==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CARBOHYDRATE-BINDING DOMAIN 28-SEP-04 1W8T . COMPND 2 MOLECULE: NON CATALYTIC PROTEIN 1; . SOURCE 2 ORGANISM_SCIENTIFIC: PIROMYCES EQUI; . AUTHOR J.FLINT,D.N.BOLAM,D.NURIZZO,E.J.TAYLOR,M.P.WILLIAMSON, . 142 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7507.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 95 66.9 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 45.8 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 . 1 0.7 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 14.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 5 3.5 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 2 A N 0 0 182 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 112.1 20.8 2.2 29.8 2 3 A V + 0 0 153 2,-0.1 2,-0.1 0, 0.0 0, 0.0 0.405 360.0 110.9 -99.9 4.4 23.4 2.2 27.0 3 4 A R S S- 0 0 211 1,-0.1 2,-0.1 131,-0.0 130,-0.0 -0.434 72.3-104.3 -75.2 154.0 21.8 -0.6 24.9 4 5 A A - 0 0 32 134,-0.1 2,-0.6 -2,-0.1 -1,-0.1 -0.310 20.0-121.1 -76.6 159.0 20.2 0.3 21.6 5 6 A T - 0 0 85 -2,-0.1 128,-1.5 2,-0.0 2,-0.6 -0.909 27.3-157.4 -94.5 120.3 16.6 0.7 20.7 6 7 A Y E -A 132 0A 77 -2,-0.6 2,-0.6 126,-0.2 126,-0.2 -0.890 5.6-166.7-102.9 121.1 15.7 -1.7 17.9 7 8 A T E -A 131 0A 33 124,-3.1 124,-2.5 -2,-0.6 2,-0.9 -0.936 9.7-153.5-106.4 110.0 12.6 -0.8 15.8 8 9 A V E -A 130 0A 66 -2,-0.6 122,-0.2 122,-0.2 3,-0.2 -0.761 13.5-177.9 -83.3 106.6 11.3 -3.6 13.7 9 10 A I E - 0 0 11 120,-2.3 2,-0.3 -2,-0.9 -1,-0.2 0.950 67.7 -22.0 -74.3 -49.5 9.7 -1.6 10.9 10 11 A F E -A 129 0A 13 119,-1.6 119,-1.6 -3,-0.2 -1,-0.3 -0.962 46.2-174.1-155.8 152.1 8.5 -4.8 9.2 11 12 A K S S+ 0 0 113 1,-0.5 117,-2.4 -2,-0.3 2,-0.5 0.709 89.0 6.5 -96.6 -87.3 9.4 -8.5 9.1 12 13 A N S S- 0 0 102 115,-0.2 -1,-0.5 116,-0.1 2,-0.5 -0.856 85.9-138.8 -94.5 132.6 7.2 -9.9 6.4 13 14 A A + 0 0 5 21,-2.8 21,-0.4 -2,-0.5 3,-0.1 -0.832 36.9 161.5 -99.3 126.7 5.3 -7.2 4.7 14 15 A S S S- 0 0 119 -2,-0.5 2,-0.3 1,-0.3 -1,-0.1 0.028 81.4 -24.7-119.5 20.1 1.6 -7.6 3.7 15 16 A G S S- 0 0 24 15,-0.1 -1,-0.3 3,-0.0 3,-0.1 -0.933 104.1 -35.5 159.7-174.8 1.1 -3.9 3.3 16 17 A L S S- 0 0 70 -2,-0.3 3,-0.1 1,-0.1 -2,-0.1 -0.451 75.3 -95.9 -67.5 146.3 2.8 -0.7 4.6 17 18 A P > - 0 0 12 0, 0.0 3,-2.0 0, 0.0 -1,-0.1 -0.332 45.4 -97.8 -61.9 137.4 4.0 -1.0 8.2 18 19 