==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=31-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SUGAR BINDING PROTEIN 10-JUN-11 3SEE . COMPND 2 MOLECULE: HYPOTHETICAL SUGAR BINDING PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BACTEROIDES THETAIOTAOMICRON; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 214 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10452.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 123 57.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 3 1.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 71 33.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 11 5.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 20 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 5 2.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 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 PARALLEL BRIDGES PER LADDER . 3 0 1 3 2 2 0 2 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 0 0 0 0 0 0 0 1 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 20 A Q 0 0 115 0, 0.0 2,-0.4 0, 0.0 212,-0.4 0.000 360.0 360.0 360.0 152.2 56.8 53.3 18.0 2 21 A N - 0 0 51 1,-0.1 210,-0.2 210,-0.1 5,-0.1 -0.615 360.0-160.4 -68.1 123.6 53.2 53.6 17.1 3 22 A L + 0 0 45 208,-2.8 2,-0.4 -2,-0.4 -1,-0.1 0.569 65.7 90.7 -85.4 -10.9 52.7 51.5 13.9 4 23 A I - 0 0 2 207,-0.3 3,-0.4 205,-0.1 2,-0.2 -0.753 68.4-146.7 -89.5 133.3 49.4 53.2 13.0 5 24 A K S S+ 0 0 71 -2,-0.4 4,-0.1 1,-0.2 204,-0.1 -0.634 78.3 20.6 -96.2 155.8 49.7 56.3 10.8 6 25 A N S > S+ 0 0 39 -2,-0.2 3,-1.7 1,-0.1 -1,-0.2 0.918 79.6 172.9 49.4 50.8 47.4 59.4 10.9 7 26 A E T 3 + 0 0 71 -3,-0.4 202,-2.4 1,-0.3 201,-0.3 0.674 69.5 39.6 -69.7 -22.0 46.6 58.1 14.4 8 27 A K T 3 S- 0 0 103 200,-0.2 45,-0.3 199,-0.2 -1,-0.3 0.253 108.2-117.1-110.5 11.4 44.6 61.1 15.5 9 28 A F < + 0 0 0 -3,-1.7 45,-0.2 1,-0.1 4,-0.1 0.781 64.2 147.4 59.3 28.4 42.8 61.6 12.2 10 29 A A + 0 0 73 43,-0.1 2,-0.5 2,-0.1 -1,-0.1 0.829 63.3 61.3 -62.8 -30.6 44.3 65.0 11.8 11 30 A T S S- 0 0 97 -5,-0.0 -1,-0.0 42,-0.0 42,-0.0 -0.865 104.0-107.4 -93.6 129.1 44.3 64.4 8.1 12 31 A E - 0 0 116 -2,-0.5 2,-0.6 1,-0.1 -2,-0.1 -0.265 