==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PLANT PROTEIN 20-NOV-98 2CAV . COMPND 2 MOLECULE: PROTEIN (CANAVALIN); . SOURCE 2 ORGANISM_SCIENTIFIC: CANAVALIA ENSIFORMIS; . AUTHOR T.-P.KO,J.DAY,A.MACPHERSON . 346 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18095.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 249 72.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 131 37.9 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 . 4 1.2 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 . 39 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 28 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 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 0 0 1 2 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 3 5 4 2 2 3 3 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 0 0 0 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 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 46 A N 0 0 187 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -68.2 40.9 30.0 16.9 2 47 A N > - 0 0 35 1,-0.1 3,-1.4 3,-0.1 260,-0.0 -0.778 360.0-174.8-122.6 92.9 40.5 30.5 13.1 3 48 A P T 3 S+ 0 0 29 0, 0.0 28,-0.1 0, 0.0 -1,-0.1 0.569 76.0 59.6 -61.9 -13.8 43.7 32.2 11.8 4 49 A Y T 3 S+ 0 0 11 268,-0.1 269,-2.7 30,-0.0 2,-0.5 0.295 84.8 92.8-100.4 11.5 42.5 32.7 8.2 5 50 A L E < -A 272 0A 36 -3,-1.4 2,-0.6 267,-0.2 267,-0.2 -0.911 47.6-176.3-111.6 123.8 39.5 34.9 8.9 6 51 A F E -A 271 0A 5 265,-3.6 265,-2.1 -2,-0.5 2,-0.1 -0.877 13.4-158.3-120.1 98.1 39.8 38.7 9.0 7 52 A R > - 0 0 85 -2,-0.6 3,-3.4 263,-0.2 4,-0.2 -0.474 32.4-108.8 -75.0 146.3 36.5 40.3 10.1 8 53 A S G > S+ 0 0 27 1,-0.3 3,-1.3 2,-0.2 -1,-0.1 0.677 117.0 69.6 -46.3 -22.4 35.9 43.9 9.0 9 54 A N G 3 S+ 0 0 122 1,-0.3 -1,-0.3 3,-0.0 -2,-0.1 0.550 89.1 65.5 -75.5 -5.9 36.4 44.9 12.7 10 55 A K G < S+ 0 0 69 -3,-3.4 16,-1.2 2,-0.1 -1,-0.3 0.390 78.6 97.7 -95.6 -0.0 40.1 44.0 12.2 11 56 A F E < S-G 25 0B 18 -3,-1.3 2,-0.4 14,-0.2 14,-0.3 -0.560 72.0-135.3 -80.5 154.9 40.7 46.8 9.7 12 57 A L E -G 24 0B 99 12,-2.2 12,-2.9 -2,-0.2 2,-0.7 -0.913 11.6-117.2-118.4 145.1 42.2 49.8 11.3 13 58 A T E +G 23 0B 69 -2,-0.4 10,-0.3 10,-0.2 3,-0.1 -0.664 31.7 170.5 -85.3 114.4 41.2 53.4 10.8 14 59 A L E S- 0 0 47 8,-3.1 2,-0.3 -2,-0.7 9,-0.2 0.896 75.0 -7.8 -81.8 -45.2 43.9 55.6 9.2 15 60 A F E +G 22 0B 25 7,-1.8 7,-3.2 2,-0.0 -1,-0.4 -0.987 63.3 172.0-153.5 145.8 41.7 58.6 8.6 16 61 A K E +G 21 0B 157 -2,-0.3 2,-0.3 5,-0.3 5,-0.2 -0.965 10.3 149.6-155.9 134.4 37.9 59.3 8.8 17 62 A N E > -G 20 0B 37 3,-2.4 3,-1.4 -2,-0.3 -2,-0.0 -0.896 65.6 -75.2-151.8-179.2 35.9 62.5 8.5 18 63 A Q T 3 S+ 0 0 135 -2,-0.3 3,-0.1 1,-0.2 31,-0.1 0.701 127.1 54.1 -62.0 -13.1 32.4 63.3 7.3 19 64 A H T 3 S- 0 0 22 155,-0.2 30,-2.8 1,-0.2 2,-0.3 0.622 120.3 -57.7 -97.5 -8.9 33.5 62.8 3.7 20 65 A G E < -GH 17 48B 7 -3,-1.4 -3,-2.4 28,-0.3 2,-0.3 -0.985 49.6-113.7 162.4-169.6 35.0 59.4 3.8 21 66 A S E -GH 16 47B 19 26,-3.0 26,-2.3 -2,-0.3 2,-0.4 -0.999 0.8-144.5-160.0 161.8 37.6 57.1 5.4 22 67 A L E +GH 15 46B 14 -7,-3.2 -8,-3.1 -2,-0.3 -7,-1.8 -0.994 22.8 179.6-132.3 123.5 40.8 55.1 5.0 23 68 A R E -GH 13 45B 47 22,-2.3 22,-2.4 -2,-0.4 2,-0.5 -0.930 