==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LECTIN 17-NOV-93 1LEM . COMPND 2 MOLECULE: LECTIN; . SOURCE 2 ORGANISM_SCIENTIFIC: LENS CULINARIS; . AUTHOR R.LORIS,L.WYNS . 228 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9995.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 155 68.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 102 44.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 1.3 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 . 2 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 20 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 15 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 6 2.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.9 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 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 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 2 0 2 1 2 1 3 3 0 0 1 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 0 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 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 T 0 0 157 0, 0.0 2,-0.4 0, 0.0 228,-0.2 0.000 360.0 360.0 360.0 120.3 42.7 -13.0 2.0 2 2 A E E -A 228 0A 100 226,-1.7 226,-2.6 49,-0.1 2,-0.3 -0.938 360.0-179.2-141.6 129.5 40.6 -10.0 1.7 3 3 A T E -A 227 0A 91 -2,-0.4 2,-0.3 224,-0.2 224,-0.2 -0.823 3.8-171.6-116.7 161.8 42.0 -6.7 2.4 4 4 A T E +A 226 0A 49 222,-2.0 222,-2.7 -2,-0.3 2,-0.3 -0.969 7.3 168.4-160.9 149.9 40.4 -3.3 2.3 5 5 A S E +A 225 0A 84 -2,-0.3 2,-0.3 220,-0.2 220,-0.2 -0.985 2.9 166.7-161.2 149.0 41.6 0.3 2.6 6 6 A F E -A 224 0A 25 218,-2.4 218,-2.0 -2,-0.3 2,-0.3 -0.983 12.7-166.9-161.3 171.9 40.7 4.0 2.2 7 7 A S E -A 223 0A 83 -2,-0.3 2,-0.5 216,-0.3 216,-0.3 -0.899 2.2-175.7-163.2 121.0 41.6 7.6 2.8 8 8 A I E +A 222 0A 16 214,-2.9 214,-1.7 -2,-0.3 3,-0.1 -0.970 5.4 175.6-118.1 112.1 39.5 10.7 2.5 9 9 A T S S+ 0 0 120 -2,-0.5 2,-0.2 1,-0.3 -1,-0.1 0.226 76.8 20.9 -95.8 12.3 41.7 13.9 3.2 10 10 A K S S- 0 0 150 212,-0.1 2,-0.4 20,-0.0 -1,-0.3 -0.732 84.2-123.9-175.1 129.8 38.9 16.3 2.3 11 11 A F - 0 0 4 18,-2.0 18,-0.3 -2,-0.2 19,-0.1 -0.641 16.9-138.8 -99.0 133.3 35.3 15.7 2.2 12 12 A S - 0 0 59 -2,-0.4 3,-0.5 17,-0.1 -1,-0.1 -0.230 25.0-113.6 -66.6 164.5 33.1 16.2 -0.8 13 13 A P S S+ 0 0 116 0, 0.0 2,-0.3 0, 0.0 13,-0.2 0.672 116.5 34.6 -69.2 -26.6 29.6 17.7 -0.7 14 14 A D S S- 0 0 109 3,-0.0 2,-1.2 0, 0.0 3,-0.1 -0.762 73.7-178.4-129.0 87.7 28.2 14.4 -1.8 15 15 A Q > - 0 0 22 -3,-0.5 3,-0.8 -2,-0.3 -4,-0.0 -0.768 4.6-177.1 -75.5 102.6 30.3 11.8 -0.2 16 16 A Q T 3 S+ 0 0 157 -2,-1.2 -1,-0.2 1,-0.2 31,-0.0 0.710 73.6 63.8 -82.9 -9.2 28.5 9.0 -1.7 17 17 A N T 3 S+ 0 0 65 -3,-0.1 30,-2.0 29,-0.0 31,-0.3 0.316 95.0 76.3 -90.3 12.3 30.6 6.4 0.1 18 18 A L E < -H 46 0B 13 -3,-0.8 2,-0.5 28,-0.3 28,-0.2 -0.840 