==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CARBOHYDRATE BINDING DOMAIN 19-MAR-02 1GWM . COMPND 2 MOLECULE: NON-CATALYTIC PROTEIN 1; . SOURCE 2 ORGANISM_SCIENTIFIC: PIROMYCES EQUI; . AUTHOR S.J.CHARNOCK,D.NURIZZO,G.J.DAVIES . 153 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8748.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 99 64.7 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 . 65 42.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.7 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 . 1 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 . 22 14.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 8 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 1 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.7 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 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 1 2 3 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 0 0 0 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 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 M 0 0 229 0, 0.0 2,-0.6 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 139.4 27.9 4.2 -15.2 2 2 A N - 0 0 128 1,-0.1 0, 0.0 2,-0.0 0, 0.0 -0.696 360.0-173.4 -80.7 117.9 28.7 1.3 -12.9 3 3 A V + 0 0 137 -2,-0.6 -1,-0.1 2,-0.0 2,-0.1 0.433 47.4 108.5 -95.5 -3.4 26.0 1.2 -10.2 4 4 A R S S- 0 0 208 1,-0.1 2,-0.1 131,-0.0 -2,-0.0 -0.407 73.9-101.8 -73.7 155.8 27.6 -1.5 -8.0 5 5 A A - 0 0 33 134,-0.1 2,-0.6 -2,-0.1 -1,-0.1 -0.330 20.9-121.6 -76.5 156.1 29.1 -0.6 -4.7 6 6 A T - 0 0 88 -2,-0.1 128,-1.5 2,-0.0 2,-0.5 -0.892 28.2-157.9 -91.8 119.6 32.7 -0.1 -3.8 7 7 A Y E -A 133 0A 76 -2,-0.6 2,-0.6 126,-0.2 126,-0.2 -0.896 5.9-166.7-101.4 124.5 33.6 -2.5 -1.0 8 8 A T E -A 132 0A 33 124,-3.1 124,-2.6 -2,-0.5 2,-0.9 -0.951 10.3-152.3-111.0 112.7 36.7 -1.6 1.1 9 9 A V E -A 131 0A 47 -2,-0.6 122,-0.2 122,-0.2 3,-0.2 -0.762 13.7-177.6 -83.5 107.8 37.9 -4.4 3.3 10 10 A I E - 0 0 10 120,-2.1 2,-0.3 -2,-0.9 -1,-0.2 0.953 68.8 -20.2 -77.0 -47.9 39.5 -2.5 6.2 11 11 A F E -A 130 0A 13 119,-1.7 119,-1.6 -3,-0.2 -1,-0.3 -0.960 47.8-177.8-155.8 151.3 40.7 -5.7 7.9 12 12 A K S S+ 0 0 62 1,-0.5 117,-2.5 -2,-0.3 2,-0.6 0.714 89.3 8.6 -98.7 -88.6 39.8 -9.4 7.8 13 13 A N S S- 0 0 109 115,-0.2 2,-0.5 116,-0.1 -1,-0.5 -0.850 85.0-143.3 -92.3 122.4 42.1 -11.0 10.4 14 14 A A + 0 0 5 21,-2.9 21,-0.4 -2,-0.6 19,-0.1 -0.781 35.7 161.0 -90.9 124.5 43.8 -8.2 12.3 15 15 A S S S- 0 0 118 -2,-0.5 