14.2-151.4-126.6 151.5 41.3 51.8 6.8 24 69 A L E -GH 12 44B 23 -12,-2.9 -12,-2.2 -2,-0.3 20,-0.2 -0.979 19.9-125.1-126.6 126.3 44.2 49.4 6.8 25 70 A L E -G 11 0B 1 18,-3.2 -14,-0.2 -2,-0.5 18,-0.2 -0.356 38.7-100.2 -66.4 144.1 43.9 45.6 7.5 26 71 A Q - 0 0 33 -16,-1.2 17,-0.2 1,-0.2 -1,-0.1 -0.218 57.5 -74.2 -58.8 159.1 46.1 44.3 10.3 27 72 A R > - 0 0 81 1,-0.1 3,-2.3 2,-0.1 4,-0.3 -0.308 42.1-127.8 -55.3 132.6 49.3 42.6 9.2 28 73 A F T 3 S+ 0 0 2 13,-0.5 3,-0.3 10,-0.3 -1,-0.1 0.894 110.4 40.8 -53.5 -41.9 48.4 39.2 7.8 29 74 A N T 3 S+ 0 0 33 1,-0.2 3,-0.4 6,-0.2 -1,-0.3 0.028 82.0 120.9 -95.6 31.2 50.9 37.5 10.0 30 75 A E S < S+ 0 0 108 -3,-2.3 -1,-0.2 1,-0.2 -2,-0.1 0.976 92.5 2.8 -59.4 -58.5 50.1 39.7 13.0 31 76 A D S S+ 0 0 122 -3,-0.3 2,-0.3 -4,-0.3 -1,-0.2 -0.150 123.2 65.3-126.1 44.9 49.1 36.9 15.3 32 77 A T - 0 0 12 -3,-0.4 3,-0.5 1,-0.1 -1,-0.0 -0.952 56.4-152.4-158.5 142.7 49.7 33.7 13.3 33 78 A E S > S+ 0 0 136 -2,-0.3 3,-1.3 1,-0.2 -1,-0.1 0.741 87.0 82.5 -84.5 -23.0 52.8 32.0 12.0 34 79 A K T 3 S+ 0 0 99 1,-0.3 3,-0.2 2,-0.1 -1,-0.2 0.588 86.4 51.8 -59.7 -16.1 50.7 30.4 9.3 35 80 A L T > + 0 0 2 -3,-0.5 3,-2.6 1,-0.2 4,-0.3 0.027 60.6 128.0-117.6 32.4 50.7 33.4 6.9 36 81 A E G X S+ 0 0 98 -3,-1.3 3,-1.4 1,-0.3 4,-0.2 0.801 70.6 64.9 -51.1 -34.5 54.4 34.2 6.6 37 82 A N G 3 S+ 0 0 83 1,-0.3 -1,-0.3 -3,-0.2 3,-0.2 0.588 101.7 49.6 -71.5 -7.2 54.0 34.1 2.8 38 83 A L G X S+ 0 0 0 -3,-2.6 3,-2.2 1,-0.1 -10,-0.3 0.360 75.0 107.8-110.3 2.1 51.7 37.1 3.0 39 84 A R T < S+ 0 0 113 -3,-1.4 -1,-0.1 -4,-0.3 -2,-0.1 0.710 75.2 57.2 -55.0 -24.7 53.9 39.4 5.2 40 85 A D T 3 S+ 0 0 45 -3,-0.2 80,-2.7 -4,-0.2 85,-0.4 0.504 96.5 78.8 -86.6 -2.4 54.8 41.7 2.2 41 86 A Y E < - I 0 119B 35 -3,-2.2 -13,-0.5 78,-0.2 2,-0.4 -0.835 52.5-176.4-112.1 143.0 51.1 42.6 1.4 42 87 A R E - I 0 118B 21 76,-2.3 76,-4.1 -2,-0.4 2,-0.4 -0.968 15.0-144.5-131.6 150.4 48.7 44.9 3.0 43 88 A V E - I 0 117B 1 -2,-0.4 -18,-3.2 74,-0.2 2,-0.3 -0.961 18.5-175.4-118.1 130.9 45.1 45.5 2.2 44 89 A L E -HI 24 116B 2 72,-3.2 72,-3.5 -2,-0.4 2,-0.4 -0.908 12.4-151.5-124.9 156.0 43.5 48.9 2.4 45 90 A E E -HI 23 115B 43 -22,-2.4 -22,-2.3 -2,-0.3 2,-0.5 -0.991 7.6-170.4-130.2 127.9 40.0 50.2 2.0 46 91 A Y E +HI 22 114B 1 68,-2.9 68,-3.4 -2,-0.4 2,-0.4 -0.974 8.4 174.0-119.8 127.5 39.0 53.7 0.9 47 92 A C E +HI 21 113B 30 -26,-2.3 -26,-3.0 -2,-0.5 2,-0.3 -0.996 5.0 172.0-132.3 130.0 35.4 54.9 1.0 48 93 A S E -HI 20 112B 0 64,-2.1 64,-3.0 -2,-0.4 -28,-0.3 -0.999 27.8-120.8-143.1 148.6 34.2 58.4 0.2 49 94 A K - 0 0 93 -30,-2.8 3,-0.4 -2,-0.3 56,-0.2 -0.214 54.6 -63.5 -74.7 169.2 30.9 60.3 -0.2 50 95 A P S S+ 0 0 30 0, 0.0 58,-0.2 0, 0.0 -1,-0.2 -0.067 114.2 15.1 -56.2 151.4 29.9 62.1 -3.4 51 96 A N S S+ 0 0 54 54,-1.0 126,-3.3 56,-0.7 2,-0.3 0.899 95.8 137.0 47.0 50.1 31.8 65.1 -4.9 52 97 A T E -MN 105 176C 0 53,-0.9 53,-2.4 -3,-0.4 2,-0.4 -0.859 41.2-149.3-123.0 160.2 34.9 64.5 -2.7 53 98 A L E -MN 104 175C 33 122,-3.1 122,-2.8 -2,-0.3 2,-0.6 -0.989 9.2-147.3-132.1 134.5 38.6 64.5 -3.2 54 99 A L E -MN 103 174C 3 49,-2.9 49,-1.1 -2,-0.4 120,-0.2 -0.929 41.0-115.7-100.0 121.2 41.4 62.5 -1.7 55 100 A L E - 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