==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-JAN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER RECEPTOR/TOXIN 25-APR-07 2UZ6 . COMPND 2 MOLECULE: SOLUBLE ACETYLCHOLINE RECEPTOR; . SOURCE 2 ORGANISM_SCIENTIFIC: APLYSIA CALIFORNICA; . AUTHOR C.ULENS,S.DUTERTRE,R.BUTTNER,A.FISH,R.VAN ELK,Y.KENDEL, . 2210 20 30 30 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 86757.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1402 63.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 69 3.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 713 32.3 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 . 14 0.6 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 . 191 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 186 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 152 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 31 1.4 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 2 1 8 0 0 2 3 2 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 12 0 0 9 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 . 22 16 14 3 17 0 19 1 1 0 9 9 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 1 10 1 0 0 0 9 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 87 0, 0.0 4,-3.5 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -19.5 82.8 -0.3 112.9 2 2 A A H > + 0 0 72 2,-0.2 4,-2.0 3,-0.2 5,-0.1 0.920 360.0 42.5 -67.3 -45.0 86.2 -0.6 111.1 3 3 A N H > S+ 0 0 63 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.926 119.0 44.4 -62.7 -46.9 84.1 -1.2 108.0 4 4 A L H > S+ 0 0 12 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.916 112.9 49.6 -66.1 -47.4 81.7 1.6 108.8 5 5 A M H X S+ 0 0 38 -4,-3.5 4,-2.2 1,-0.2 -1,-0.2 0.886 111.4 50.4 -58.7 -42.0 84.3 4.1 109.9 6 6 A R H X S+ 0 0 103 -4,-2.0 4,-1.8 -5,-0.2 -1,-0.2 0.893 109.9 50.7 -63.9 -41.5 86.2 3.5 106.6 7 7 A L H >X S+ 0 0 0 -4,-1.9 4,-1.9 2,-0.2 3,-0.8 0.982 113.3 43.2 -57.3 -61.8 83.0 4.0 104.6 8 8 A K H 3X>S+ 0 0 32 -4,-2.4 4,-2.0 1,-0.3 5,-0.7 0.850 112.3 56.2 -52.0 -40.6 82.2 7.3 106.2 9 9 A S H 3<5S+ 0 0 50 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.849 109.3 45.9 -60.8 -37.6 85.9 8.3 105.9 10 10 A D H <<5S+ 0 0 24 -4,-1.8 -2,-0.2 -3,-0.8 -1,-0.2 0.822 118.7 39.1 -77.3 -33.3 85.8 7.7 102.2 11 