2,-0.3 1,-0.3 17,-0.1 0.174 81.7 -24.7-118.4 14.8 47.5 -8.8 13.4 16 16 A G S S- 0 0 23 15,-0.1 -1,-0.3 3,-0.0 3,-0.1 -0.946 104.5 -34.7 167.9-171.8 47.9 -5.0 13.8 17 17 A L S S- 0 0 72 -2,-0.3 3,-0.1 -3,-0.1 -2,-0.1 -0.440 74.3 -98.8 -64.1 144.1 46.4 -1.8 12.5 18 18 A P > - 0 0 14 0, 0.0 3,-1.8 0, 0.0 -1,-0.1 -0.364 43.1 -98.2 -64.2 140.1 45.3 -2.1 8.9 19 19 A N T 3 S+ 0 0 172 1,-0.3 3,-0.1 -9,-0.1 -3,-0.0 -0.392 112.7 30.6 -59.0 131.5 47.7 -0.6 6.3 20 20 A G T 3 S+ 0 0 31 1,-0.2 34,-2.9 -2,-0.1 35,-0.4 0.370 105.2 92.4 97.7 -0.6 46.6 2.9 5.4 21 21 A Y E < -F 53 0B 22 -3,-1.8 2,-0.2 32,-0.2 -1,-0.2 -0.985 53.2-162.6-130.1 133.2 45.0 3.6 8.8 22 22 A D E -F 52 0B 79 30,-2.3 30,-3.0 -2,-0.4 2,-0.7 -0.677 27.8-117.2 -98.4 164.1 46.4 5.3 11.9 23 23 A N E +F 51 0B 59 -2,-0.2 28,-0.2 28,-0.2 89,-0.0 -0.909 31.2 172.8-106.1 107.1 44.7 4.9 15.4 24 24 A W + 0 0 115 26,-2.9 27,-0.1 -2,-0.7 -1,-0.1 -0.038 40.9 131.7 -95.5 26.9 43.5 8.2 16.7 25 25 A G - 0 0 27 25,-0.3 2,-0.3 22,-0.0 24,-0.2 0.009 40.5-154.2 -71.4-178.3 41.9 6.4 19.6 26 26 A W B +G 48 0B 95 22,-2.1 22,-2.4 20,-0.1 3,-0.1 -0.991 59.6 21.6-155.6 150.6 42.1 7.2 23.3 27 27 A G S S+ 0 0 17 -2,-0.3 15,-3.2 20,-0.2 20,-0.4 0.763 99.0 85.3 64.8 28.9 41.8 5.5 26.6 28 28 A C E -B 41 0A 24 13,-0.3 2,-0.4 20,-0.2 -1,-0.2 -0.956 62.9-136.3-145.1 167.3 42.5 2.0 25.5 29 29 A T E -B 40 0A 93 11,-1.7 11,-2.7 -2,-0.3 2,-0.4 -0.991 25.4-147.9-124.3 146.4 45.2 -0.6 24.8 30 30 A L E -B 39 0A 39 -2,-0.4 2,-0.3 9,-0.2 9,-0.2 -0.891 15.8-180.0-112.5 138.1 44.9 -2.8 21.7 31 31 A S E -B 38 0A 60 7,-2.5 7,-3.2 -2,-0.4 2,-0.4 -0.895 16.5-142.3-130.1 165.8 46.0 -6.3 21.2 32 32 A Y E +B 37 0A 68 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.986 32.8 143.1-135.7 118.1 45.8 -8.7 18.3 33 33 A Y E > +B 36 0A 190 3,-1.6 3,-2.0 -2,-0.4 -19,-0.1 -0.969 65.8 8.4-155.4 140.5 45.2 -12.4 18.6 34 34 A G T 3 S- 0 0 66 -2,-0.3 3,-0.1 1,-0.3 -19,-0.1 0.727 127.9 -61.3 64.3 23.8 43.3 -15.0 16.6 35 35 A G T 3 S+ 0 0 14 -21,-0.4 -21,-2.9 1,-0.3 2,-0.4 0.416 110.2 122.0 78.2 2.2 42.7 -12.4 13.9 36 36 A A E < -B 33 0A 2 -3,-2.0 -3,-1.6 -23,-0.2 2,-0.6 -0.776 63.0-135.7 -95.7 143.4 40.8 -10.2 16.2 37 37 A M E -BC 32 127A 0 90,-2.6 90,-2.5 -2,-0.4 2,-0.6 -0.867 29.8-158.7 -84.0 120.6 41.5 -6.6 17.2 38 38 A I E -BC 31 126A 24 -7,-3.2 -7,-2.5 -2,-0.6 2,-0.5 -0.937 4.2-160.7-111.6 116.6 41.0 -6.7 21.0 39 39 A I E -BC 30 125A 0 86,-3.2 86,-2.0 -2,-0.6 -9,-0.2 -0.871 7.7-170.9-102.5 