68.0-141.9-120.7 151.4 29.3 7.5 3.5 19 19 A I E -H 45 0B 54 26,-2.8 26,-2.7 -2,-0.3 2,-0.4 -0.969 18.7-153.5-114.6 126.1 26.0 7.1 5.4 20 20 A F E -H 44 0B 69 -2,-0.5 2,-0.4 24,-0.2 24,-0.2 -0.788 12.8-177.1-103.0 136.9 24.8 10.0 7.4 21 21 A Q E > -H 43 0B 29 22,-2.8 22,-2.5 -2,-0.4 3,-1.4 -0.988 55.1 -19.6-132.0 142.6 22.6 9.7 10.4 22 22 A G E 3 S-H 42 0B 56 -2,-0.4 20,-0.2 1,-0.2 12,-0.1 -0.435 129.9 -11.0 64.4-126.5 21.0 12.3 12.6 23 23 A D T 3 S+ 0 0 69 18,-2.7 -1,-0.2 -2,-0.2 19,-0.2 0.293 95.0 127.8 -96.8 15.5 22.8 15.6 12.2 24 24 A G < + 0 0 11 -3,-1.4 2,-0.3 19,-0.3 9,-0.2 -0.438 24.8 143.1 -72.6 139.4 25.9 14.6 10.2 25 25 A Y E -B 32 0A 86 7,-2.3 7,-3.0 -2,-0.2 2,-0.4 -0.970 43.9-109.1-163.0 166.5 26.8 16.4 7.0 26 26 A T E +B 31 0A 21 -2,-0.3 2,-0.4 -13,-0.2 5,-0.2 -0.843 38.9 157.4-106.6 132.9 29.8 17.6 4.9 27 27 A T E > +B 30 0A 63 3,-2.5 3,-2.6 -2,-0.4 -16,-0.1 -0.966 64.6 5.4-158.2 139.9 30.7 21.3 4.5 28 28 A K T 3 S- 0 0 177 -2,-0.4 3,-0.1 1,-0.3 -16,-0.1 0.681 127.6 -60.3 58.9 27.3 33.8 23.0 3.7 29 29 A G T 3 S+ 0 0 14 1,-0.3 -18,-2.0 -18,-0.3 2,-0.3 0.642 116.8 106.9 79.1 8.9 35.7 19.8 3.1 30 30 A K E < S-B 27 0A 48 -3,-2.6 -3,-2.5 -20,-0.2 2,-0.6 -0.848 70.2-127.3-118.3 159.0 35.0 18.7 6.7 31 31 A L E -BC 26 219A 0 188,-2.8 188,-2.1 -2,-0.3 2,-0.5 -0.916 29.0-164.3-102.9 119.9 32.6 16.1 8.1 32 32 A T E +BC 25 218A 5 -7,-3.0 -7,-2.3 -2,-0.6 186,-0.2 -0.925 17.3 175.5-114.2 126.1 30.5 17.7 10.7 33 33 A L E S+ 0 0 0 184,-2.3 2,-0.4 -2,-0.5 -10,-0.2 0.892 70.7 8.7 -96.6 -45.3 28.6 15.7 13.2 34 34 A T E - C 0 217A 0 183,-1.0 183,-1.4 8,-0.1 -1,-0.4 -0.989 65.1-145.6-132.6 138.7 27.0 18.1 15.6 35 35 A K - 0 0 102 -2,-0.4 2,-2.1 181,-0.2 180,-0.3 -0.532 52.6 -79.8 -86.2 169.9 27.0 21.9 15.3 36 36 A A S S+ 0 0 52 -2,-0.2 2,-0.3 178,-0.1 180,-0.2 -0.411 91.8 125.8 -72.5 80.1 27.2 23.8 18.8 37 37 A V - 0 0 65 -2,-2.1 3,-0.4 178,-0.5 178,-0.3 -0.915 66.0 -94.3-128.7 157.2 23.4 23.3 19.5 38 38 A K S S- 0 0 141 -2,-0.3 174,-0.2 1,-0.2 176,-0.1 -0.348 91.6 -2.7 -68.9 147.7 21.6 21.9 22.3 39 39 A S S S+ 0 0 89 172,-1.5 2,-0.3 174,-0.3 172,-0.2 0.696 84.9 135.6 34.5 72.2 20.6 18.3 22.3 40 40 A T - 0 0 24 -3,-0.4 170,-1.9 -5,-0.1 2,-0.4 -0.962 39.8-145.6-142.6 153.3 21.5 16.7 19.0 41 41 A V E - I 0 209B 39 -2,-0.3 -18,-2.7 168,-0.2 2,-0.4 -0.948 11.9-171.5-118.8 142.7 23.1 13.5 17.8 42 42 A G E +HI 22 208B 0 166,-2.7 166,-1.9 -2,-0.4 2,-0.3 -0.989 9.1 170.8-134.2 127.6 25.4 13.1 14.7 43 43 A R E -HI 21 207B 2 -22,-2.5 -22,-2.8 -2,-0.4 2,-0.4 -0.988 8.6-176.6-131.1 140.4 26.6 9.8 13.2 44 44 A A E -HI 20 206B 0 162,-2.2 162,-2.4 -2,-0.3 2,-0.3 -0.963 8.2-168.4-137.0 125.0 28.5 9.0 9.9 45 45 A L E -HI 19 205B 2 -26,-2.7 -26,-2.8 -2,-0.4 2,-0.5 -0.843 28.2-121.1-108.0 147.0 29.3 5.4 8.8 46 46 A Y E -HI 18 204B 