11 A L H X5S+ 0 0 23 -4,-1.9 4,-0.8 3,-0.1 -2,-0.2 0.957 128.1 24.0 -81.3 -59.5 82.5 9.5 101.5 12 12 A F T ><5S+ 0 0 43 -4,-2.0 3,-1.0 -5,-0.2 -3,-0.2 0.996 125.9 42.5 -70.9 -72.2 82.6 12.6 103.7 13 13 A N T 34> - B 0 47A 43 5,-1.6 4,-3.0 -2,-0.4 5,-1.0 -0.861 12.8-176.1-133.0 100.9 46.8 33.3 120.4 43 43 A S T 45S+ 0 0 91 -2,-0.4 -1,-0.1 1,-0.2 85,-0.1 0.787 84.1 55.4 -60.5 -33.9 43.9 35.5 119.4 44 44 A S T 45S+ 0 0 69 1,-0.1 -1,-0.2 3,-0.1 333,-0.1 0.825 122.7 22.9 -74.3 -33.8 45.7 38.7 120.3 45 45 A T T 45S- 0 0 27 -3,-0.3 332,-0.3 2,-0.1 -2,-0.2 0.757 100.0-124.8-101.9 -28.3 48.7 38.2 118.2 46 46 A N T <5 + 0 0 4 -4,-3.0 79,-2.8 1,-0.3 2,-0.4 0.862 60.4 135.4 80.9 44.5 47.4 35.8 115.6 47 47 A E E < -BD 42 124A 10 -5,-1.0 -5,-1.6 77,-0.2 2,-0.4 -0.959 36.1-162.5-126.5 148.1 49.9 33.0 115.9 48 48 A V E -BD 41 123A 0 75,-1.8 75,-2.0 -2,-0.4 2,-0.5 -0.969 8.2-150.4-126.0 138.5 49.6 29.2 116.2 49 49 A D E -BD 40 122A 6 -9,-2.3 -10,-2.3 -2,-0.4 -9,-1.1 -0.945 14.9-176.5-114.0 130.1 52.2 26.8 117.5 50 50 A L E -BD 38 121A 4 71,-2.3 71,-2.4 -2,-0.5 2,-0.4 -0.933 15.7-156.1-124.8 147.0 52.4 23.2 116.2 51 51 A V E +BD 37 120A 0 -14,-2.2 -15,-2.1 -2,-0.4 -14,-1.6 -0.989 36.4 139.6-120.1 131.6 54.7 20.4 117.2 52 52 A Y E -BD 35 119A 2 67,-1.5 67,-2.9 -2,-0.4 2,-0.5 -0.952 52.5-103.4-160.3 165.7 55.1 17.8 114.5 53 53 A Y E -BD 34 118A 4 -19,-2.2 -19,-1.3 -2,-0.3 2,-0.6 -0.915 31.7-150.4-101.7 137.0 57.8 15.5 112.9 54 54 A E E -B 33 0A 11 63,-2.6 2,-0.4 -2,-0.5 -21,-0.2 -0.937 8.3-155.7-112.2 121.4 59.0 16.7 109.6 55 55 A Q E -B 32 0A 31 -23,-3.0 -23,-1.4 -2,-0.6 2,-0.4 -0.789 11.6-177.2-100.6 133.1 60.2 14.1 107.2 56 56 A Q E +BE 31 115A 12 59,-2.0 59,-1.3 -2,-0.4 2,-0.4 -0.990 2.1 178.2-136.8 130.8 62.7 14.8 104.4 57 57 A R E +BE 30 114A 51 -27,-2.1 -27,-2.6 -2,-0.4 2,-0.3 -0.990 10.9 145.6-136.2 135.4 64.0 12.5 101.6 58 58 A W E - E 0 113A 10 55,-1.8 55,-4.1 -2,-0.4 2,-0.4 -0.956 30.3-132.9-158.3 167.6 66.4 12.8 98.7 59 59 A K E - E 0 112A 73 -31,-0.4 2,-0.4 -2,-0.3 53,-0.3 -0.975 15.8-171.6-132.0 138.7 69.0 10.8 96.8 60 60 A L E > - 0 0 10 51,-2.1 3,-1.6 -2,-0.4 -33,-0.0 -0.994 26.8-149.0-137.1 133.4 72.6 11.7 95.6 61 61 A N E > S+ 0 0 108 -2,-0.4 3,-2.0 1,-0.3 -1,-0.1 0.893 102.5 67.9 -59.6 -38.0 75.1 9.9 93.4 62 