A N T 3 S+ 0 0 174 1,-0.3 3,-0.1 -9,-0.1 -3,-0.0 -0.376 114.6 30.0 -53.9 132.2 1.5 0.4 10.9 19 20 A G T 3 S+ 0 0 33 1,-0.3 34,-2.8 -3,-0.1 35,-0.5 0.391 106.0 94.6 97.0 -2.9 2.6 3.9 11.7 20 21 A Y E < -F 52 0B 25 -3,-2.0 -1,-0.3 32,-0.2 2,-0.2 -0.966 51.0-165.3-126.9 136.8 4.1 4.6 8.3 21 22 A D E -F 51 0B 77 30,-2.4 30,-2.9 -2,-0.4 2,-0.6 -0.683 28.7-115.8-103.2 168.5 2.8 6.3 5.1 22 23 A N E +F 50 0B 55 -2,-0.2 28,-0.2 28,-0.2 89,-0.0 -0.937 31.0 172.9-109.9 110.0 4.4 6.0 1.7 23 24 A W + 0 0 117 26,-3.1 27,-0.1 -2,-0.6 -1,-0.1 -0.047 40.4 133.6 -99.8 28.1 5.7 9.3 0.3 24 25 A G - 0 0 27 25,-0.3 2,-0.3 1,-0.0 24,-0.2 0.041 39.7-153.2 -72.5-178.6 7.3 7.5 -2.6 25 26 A W B +G 47 0B 91 22,-2.0 22,-2.5 1,-0.0 3,-0.1 -0.994 60.2 19.8-154.5 151.5 7.2 8.4 -6.2 26 27 A G S S+ 0 0 23 -2,-0.3 15,-3.1 20,-0.2 20,-0.5 0.759 101.6 76.3 59.9 29.8 7.5 6.8 -9.6 27 28 A C E -B 40 0A 32 13,-0.3 2,-0.3 20,-0.2 -1,-0.1 -0.978 64.5-130.4-154.8 168.8 6.7 3.2 -8.6 28 29 A T E -B 39 0A 90 11,-1.9 11,-3.1 -2,-0.3 2,-0.4 -0.882 22.9-143.8-116.8 152.9 4.1 0.7 -7.6 29 30 A L E +B 38 0A 38 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.965 17.5 177.8-116.4 137.9 4.3 -1.6 -4.5 30 31 A S E -B 37 0A 57 7,-2.2 7,-3.3 -2,-0.4 2,-0.4 -0.881 18.4-141.4-131.4 165.7 3.1 -5.1 -4.2 31 32 A Y E +B 36 0A 72 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.976 32.5 147.1-135.3 116.4 3.4 -7.6 -1.4 32 33 A Y E > +B 35 0A 193 3,-1.5 3,-2.0 -2,-0.4 -19,-0.1 -0.983 66.7 5.1-151.5 135.2 4.0 -11.3 -1.9 33 34 A G T 3 S- 0 0 65 -2,-0.3 3,-0.1 1,-0.3 -19,-0.1 0.741 127.9 -60.9 66.9 21.5 5.9 -13.9 0.1 34 35 A G T 3 S+ 0 0 15 -21,-0.4 -21,-2.8 1,-0.3 2,-0.4 0.438 110.3 122.4 82.5 -1.4 6.4 -11.4 2.9 35 36 A A E < -B 32 0A 2 -3,-2.0 -3,-1.5 -23,-0.2 2,-0.7 -0.756 62.7-135.0 -92.9 141.2 8.4 -9.1 0.6 36 37 A M E -BC 31 126A 0 90,-2.7 90,-2.5 -2,-0.4 2,-0.6 -0.862 30.0-157.4 -83.4 119.9 7.7 -5.5 -0.2 37 38 A I E -BC 30 125A 20 -7,-3.3 -7,-2.2 -2,-0.7 2,-0.5 -0.918 5.3-158.0-109.8 114.9 8.2 -5.5 -3.9 38 39 A I E -BC 29 124A 0 86,-3.1 86,-1.9 -2,-0.6 -9,-0.2 -0.853 5.6-170.1 -95.6 125.5 9.0 -2.1 -5.6 39 40 A N E -B 28 0A 76 -11,-3.1 -11,-1.9 -2,-0.5 2,-0.2 -0.877 15.8-160.0-111.9 90.6 8.2 -1.9 -9.3 40 41 A P E -B 27 0A 4 0, 0.0 2,-0.4 0, 0.0 -13,-0.3 -0.479 18.5-114.8 -74.9 147.5 9.8 1.4 -10.4 41 42 A Q > - 0 