.2 -81.5 149.0 26.8 -13.0 11.6 65 65 A W - 0 0 21 44,-2.3 46,-0.1 -2,-0.2 -2,-0.0 -0.981 39.0-112.3-148.7 157.4 23.3 -13.7 10.5 66 66 A D > - 0 0 77 -2,-0.3 3,-1.1 1,-0.1 4,-0.3 -0.839 25.5-147.5 -81.3 115.1 21.3 -16.4 8.9 67 67 A P G > >S+ 0 0 24 0, 0.0 5,-2.1 0, 0.0 3,-1.1 0.746 95.0 64.2 -53.8 -29.7 20.3 -15.0 5.4 68 68 A N G > 5S+ 0 0 63 1,-0.3 3,-0.6 3,-0.2 -2,-0.0 0.797 96.8 56.4 -67.7 -32.2 17.0 -17.0 5.6 69 69 A E G < 5S+ 0 0 42 -3,-1.1 -1,-0.3 1,-0.2 1648,-0.0 0.599 113.1 43.4 -68.7 -13.9 15.9 -14.9 8.5 70 70 A Y G X 5S- 0 0 8 -3,-1.1 3,-1.6 -4,-0.3 -1,-0.2 -0.282 124.2 -84.2-135.6 48.2 16.4 -11.7 6.4 71 71 A G T < 5S- 0 0 35 -3,-0.6 -3,-0.2 1,-0.3 -2,-0.1 0.832 86.0 -61.1 59.2 37.3 15.0 -12.2 2.9 72 72 A N T 3 -F 104 0A 54 -2,-0.3 3,-2.0 25,-0.2 25,-0.3 -0.250 36.4-129.7 -54.1 132.3 29.2 3.4 7.2 80 80 A A G > S+ 0 0 12 23,-2.2 3,-0.8 1,-0.3 -1,-0.1 0.661 107.3 70.4 -62.4 -19.2 32.5 2.4 8.9 81 81 A A G 3 S+ 0 0 81 22,-0.4 -1,-0.3 1,-0.2 -2,-0.1 0.745 88.1 64.4 -61.8 -26.2 31.2 4.4 11.9 82 82 A D G < S+ 0 0 64 -3,-2.0 2,-0.3 2,-0.1 -1,-0.2 0.588 106.5 43.3 -77.5 -10.6 28.5 1.7 12.5 83 83 A I S < S- 0 0 10 -3,-0.8 2,-0.2 -4,-0.2 -66,-0.0 -0.893 90.0 -93.1-133.0 161.8 31.1 -0.9 13.3 84 84 A W - 0 0 32 -2,-0.3 -2,-0.1 -64,-0.0 -3,-0.0 -0.533 42.6-168.5 -65.3 134.6 34.3 -1.6 15.2 85 85 A T - 0 0 53 -2,-0.2 2,-0.1 -4,-0.1 -5,-0.0 -0.975 24.3-103.9-127.5 148.5 37.3 -1.1 13.0 86 86 A P - 0 0 10 0, 0.0 2,-1.5 0, 0.0 -66,-0.0 -0.337 25.5-121.8 -73.1 150.2 40.9 -2.1 13.7 87 87 A D + 0 0 14 -2,-0.1 58,-0.6 2,-0.0 2,-0.4 -0.299 45.2 168.7 -89.7 53.1 43.5 0.5 14.8 88 88 A I E +J 144 0B 21 -2,-1.5 2,-0.3 56,-0.2 56,-0.2 -0.578 11.1 177.5 -79.0 120.1 45.9 -0.2 11.9 89 89 A T E -J 143 0B 13 54,-3.1 54,-2.3 -2,-0.4 2,-0.4 -0.947 36.0-119.5-130.2 142.9 48.5 2.6 11.8 90 90 A A E -J 142 0B 8 -2,-0.3 3,-0.5 52,-0.2 52,-0.2 -0.687 24.7-150.1 -72.4 129.5 51.6 3.5 9.8 91 91 A Y S S+ 0 0 29 50,-3.5 -1,-0.1 -2,-0.4 51,-0.1 0.589 88.4 38.9 -84.0 -10.3 54.4 3.6 12.2 92 92 A S S S+ 0 0 15 49,-0.3 32,-2.3 32,-0.0 -1,-0.2 0.047 76.2 139.6-135.7 29.6 56.5 6.2 10.4 93 93 A S B -G 123 0A 6 -3,-0.5 30,-0.3 30,-0.2 213,-0.1 -0.301 35.2-163.7 -53.6 149.9 54.0 8.7 9.1 94 94 A T S S+ 0 0 0 28,-2.2 29,-0.2 1,-0.2 -1,-0.1 0.383 74.0 28.7-120.1 -10.1 55.0 12.3 9.5 95 95 A R S S- 0 0 85 27,-0.9 27,-0.3 211,-0.1 -1,-0.2 -0.956 99.6 -79.2-142.9 158.3 51.5 13.8 9.0 96 96 A P - 0 0 48 0, 0.0 210,-0.1 0, 0.0 26,-0.1 -0.394 56.9-102.8 -55.5 135.1 47.9 12.6 9.6 97 97 A V - 0 0 54 209,-0.1 2,-0.5 24,-0.1 24,-0.2 -0.286 32.9-135.3 -52.0 136.8 46.7 10.2 7.0 98 98 A Q E -H 120 0A 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20.9 12.5 1965 111 J G E < S+ 0 0 0 -3,-2.3 -51,-2.6 -48,-0.6 2,-0.3 0.559 71.8 151.2 80.7 10.3 -13.2 20.1 16.0 1966 112 J S E -U 1913 0V 4 -4,-0.3 -4,-2.8 -53,-0.3 2,-0.4 -0.577 27.9-159.8 -78.6 136.0 -16.5 18.9 17.5 1967 113 J V E -UY19121961V 1 -55,-3.4 -55,-2.0 -2,-0.3 2,-0.4 -0.967 9.7-171.7-119.9 135.5 -16.2 16.3 20.2 1968 114 J M E +UY19111960V 11 -8,-2.3 -8,-2.4 -2,-0.4 2,-0.4 -0.994 7.9 174.6-130.6 123.2 -18.8 13.9 21.3 1969 115 J F E -U 1910 0V 12 -59,-2.8 -59,-2.2 -2,-0.4 -10,-0.1 -0.997 7.6-175.7-134.7 126.6 -18.3 11.8 24.4 1970 116 J I - 0 0 9 -12,-0.5 2,-0.3 -2,-0.4 -61,-0.2 -0.704 6.8-173.1-130.1 78.3 -21.0 9.5 25.9 1971 117 J P - 0 0 3 0, 0.0 -63,-2.2 0, 0.0 2,-0.4 -0.603 19.1-138.1 -72.7 132.6 -20.0 7.8 29.2 1972 118 J A E -T 1907 0V 3 -2,-0.3 -18,-3.4 -65,-0.2 -17,-0.6 -0.752 34.1-176.5 -84.3 133.3 -22.4 5.2 30.6 1973 119 J Q E -TX19061953V 28 -67,-2.8 -67,-2.2 -2,-0.4 2,-0.5 -0.986 33.9-147.7-138.0 141.0 -22.7 5.7 34.3 1974 120 J R E -TX19051952V 3 -22,-2.7 -22,-2.3 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