62 A S E 3 S+ 0 0 69 1,-0.3 -1,-0.3 -3,-0.1 49,-0.1 0.713 103.2 47.7 -49.9 -24.5 77.7 11.6 95.6 63 63 A L E < S+ 0 0 17 -3,-1.6 48,-0.7 47,-0.1 2,-0.3 0.024 86.0 105.0-114.3 25.4 76.4 9.2 98.3 64 64 A M E < + E 0 110A 92 -3,-2.0 2,-0.3 46,-0.3 46,-0.2 -0.826 39.9 168.4-107.5 148.9 76.2 5.8 96.8 65 65 A W - 0 0 24 44,-2.3 3,-0.1 -2,-0.3 -2,-0.0 -0.955 39.1-100.3-149.7 169.0 78.6 2.9 97.3 66 66 A D > - 0 0 70 -2,-0.3 3,-2.2 1,-0.2 4,-0.3 -0.848 22.1-153.2 -98.2 109.8 79.1 -0.9 96.8 67 67 A P G > >S+ 0 0 26 0, 0.0 3,-2.5 0, 0.0 5,-1.9 0.837 93.2 65.7 -46.9 -41.5 78.3 -2.9 100.0 68 68 A N G > 5S+ 0 0 128 1,-0.3 3,-0.6 3,-0.2 -2,-0.0 0.759 99.9 50.6 -53.4 -30.5 80.8 -5.6 98.9 69 69 A E G < 5S+ 0 0 118 -3,-2.2 -1,-0.3 1,-0.2 -3,-0.0 0.414 116.1 43.2 -87.7 0.4 83.7 -3.1 99.3 70 70 A Y G X 5S- 0 0 25 -3,-2.5 3,-1.8 -4,-0.3 -1,-0.2 -0.252 125.0 -87.9-141.5 46.8 82.5 -2.2 102.8 71 71 A G T < 5S- 0 0 35 -3,-0.6 -3,-0.2 1,-0.3 3,-0.1 0.842 83.0 -58.6 48.1 46.2 81.6 -5.6 104.4 72 72 A N T 3 -F 104 0A 47 -2,-0.3 3,-3.0 25,-0.3 4,-0.3 -0.482 35.6-119.7 -74.4 141.7 74.2 13.4 111.9 80 80 A A G > S+ 0 0 7 23,-1.1 3,-1.6 1,-0.3 24,-0.1 0.751 112.1 65.8 -48.8 -32.1 72.5 15.7 109.5 81 81 A A G 3 S+ 0 0 91 22,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.457 90.6 66.0 -72.5 0.2 75.4 18.2 109.8 82 82 A D G < S+ 0 0 70 -3,-3.0 -1,-0.3 2,-0.1 2,-0.2 0.568 108.0 41.6 -90.0 -13.3 77.7 15.5 108.2 83 83 A I S < S- 0 0 12 -3,-1.6 2,-0.3 -4,-0.3 -66,-0.0 -0.759 92.5 -90.4-130.3 169.7 75.7 15.9 105.0 84 84 A W - 0 0 39 -2,-0.2 -2,-0.1 -64,-0.0 -3,-0.0 -0.643 45.0-177.4 -77.0 140.0 74.1 18.4 102.6 85 85 A T - 0 0 53 -2,-0.3 -29,-0.0 -4,-0.1 -27,-0.0 -0.982 27.1-102.5-138.9 148.1 70.4 18.9 103.6 86 86 A P - 0 0 13 0, 0.0 -28,-0.0 0, 0.0 66,-0.0 -0.064 19.0-121.9 -72.7 169.6 67.9 21.0 101.7 87 87 A D + 0 0 13 2,-0.1 58,-0.5 221,-0.0 2,-0.3 -0.123 50.6 154.3 -99.0 34.0 66.6 24.5 102.6 88 88 A I E +J 144 0B 13 56,-0.2 2,-0.3 57,-0.1 56,-0.2 -0.518 20.7 161.7 -65.9 125.5 62.9 23.6 102.8 89 89 A T E -J 143 0B 30 54,-2.3 54,-2.2 -2,-0.3 2,-0.6 -0.967 47.0 -95.7-145.6 159.6 61.3 26.1 105.2 90 90 A A E > -J 142 0B 7 -2,-0.3 3,-1.1 52,-0.2 52,-0.2 -0.657 26.8-152.7 -78.6 115.1 58.0 27.6 106.2 91 91 A Y T 3 S+ 0 0 9 50,-2.4 -1,-0.1 -2,-0.6 51,-0.1 