0 110 -15,-3.1 3,-2.2 -2,-0.2 5,-0.4 -0.629 37.3-100.1 -82.3 134.3 8.7 3.1 -13.6 42 43 A E T 3 S+ 0 0 147 -2,-0.4 78,-0.2 1,-0.3 -1,-0.1 -0.208 106.2 9.5 -49.0 130.0 11.3 3.4 -16.4 43 44 A G T 3 S+ 0 0 52 76,-3.1 -1,-0.3 1,-0.1 77,-0.1 0.339 105.6 92.3 81.1 -1.7 12.8 6.9 -16.4 44 45 A K S < S- 0 0 117 -3,-2.2 -2,-0.1 -18,-0.2 -1,-0.1 0.585 79.7-138.5 -98.6 -11.0 11.3 8.1 -13.1 45 46 A Y - 0 0 120 -4,-0.4 -18,-0.1 74,-0.1 -3,-0.1 0.936 42.4-167.5 47.1 49.1 14.1 7.1 -10.7 46 47 A G + 0 0 0 -20,-0.5 70,-3.3 -5,-0.4 2,-0.3 -0.097 16.4 178.5 -72.5 162.6 11.3 6.0 -8.5 47 48 A A E -GH 25 115B 0 -22,-2.5 -22,-2.0 68,-0.2 2,-0.4 -0.995 33.1-117.6-155.2 154.8 11.4 5.0 -4.8 48 49 A V E - H 0 114B 0 66,-1.8 66,-2.0 -2,-0.3 2,-0.4 -0.783 29.2-167.0 -83.4 142.6 9.5 3.9 -1.8 49 50 A S E - H 0 113B 0 -2,-0.4 -26,-3.1 64,-0.2 2,-0.6 -0.855 7.4-154.6-135.8 97.4 9.7 6.5 0.9 50 51 A L E -FH 22 112B 1 62,-2.8 62,-1.9 -2,-0.4 2,-0.6 -0.656 11.7-162.0 -78.7 117.0 8.5 5.2 4.3 51 52 A K E -FH 21 111B 18 -30,-2.9 -30,-2.4 -2,-0.6 2,-0.5 -0.900 14.9-136.9-105.4 116.9 7.4 8.1 6.3 52 53 A R E -F 20 0B 73 58,-2.8 -32,-0.2 -2,-0.6 3,-0.1 -0.605 14.7-151.6 -73.5 118.9 7.0 7.6 10.1 53 54 A N S S+ 0 0 76 -34,-2.8 2,-0.4 -2,-0.5 -1,-0.2 0.861 78.9 24.6 -66.4 -36.0 3.8 9.4 10.8 54 55 A S S S- 0 0 100 -35,-0.5 -1,-0.2 -3,-0.1 2,-0.1 -0.991 117.0 -3.7-134.6 120.5 4.6 10.3 14.4 55 56 A G - 0 0 46 -2,-0.4 2,-0.3 -3,-0.1 -3,-0.1 -0.242 66.4-110.6 93.5-178.1 8.2 10.7 15.6 56 57 A S - 0 0 48 -2,-0.1 2,-0.3 22,-0.0 54,-0.2 -0.883 11.0-119.3-147.6 166.7 11.6 10.2 14.2 57 58 A F B -K 109 0C 8 52,-2.8 52,-2.8 -2,-0.3 2,-0.4 -0.816 20.7-150.1-106.7 157.6 14.8 8.2 14.2 58 59 A R - 0 0 164 -2,-0.3 48,-0.1 50,-0.2 45,-0.1 -0.985 47.0 -58.9-133.9 124.9 18.3 9.5 15.1 59 60 A G S S+ 0 0 19 -2,-0.4 2,-0.1 48,-0.4 45,-0.1 -0.068 84.6 105.6 50.9-139.4 21.6 8.1 13.7 60 61 A G S S- 0 0 15 73,-0.4 43,-3.0 71,-0.1 2,-0.3 -0.384 73.1 -59.7 71.8-139.0 22.2 4.5 14.4 61 62 A S E -DE 102 132A 0 71,-2.5 71,-2.7 41,-0.3 2,-0.4 -0.976 29.7-135.3-149.4 154.5 21.9 1.9 11.7 62 63 A L E -DE 101 131A 0 39,-2.3 39,-2.8 -2,-0.3 2,-0.4 -0.966 19.1-169.6-117.1 131.8 19.5 0.4 9.2 63 64 A R E +DE 100 130A 14 67,-2.8 67,-2.8 -2,-0.4 2,-0.3 -0.954 19.1 143.8-121.3 136.7 19.2 -3.4 8.7 64 65 A F E -D 99 0A 0 35,-2.0 35,-3.0 -2,-0.4 2,-0.5 -0.975 44.0-118.8-163.4 158.1 17.2 -5.1 5.9 65 66 A D E +DE 98 127A 18 62,-2.9 62,-2.2 -2,-0.3 2,-0.4 -0.903 41.8 172.2 -98.7 132.9 17.2 -8.0 3.5 66 67 A M E -DE 97 126A 0 31,-2.3 31,-1.8 -2,-0.5 2,-0.3 -0.999 26.0-175.8-144.3 143.1 17.2 -7.1 -0.1 67 68 A K E + E 0 125A 55 58,-1.7 58,-2.8 -2,-0.4 2,-0.3 -0.938 22.1 173.2-126.1 156.2 17.4 -8.5 -3.6 68 69 A N E -DE 93 124A 2 25,-2.3 25,-2.3 -2,-0.3 56,-0.2 -0.942 38.8-142.9-170.1 131.6 17.4 -6.2 -6.5 69 70 A E S S+ 0 0 88 54,-2.1 2,-0.2 -2,-0.3 55,-0.1 0.697 90.3 17.7 -76.6 -22.4 17.9 -6.3 -10.3 70 71 A G S S- 0 0 5 53,-0.4 23,-0.1 21,-0.1 20,-0.1 -0.809 103.8 -57.2-136.7 179.1 19.8 -3.0 -10.3 71 72 A K - 0 0 111 -2,-0.2 46,-0.8 21,-0.1 2,-0.5 -0.353 49.8-156.0 -60.3 138.3 21.6 -0.5 -8.1 72 73 A V E -IJ 90 116B 2 18,-2.2 18,-3.0 44,-0.2 2,-0.5 -0.985 4.5-147.7-121.1 123.1 19.5 0.7 -5.2 73 74 A A E -IJ 89 115B 5 42,-2.3 42,-2.8 -2,-0.5 2,-0.5 -0.807 8.9-153.8 -88.6 130.6 20.1 4.0 -3.4 74 75 A I E +IJ 88 114B 0 14,-3.0 13,-2.4 -2,-0.5 14,-1.4 -0.933 24.4 168.4-100.4 122.8 19.3 4.0 0.3 75 76 A L E -IJ 86 113B 6 38,-2.0 38,-3.0 -2,-0.5 2,-0.3 -0.903 23.0-155.6-128.3 158.9 18.4 7.5 1.6 76 77 A V E -IJ 85 112B 0 9,-2.3 9,-2.2 -2,-0.3 2,-0.3 -0.935 15.5-164.3-124.4 157.7 17.0 9.0 4.7 77 78 A E E -IJ 84 111B 15 34,-2.1 33,-2.1 -2,-0.3 34,-1.8 -0.988 22.8-140.1-141.0 152.2 15.2 12.4 5.0 78 79 A N E >> -I 83 0B 17 5,-2.7 5,-1.8 -2,-0.3 4,-1.2 -0.957 18.4-162.8-105.8 111.8 14.1 14.9 7.5 79 80 A S T 45S+ 0 0 36 -2,-0.6 -1,-0.1 1,-0.2 30,-0.1 0.786 84.3 55.6 -71.7 -27.5 10.7 16.1 6.3 80 81 A E T 45S+ 0 0 185 1,-0.2 -1,-0.2 3,-0.1 -2,-0.0 0.922 120.0 31.1 -70.4 -44.6 10.6 19.3 8.5 81 82 A A T 45S- 0 0 58 2,-0.1 -1,-0.2 0, 0.0 -2,-0.2 0.594 102.6-131.4 -81.9 -15.6 13.9 20.5 7.1 82 83 A D T <5 + 0 0 123 -4,-1.2 2,-0.4 1,-0.2 -3,-0.2 0.929 56.2 149.6 52.9 51.7 13.4 18.9 3.7 83 84 A E E < -I 78 0B 99 -5,-1.8 -5,-2.7 2,-0.0 2,-0.3 -0.957 29.8-163.1-118.0 131.9 16.9 17.5 4.0 84 85 A K E -I 77 0B 128 -2,-0.4 2,-0.3 -7,-0.2 -7,-0.2 -0.734 2.9-164.9-113.0 157.9 18.0 14.2 2.4 85 86 A F E -I 76 0B 60 -9,-2.2 -9,-2.3 -2,-0.3 2,-0.7 -0.963 17.9-134.2-145.7 127.7 21.1 12.0 3.1 86 87 A E E +I 75 0B 102 -2,-0.3 -11,-0.2 -11,-0.2 3,-0.1 -0.710 21.6 179.2 -86.3 118.3 22.5 9.2 1.0 87 88 A V E - 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