125.8 40.2 -3.4 22.7 40 40 A N E -B 29 0A 76 -11,-2.7 -11,-1.7 -2,-0.5 84,-0.1 -0.873 16.6-158.0-113.3 92.5 40.8 -3.1 26.4 41 41 A P E -B 28 0A 2 0, 0.0 2,-0.4 0, 0.0 -13,-0.3 -0.438 19.5-113.8 -70.4 147.3 39.3 0.3 27.4 42 42 A Q > - 0 0 90 -15,-3.2 3,-2.2 -2,-0.1 5,-0.5 -0.677 37.0-101.7 -81.2 132.4 40.5 1.9 30.6 43 43 A E T 3 S+ 0 0 137 -2,-0.4 78,-0.2 1,-0.3 -1,-0.1 -0.201 106.0 12.6 -47.1 131.1 37.8 2.2 33.3 44 44 A G T 3 S+ 0 0 46 76,-2.9 -1,-0.3 1,-0.1 77,-0.1 0.315 105.1 90.7 83.1 -5.7 36.5 5.8 33.4 45 45 A K S < S- 0 0 123 -3,-2.2 -2,-0.1 -18,-0.2 3,-0.1 0.582 80.6-137.0 -98.1 -11.4 38.0 6.9 30.1 46 46 A Y - 0 0 121 -4,-0.4 -3,-0.1 1,-0.1 -18,-0.1 0.942 43.2-164.9 47.3 49.7 35.1 6.1 27.7 47 47 A G - 0 0 1 -5,-0.5 70,-3.2 -20,-0.4 2,-0.3 -0.095 16.4-180.0 -70.3 161.1 37.9 4.8 25.5 48 48 A A E -GH 26 116B 1 -22,-2.4 -22,-2.1 68,-0.3 2,-0.4 -0.997 32.7-122.0-153.8 152.9 37.8 4.0 21.8 49 49 A V E - H 0 115B 0 66,-1.9 66,-2.1 -2,-0.3 2,-0.4 -0.818 29.4-168.7 -84.8 140.4 39.7 2.8 18.8 50 50 A S E - H 0 114B 0 -2,-0.4 -26,-2.9 64,-0.2 2,-0.6 -0.863 7.9-155.2-135.4 97.0 39.4 5.4 16.1 51 51 A L E -FH 23 113B 1 62,-2.7 62,-2.0 -2,-0.4 2,-0.6 -0.665 10.2-161.5 -78.5 118.2 40.7 4.2 12.8 52 52 A K E -FH 22 112B 22 -30,-3.0 -30,-2.3 -2,-0.6 2,-0.5 -0.903 15.2-136.7-105.9 114.5 41.8 7.2 10.7 53 53 A R E -F 21 0B 74 58,-2.6 -32,-0.2 -2,-0.6 3,-0.1 -0.623 14.9-152.1 -71.6 117.0 42.1 6.6 6.9 54 54 A N S S+ 0 0 79 -34,-2.9 2,-0.4 -2,-0.5 -1,-0.2 0.789 79.9 31.6 -67.3 -30.4 45.4 8.3 6.1 55 55 A S S S- 0 0 98 -35,-0.4 -1,-0.2 -3,-0.0 2,-0.1 -0.969 116.6 -13.4-135.6 111.2 44.5 9.2 2.5 56 56 A G - 0 0 46 -2,-0.4 2,-0.3 -3,-0.1 -3,-0.1 -0.173 66.8 -98.5 91.6 177.8 40.9 9.9 1.5 57 57 A S - 0 0 55 -2,-0.1 2,-0.3 -3,-0.0 54,-0.2 -0.835 16.2-124.8-132.0 162.4 37.4 9.5 2.9 58 58 A F B -K 110 0C 9 52,-3.0 52,-2.6 -2,-0.3 2,-0.4 -0.795 22.1-148.8 -97.6 157.3 34.4 7.3 2.8 59 59 A R - 0 0 174 -2,-0.3 48,-0.1 50,-0.2 45,-0.1 -0.983 45.0 -57.8-134.3 126.3 30.9 8.5 1.9 60 60 A G S S+ 0 0 20 -2,-0.4 2,-0.2 48,-0.4 45,-0.1 -0.058 84.5 104.7 51.2-141.2 27.7 7.2 3.3 61 61 A G S S- 0 0 16 73,-0.4 43,-3.0 43,-0.1 2,-0.3 -0.414 73.0 -60.2 73.4-138.3 27.0 3.5 2.6 62 62 A S E -DE 103 133A 0 71,-2.5 71,-2.6 41,-0.3 2,-0.4 -0.972 28.8-135.0-149.3 155.1 27.3 0.9 5.3 63 63 A L E -DE 102 132A 0 39,-2.4 39,-2.9 -2,-0.3 2,-0.4 -0.975 19.4-170.4-117.2 133.1 29.7 -0.6 7.8 64 64 A R E +DE 101 131A 11 67,-2.8 67,-2.8 -2,-0.4 2,-0.3 -0.957 