0.609 90.8 45.4 -65.3 -9.6 57.5 30.9 104.3 92 92 A S T 3 S+ 0 0 34 49,-0.4 32,-1.5 232,-0.0 -1,-0.2 0.147 72.3 139.0-126.5 23.0 55.3 32.2 107.1 93 93 A S B < -G 123 0A 7 -3,-1.1 30,-0.3 213,-0.2 213,-0.1 -0.264 34.0-164.1 -62.0 152.9 57.0 31.5 110.5 94 94 A T S S+ 0 0 2 28,-2.0 29,-0.2 1,-0.2 -1,-0.1 0.368 76.0 32.3-116.7 -6.4 56.9 34.3 113.0 95 95 A R S S- 0 0 80 27,-0.9 27,-0.3 211,-0.1 -1,-0.2 -0.976 100.9 -81.6-145.1 157.7 59.7 32.8 115.2 96 96 A P - 0 0 51 0, 0.0 210,-0.1 0, 0.0 -2,-0.0 -0.426 58.5-109.1 -60.3 131.9 62.8 30.7 114.6 97 97 A V - 0 0 65 24,-0.1 2,-0.5 209,-0.1 24,-0.2 -0.259 33.0-132.1 -57.9 151.4 61.6 27.2 114.2 98 98 A Q E -H 120 0A 75 22,-2.8 22,-2.5 -3,-0.1 2,-0.4 -0.958 5.9-141.0-114.0 125.8 62.6 25.1 117.3 99 99 A V E -H 119 0A 47 -2,-0.5 20,-0.2 20,-0.2 4,-0.1 -0.702 16.5-175.5 -80.6 133.6 64.2 21.7 116.9 100 100 A L + 0 0 13 18,-2.2 817,-0.2 -2,-0.4 19,-0.2 0.200 61.7 30.2-115.2 15.6 62.9 19.3 119.6 101 101 A S S S- 0 0 18 17,-0.4 2,-0.1 812,-0.1 814,-0.0 -0.928 95.7 -67.7-158.1 174.2 65.0 16.2 118.9 102 102 A P - 0 0 33 0, 0.0 2,-0.9 0, 0.0 16,-0.1 -0.496 42.3-131.4 -71.8 146.3 68.4 15.1 117.6 103 103 A Q + 0 0 94 -2,-0.1 -23,-1.1 14,-0.1 -22,-0.4 -0.861 47.2 148.0-100.6 100.1 69.1 15.7 113.9 104 104 A I E -F 79 0A 36 -2,-0.9 12,-0.5 -25,-0.3 -25,-0.3 -0.998 27.4-157.1-133.9 134.1 70.4 12.4 112.6 105 105 A A E -FI 78 115A 0 -27,-2.9 -27,-1.9 -2,-0.4 2,-0.5 -0.694 14.7-130.1-108.7 162.4 69.9 11.0 109.0 106 106 A V E -FI 77 114A 9 8,-2.7 8,-1.9 -2,-0.2 2,-0.4 -0.973 22.2-162.6-113.1 117.5 70.0 7.5 107.5 107 107 A V E -FI 76 113A 0 -31,-3.5 -31,-2.5 -2,-0.5 2,-0.3 -0.830 8.3-150.4 -97.8 136.1 72.1 7.3 104.3 108 108 A T E > -F 75 0A 37 4,-2.2 3,-2.9 -2,-0.4 -33,-0.2 -0.793 28.4-111.2-109.1 154.9 71.6 4.3 102.0 109 109 A H T 3 S+ 0 0 70 -35,-3.0 -44,-2.3 -2,-0.3 -34,-0.1 0.599 118.6 57.1 -55.6 -11.5 74.1 2.6 99.7 110 110 A D E 3 S-E 64 0A 52 -46,-0.2 -1,-0.3 -36,-0.2 -46,-0.3 0.437 124.7 -97.1-101.2 -1.0 72.1 4.0 96.8 111 111 A G E < S+ 0 0 0 -3,-2.9 -51,-2.1 -48,-0.7 2,-0.5 0.466 75.7 143.8 99.7 4.0 72.4 7.7 97.8 112 112 A S E -E 59 0A 37 -53,-0.3 -4,-2.2 -4,-0.1 2,-0.4 -0.656 29.2-168.3 -79.8 123.1 69.0 7.9 99.6 113 113 A V E -EI 58 107A 3 -55,-4.1 -55,-1.8 -2,-0.5 2,-0.3 -0.945 