26 158,-2.2 158,-0.6 -2,-0.3 -28,-0.3 -0.783 33.1-139.7 -74.0 124.0 31.6 4.2 5.9 47 47 A S E S+ 0 0 35 -30,-2.0 -1,-0.1 -2,-0.5 -29,-0.1 0.739 71.2 89.9 -66.3 -28.4 29.1 2.2 3.8 48 48 A T E S- 0 0 70 -31,-0.3 156,-0.2 1,-0.1 2,-0.2 -0.492 83.6-116.8 -66.9 133.5 31.0 -1.0 2.6 49 49 A P E - 0 0 49 0, 0.0 2,-0.4 0, 0.0 154,-0.2 -0.528 26.7-140.8 -61.7 134.6 30.6 -3.9 5.1 50 50 A I E - I 0 202B 5 152,-3.0 152,-2.3 -2,-0.2 2,-1.0 -0.830 7.9-135.1 -99.0 138.2 34.0 -4.7 6.6 51 51 A H E + I 0 201B 27 -2,-0.4 150,-0.3 150,-0.2 149,-0.1 -0.833 29.1 174.2 -96.1 102.7 34.6 -8.4 7.1 52 52 A I - 0 0 2 148,-1.8 9,-2.1 -2,-1.0 2,-0.3 0.637 59.3 -5.1 -92.7 -14.6 36.1 -8.5 10.6 53 53 A W B -N 60 0C 21 147,-1.6 2,-0.4 7,-0.2 7,-0.2 -0.989 63.5-116.5-164.8 177.9 36.3 -12.3 11.1 54 54 A D >> - 0 0 38 5,-2.2 4,-2.7 -2,-0.3 3,-0.6 -0.909 4.1-159.7-131.5 110.8 35.4 -15.7 9.6 55 55 A R T 34 S+ 0 0 192 -2,-0.4 -1,-0.1 1,-0.2 0, 0.0 0.835 99.8 47.8 -34.0 -50.2 33.1 -18.7 10.8 56 56 A D T 34 S+ 0 0 152 1,-0.2 -1,-0.2 2,-0.1 -2,-0.0 0.801 126.3 21.0 -75.8 -37.7 35.0 -21.1 8.5 57 57 A T T <4 S- 0 0 80 -3,-0.6 -1,-0.2 2,-0.1 -2,-0.2 0.568 91.4-133.6-103.3 -15.6 38.7 -20.3 9.3 58 58 A G < + 0 0 33 -4,-2.7 -3,-0.2 1,-0.2 2,-0.1 0.642 54.3 150.7 65.2 19.6 38.0 -18.7 12.7 59 59 A N - 0 0 70 -5,-0.5 -5,-2.2 136,-0.0 2,-0.3 -0.490 34.4-152.4 -81.0 151.2 40.4 -15.8 11.7 60 60 A V B -N 53 0C 23 -7,-0.2 169,-0.4 -2,-0.1 -7,-0.2 -0.897 20.6-113.7-120.3 152.0 40.1 -12.3 12.9 61 61 A A - 0 0 0 -9,-2.1 2,-0.3 -2,-0.3 167,-0.2 -0.510 13.0-139.5 -78.7 143.8 41.3 -9.3 11.1 62 62 A N E +D 227 0A 56 165,-2.0 165,-1.5 -2,-0.2 2,-0.3 -0.739 36.6 169.2 -88.2 158.5 44.1 -6.9 12.0 63 63 A F E -DE 226 166A 6 103,-1.6 103,-2.5 -2,-0.3 2,-0.3 -0.979 24.0-169.1-163.4 161.5 43.2 -3.3 11.4 64 64 A V E -DE 225 165A 52 161,-2.2 161,-1.9 -2,-0.3 2,-0.3 -0.987 4.3-177.1-151.8 147.7 44.1 0.3 11.9 65 65 A T E -DE 224 164A 1 99,-2.2 99,-2.1 -2,-0.3 2,-0.3 -0.925 4.0-169.0-137.7 158.3 42.4 3.6 11.4 66 66 A S E +DE 223 163A 42 157,-1.9 157,-1.7 -2,-0.3 2,-0.3 -0.950 13.5 162.3-150.2 136.7 43.7 7.2 11.9 67 67 A F E -DE 222 162A 3 95,-1.5 95,-2.9 -2,-0.3 2,-0.3 -0.882 28.6-130.5-146.5-176.5 41.8 10.5 11.9 68 68 A T E +DE 221 161A 12 153,-1.1 152,-2.5 -2,-0.3 153,-0.9 -0.993 31.9 158.2-139.3 131.6 41.8 14.2 12.8 69 69 A F E -DE 219 160A 4 91,-1.3 91,-2.6 -2,-0.3 2,-0.3 -0.972 21.8-154.5-156.1 163.0 39.1 16.0 14.7 70 70 A V E -D 218 0A 13 148,-1.4 148,-2.0 -2,-0.3 2,-0.5 -0.960 8.9-148.4-138.8 152.7 38.4 19.1 16.8 71 71 A I E -D 217 0A 4 87,-0.4 86,-2.7 -2,-0.3 2,-0.5 -0.986 15.6-159.4-123.6 131.6 35.9 19.8 19.4 72 72 A D E -D 216 0A 83 144,-2.5 144,-1.5 -2,-0.5 84,-0.1 -0.898 12.4-179.7-132.5 106.2 34.9 23.4 19.6 73 73 A A - 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