19.3 143.4-123.5 136.7 29.9 -4.4 8.3 65 65 A F E -D 100 0A 0 35,-2.0 35,-3.0 -2,-0.4 2,-0.5 -0.977 45.1-117.8-165.4 157.7 31.9 -6.1 11.0 66 66 A D E +DE 99 128A 17 62,-2.9 62,-2.2 -2,-0.3 2,-0.4 -0.913 41.9 173.6 -99.1 133.6 31.9 -9.1 13.4 67 67 A M E -DE 98 127A 0 31,-2.4 31,-1.9 -2,-0.5 2,-0.3 -1.000 25.2-176.7-143.5 141.7 32.0 -8.1 17.1 68 68 A K E + E 0 126A 59 58,-1.8 58,-2.8 -2,-0.4 2,-0.3 -0.943 21.9 171.5-127.5 154.8 31.7 -9.5 20.5 69 69 A N E -DE 94 125A 1 25,-2.3 25,-2.4 -2,-0.3 56,-0.2 -0.942 38.7-142.4-170.4 130.5 31.7 -7.2 23.5 70 70 A E S S+ 0 0 85 54,-2.2 2,-0.2 -2,-0.3 55,-0.1 0.720 89.7 17.1 -74.5 -25.5 31.1 -7.3 27.2 71 71 A G S S- 0 0 6 53,-0.4 23,-0.2 21,-0.1 2,-0.1 -0.757 104.7 -55.8-134.4-179.5 29.3 -4.0 27.3 72 72 A K - 0 0 117 -2,-0.2 46,-0.8 21,-0.1 2,-0.5 -0.395 49.3-156.3 -62.7 138.8 27.5 -1.5 25.1 73 73 A V E -IJ 91 117B 1 18,-2.2 18,-2.9 44,-0.2 2,-0.5 -0.978 3.7-149.1-120.9 122.6 29.7 -0.3 22.2 74 74 A K E -IJ 90 116B 61 42,-2.4 42,-2.8 -2,-0.5 2,-0.5 -0.835 9.3-154.5 -91.2 127.8 29.0 3.0 20.4 75 75 A I E +IJ 89 115B 0 14,-3.2 13,-2.6 -2,-0.5 14,-1.3 -0.901 22.6 169.6-101.2 125.5 29.9 3.1 16.7 76 76 A L E -IJ 87 114B 9 38,-2.0 38,-3.1 -2,-0.5 2,-0.3 -0.905 22.9-154.8-128.5 158.2 30.7 6.6 15.4 77 77 A V E -IJ 86 113B 0 9,-2.3 9,-2.3 -2,-0.3 2,-0.3 -0.934 16.1-161.4-122.9 158.0 32.2 8.1 12.3 78 78 A E E -IJ 85 112B 16 34,-2.1 33,-2.1 -2,-0.3 34,-1.7 -0.996 22.5-141.1-138.6 150.1 33.9 11.4 12.1 79 79 A N E >> -I 84 0B 12 5,-2.7 5,-1.8 -2,-0.3 4,-0.9 -0.938 19.4-163.6-102.2 108.4 34.9 14.0 9.5 80 80 A S T 45S+ 0 0 40 -2,-0.7 -1,-0.1 1,-0.2 3,-0.1 0.843 83.8 58.4 -69.9 -29.6 38.3 15.2 10.7 81 81 A E T 45S+ 0 0 187 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.0 0.894 119.7 28.6 -66.2 -43.0 38.3 18.4 8.6 82 82 A A T 45S- 0 0 59 -3,-0.2 -1,-0.2 2,-0.1 -2,-0.2 0.437 102.5-128.9 -91.3 -7.8 35.1 19.7 10.1 83 83 A D T <5 + 0 0 126 -4,-0.9 2,-0.5 1,-0.2 -3,-0.2 0.917 57.4 151.4 52.0 46.9 35.7 17.9 13.5 84 84 A E E < -I 79 0B 100 -5,-1.8 -5,-2.7 2,-0.0 2,-0.3 -0.923 28.5-162.7-112.9 132.5 32.1 16.6 13.1 85 85 A K E -I 78 0B 141 -2,-0.5 2,-0.3 -7,-0.2 -7,-0.2 -0.776 4.1-165.6-114.1 158.7 31.1 13.3 14.7 86 86 A F E -I 77 0B 59 -9,-2.3 -9,-2.3 -2,-0.3 2,-0.6 -0.973 18.7-133.6-147.6 124.8 28.1 11.0 14.0 87 87 A E E -I 76 0B 96 -2,-0.3 -11,-0.3 -11,-0.2 3,-0.1 -0.702 20.4-179.1 -81.8 118.0 26.7 8.1 16.0 88 88 A V E - 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