3.9-173.0-113.3 134.2 69.0 10.1 102.6 114 114 A M E +EI 57 106A 9 -8,-1.9 -8,-2.7 -2,-0.4 2,-0.3 -0.988 6.3 173.1-126.7 151.8 66.2 10.2 105.2 115 115 A F E +EI 56 105A 14 -59,-1.3 -59,-2.0 -2,-0.3 -10,-0.2 -0.965 7.9 177.3-159.2 114.6 65.8 12.6 108.1 116 116 A I + 0 0 6 -12,-0.5 2,-0.2 -2,-0.3 -61,-0.2 -0.688 12.7 167.8-128.8 77.4 62.8 13.1 110.5 117 117 A P - 0 0 3 0, 0.0 -63,-2.6 0, 0.0 2,-0.2 -0.617 34.3-116.0 -85.4 153.7 63.4 15.6 113.3 118 118 A A E -D 53 0A 3 -65,-0.2 -18,-2.2 -2,-0.2 -17,-0.4 -0.594 36.0-165.4 -86.9 151.4 60.6 17.0 115.6 119 119 A Q E -DH 52 99A 18 -67,-2.9 -67,-1.5 -20,-0.2 2,-0.6 -0.994 27.4-151.3-149.1 145.1 59.7 20.7 115.5 120 120 A R E -DH 51 98A 9 -22,-2.5 -22,-2.8 -2,-0.4 2,-0.4 -0.954 29.2-176.4-108.2 124.3 57.9 23.5 117.2 121 121 A L E -D 50 0A 3 -71,-2.4 -71,-2.3 -2,-0.6 2,-0.5 -0.990 17.1-163.0-129.2 130.8 56.8 26.1 114.7 122 122 A S E +D 49 0A 11 -2,-0.4 -28,-2.0 -27,-0.3 -27,-0.9 -0.951 27.4 162.5-107.7 128.4 55.0 29.4 115.3 123 123 A F E -DG 48 93A 3 -75,-2.0 -75,-1.8 -2,-0.5 2,-0.5 -0.890 43.5 -72.2-143.1 173.7 53.3 30.8 112.2 124 124 A M E +D 47 0A 9 -32,-1.5 15,-0.3 -2,-0.3 2,-0.3 -0.562 60.5 144.7 -76.6 115.0 50.7 33.3 111.1 125 125 A a - 0 0 0 -79,-2.8 -83,-0.3 -2,-0.5 13,-0.1 -0.875 42.2-146.8-157.2 125.6 47.1 32.4 111.9 126 126 A D - 0 0 46 -2,-0.3 11,-0.2 11,-0.2 -83,-0.1 -0.789 19.2-169.7 -82.9 110.4 44.0 34.2 112.8 127 127 A P > + 0 0 4 0, 0.0 3,-1.6 0, 0.0 -1,-0.1 0.222 29.4 144.6 -91.5 13.7 42.2 31.6 115.1 128 128 A T T 3 + 0 0 107 1,-0.2 -2,-0.1 2,-0.1 0, 0.0 -0.345 70.0 29.4 -53.9 120.1 38.8 33.4 115.4 129 129 A G T 3 S+ 0 0 18 -2,-0.1 6,-0.5 7,-0.1 -1,-0.2 0.493 74.2 123.1 108.0 6.5 36.3 30.5 115.5 130 130 A V S < S+ 0 0 12 -3,-1.6 74,-3.2 1,-0.2 6,-0.2 0.820 79.9 51.1 -67.3 -31.9 38.3 27.7 117.0 131 131 A D S S+ 0 0 116 72,-0.2 -1,-0.2 4,-0.1 72,-0.1 0.874 95.5 95.2 -70.5 -38.4 35.6 27.5 119.8 132 132 A S S S- 0 0 30 3,-0.1 72,-0.2 1,-0.1 3,-0.1 0.108 87.4-117.1 -46.3 162.5 32.9 27.3 117.1 133 133 A E S S+ 0 0 147 1,-0.2 -1,-0.1 2,-0.1 -3,-0.0 0.733 115.5 52.0 -79.4 -21.5 31.6 23.9 115.8 134 134 A E S S- 0 0 131 1,-0.2 -1,-0.2 -5,-0.1 2,-0.1 0.625 100.2-155.3 -87.6 -16.6 32.9 24.6 112.3 135 135 A G - 0 0 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