29.8-146.3 -56.5 137.0 40.8 63.9 6.6 13 32 A V + 0 0 10 1,-0.1 30,-0.7 -4,-0.1 16,-0.1 -0.947 41.6 138.9-111.8 118.4 40.0 60.3 5.7 14 33 A T + 0 0 95 -2,-0.6 2,-0.2 14,-0.2 -1,-0.1 0.488 29.6 123.9-128.9 -13.9 37.7 59.7 2.7 15 34 A N - 0 0 89 13,-0.2 15,-2.5 14,-0.1 2,-0.4 -0.313 38.3-170.9 -64.3 121.8 39.3 56.7 0.9 16 35 A K E -a 30 0A 111 13,-0.2 2,-0.3 -2,-0.2 15,-0.2 -0.904 3.6-172.4-107.9 139.5 36.9 53.8 0.4 17 36 A V E -a 31 0A 21 13,-2.0 15,-0.5 -2,-0.4 6,-0.0 -0.933 25.2-144.8-124.7 158.5 37.9 50.4 -0.8 18 37 A T S S+ 0 0 84 -2,-0.3 -1,-0.1 1,-0.3 13,-0.1 0.569 92.5 17.7 -94.5 -13.2 35.8 47.4 -1.8 19 38 A N S > S- 0 0 74 1,-0.1 3,-2.3 12,-0.0 -1,-0.3 -0.944 74.6-126.1-153.6 137.3 38.4 45.0 -0.4 20 39 A P G > S+ 0 0 6 0, 0.0 3,-1.7 0, 0.0 89,-0.1 0.757 105.3 74.1 -53.8 -26.4 41.3 45.5 1.9 21 40 A S G 3 S+ 0 0 42 1,-0.3 88,-0.1 87,-0.2 87,-0.0 0.762 97.6 48.5 -60.2 -21.3 43.6 43.9 -0.7 22 41 A K G < S+ 0 0 146 -3,-2.3 -1,-0.3 2,-0.1 2,-0.2 0.457 87.9 112.2 -96.1 -2.6 43.2 47.2 -2.7 23 42 A A S < S- 0 0 5 -3,-1.7 2,-0.4 -4,-0.3 6,-0.1 -0.471 70.8-121.6 -74.9 140.9 44.0 49.5 0.3 24 43 A T > - 0 0 91 -2,-0.2 3,-0.8 4,-0.1 52,-0.4 -0.664 36.4-117.8 -74.5 128.8 47.1 51.6 0.3 25 44 A A T 3 S+ 0 0 31 -2,-0.4 52,-0.2 1,-0.2 3,-0.1 -0.286 91.8 32.8 -68.8 153.7 49.1 50.7 3.4 26 45 A G T 3 S+ 0 0 29 50,-2.5 2,-0.3 1,-0.3 -1,-0.2 0.656 104.2 86.0 77.6 16.1 49.8 53.2 6.1 27 46 A E S < S- 0 0 83 -3,-0.8 49,-0.6 49,-0.3 2,-0.3 -0.904 82.2-104.8-135.5 158.2 46.6 55.1 5.5 28 47 A W E - B 0 75A 7 -2,-0.3 2,-0.3 47,-0.2 -13,-0.2 -0.673 35.8-166.6 -79.8 147.1 43.1 54.6 6.9 29 48 A F E - B 0 74A 5 45,-2.7 45,-2.7 -2,-0.3 2,-0.5 -0.956 16.6-131.3-129.4 155.0 40.5 53.1 4.6 30 49 A I E -aB 16 73A 12 -15,-2.5 -13,-2.0 -2,-0.3 2,-0.6 -0.920 16.1-166.6-103.5 120.5 36.7 52.9 4.8 31 50 A X E +aB 17 72A 7 41,-2.6 41,-1.9 -2,-0.5 2,-0.2 -0.963 21.4 154.7-102.1 120.9 35.1 49.5 4.2 32 51 A N E + B 0 71A 29 -2,-0.6 39,-0.2 -15,-0.5 38,-0.1 -0.647 9.4 145.9-146.7 85.6 31.3 49.8 3.7 33 52 A N + 0 0 68 37,-2.7 38,-0.2 -2,-0.2 3,-0.1 0.228 40.1 116.1-101.3 8.6 30.0 46.9 1.7 34 53 A E S S- 0 0 32 36,-0.3 3,-0.1 1,-0.2 5,-0.1 -0.417 84.2 -76.0 -65.3 157.2 26.7 46.8 3.6 35 54 A A > - 0 0 66 1,-0.2 3,-2.4 2,-0.1 4,-0.4 -0.163 64.8 -79.2 -52.3 146.7 23.7 47.7 1.5 36 55 A D T 3 S+ 0 0 170 1,-0.3 -1,-0.2 2,-0.1 -3,-0.0 -0.227 119.3 20.7 -47.8 129.0 23.2 51.3 0.6 37 56 A G T 3 S+ 0 0 53 2,-0.3 -1,-0.3 -3,-0.1 3,-0.1 0.228 94.4 101.1 94.3 -9.8 21.7 53.1 3.6 38 57 A V S < S- 0 0 25 -3,-2.4 23,-0.4 1,-0.2 24,-0.3 0.944 91.4 -5.3 -74.1 -49.3 22.7 50.7 6.3 39 58 A T - 0 0 5 -4,-0.4 2,-0.4 22,-0.2 -2,-0.3 -0.962 53.9-150.3-143.0 157.9 25.7 52.5 7.8 40 59 A T E -C 58 0A 88 18,-1.8 18,-3.0 -2,-0.3 2,-0.5 -0.993 8.9-170.7-130.4 126.7 27.8 55.6 7.2 41 60 A I E +C 57 0A 11 -2,-0.4 2,-0.3 16,-0.2 16,-0.2 -0.986 26.3 150.9-115.5 122.5 31.4 55.7 8.1 42 61 A A E -C 56 0A 41 14,-2.0 14,-3.1 -2,-0.5 2,-0.2 -0.991 45.4-103.7-153.9 154.3 33.0 59.2 7.8 43 62 A W E +C 55 0A 51 -30,-0.7 2,-0.3 -2,-0.3 12,-0.2 -0.461 42.6 175.3 -75.0 147.6 35.6 61.6 9.1 44 63 A E E -C 54 0A 35 10,-2.4 10,-2.2 -2,-0.2 2,-0.5 -0.994 36.6-126.1-150.1 155.5 34.5 64.4 11.4 45 64 A Q E -C 53 0A 136 -2,-0.3 8,-0.3 8,-0.2 10,-0.0 -0.933 27.8-162.5-100.2 127.3 35.7 67.3 13.5 46 65 A T - 0 0 30 6,-1.7 7,-0.1 -2,-0.5 -1,-0.1 0.667 25.3-126.8 -89.9 -23.9 34.2 66.7 16.9 47 66 A G S S+ 0 0 80 5,-0.6 2,-0.7 1,-0.2 6,-0.1 0.373 73.0 122.3 83.1 -3.3 34.4 70.0 18.8 48 67 A D > - 0 0 58 3,-0.5 3,-1.1 1,-0.1 -1,-0.2 -0.829 55.5-152.8 -96.1 115.9 36.2 68.2 21.6 49 68 A A T 3 S+ 0 0 99 -2,-0.7 -1,-0.1 1,-0.3 4,-0.1 0.785 94.7 53.4 -62.1 -27.0 39.6 69.7 22.3 50 69 A K T 3 S+ 0 0 159 1,-0.3 -1,-0.3 2,-0.1 -2,-0.0 0.795 129.2 16.8 -75.8 -27.4 41.0 66.5 23.7 51 70 A Y S < S+ 0 0 21 -3,-1.1 -3,-0.5 1,-0.1 -1,-0.3 -0.640 75.4 167.2-141.3 71.1 39.9 64.4 20.5 52 71 A P + 0 0 60 0, 0.0 -6,-1.7 0, 0.0 -5,-0.6 0.684 64.2 38.9 -77.5 -12.9 39.3 67.0 17.9 53 72 A N E S+C 45 0A 19 -45,-0.3 2,-0.3 -8,-0.3 -8,-0.2 -0.964 70.0 153.4-131.2 148.2 39.1 64.7 14.9 54 73 A A E -C 44 0A 0 -10,-2.2 -10,-2.4 -2,-0.3 2,-0.4 -0.967 41.6-109.3-159.5 167.3 37.5 61.2 14.7 55 74 A X E -CD 43 206A 0 151,-2.3 151,-2.6 -2,-0.3 2,-0.5 -0.932 30.8-150.8-104.5 136.8 35.8 58.6 12.5 56 75 A K E -CD 42 205A 70 -14,-3.1 -14,-2.0 -2,-0.4 2,-0.7 -0.946 7.7-162.8-111.5 127.4 32.1 58.1 13.1 57 76 A I E -CD 41 204A 4 147,-3.3 147,-2.2 -2,-0.5 2,-0.7 -0.927 16.7-170.8-106.9 103.8 30.5 54.7 12.5 58 77 A D E +CD 40 203A 48 -18,-3.0 -18,-1.8 -2,-0.7 3,-0.4 -0.866 19.0 173.5-109.6 102.7 26.8 55.5 12.2 59 78 A N > + 0 0 2 143,-2.9 142,-2.0 -2,-0.7 3,-1.8 0.037 41.7 120.6 -95.8 26.1 24.4 52.5 12.1 60 79 A S T 3 S+ 0 0 68 1,-0.3 -1,-0.2 141,-0.2 -21,-0.1 0.847 75.7 51.5 -54.5 -36.0 21.2 54.6 12.4 61 80 A G T 3 S+ 0 0 45 -3,-0.4 -1,-0.3 -23,-0.4 2,-0.2 0.501 86.8 115.5 -79.2 -3.4 20.1 53.2 9.0 62 81 A A < - 0 0 12 -3,-1.8 3,-0.1 -24,-0.3 -24,-0.1 -0.458 41.2-176.4 -82.1 136.8 20.6 49.5 10.0 63 82 A E S S+ 0 0 181 -2,-0.2 2,-0.3 1,-0.2 -1,-0.1 0.610 82.5 19.2 -91.4 -15.1 17.8 46.9 10.3 64 83 A K S S- 0 0 109 135,-0.0 137,-0.2 134,-0.0 -1,-0.2 -0.941 100.9 -77.5-147.6 158.6 20.3 44.3 11.5 65 84 A N - 0 0 99 -2,-0.3 134,-0.2 135,-0.1 2,-0.2 -0.271 57.7-107.1 -58.3 150.2 23.8 44.3 13.0 66 85 A T - 0 0 4 132,-2.2 2,-0.2 131,-0.1 -1,-0.1 -0.493 33.5-101.4 -84.8 156.8 26.5 44.9 10.5 67 86 A S >> - 0 0 22 -2,-0.2 3,-1.8 1,-0.1 4,-1.7 -0.522 17.5-130.8 -82.1 139.2 28.8 42.1 9.2 68 87 A W T 34 S+ 0 0 56 1,-0.3 -1,-0.1 -2,-0.2 -2,-0.0 0.744 109.1 42.8 -57.5 -28.9 32.4 41.8 10.5 69 88 A Y T 34 S+ 0 0 126 1,-0.1 -1,-0.3 -36,-0.0 3,-0.1 0.378 114.7 49.5-100.7 1.8 33.7 41.6 6.9 70 89 A K T <4 S+ 0 0 68 -3,-1.8 -37,-2.7 1,-0.2 2,-0.4 0.773 107.9 34.4-108.3 -38.4 31.6 44.3 5.3 71 90 A A E < S+B 32 0A 4 -4,-1.7 2,-0.3 -39,-0.2 126,-0.3 -0.938 74.6 109.7-134.4 113.5 31.7 47.5 7.5 72 91 A F E -B 31 0A 1 -41,-1.9 -41,-2.6 -2,-0.4 2,-0.5 -0.981 61.3-104.1-168.3 161.6 34.7 48.8 9.4 73 92 A L E -BE 30 195A 0 122,-2.7 122,-2.7 -2,-0.3 2,-0.3 -0.881 50.5-173.7 -91.0 126.4 37.5 51.3 9.7 74 93 A G E -BE 29 194A 0 -45,-2.7 -45,-2.7 -2,-0.5 2,-0.3 -0.886 27.2-171.1-127.1 155.4 40.7 49.7 8.5 75 94 A Q E -BE 28 193A 2 118,-1.9 118,-2.4 -2,-0.3 2,-0.3 -0.911 19.8-143.6-143.7 121.9 44.5 50.3 8.2 76 95 A R E - E 0 192A 32 -49,-0.6 -50,-2.5 -52,-0.4 2,-0.5 -0.632 12.6-157.0 -82.2 137.1 46.8 48.0 6.3 77 96 A I E + E 0 191A 4 114,-3.1 114,-1.7 -2,-0.3 4,-0.2 -0.977 26.2 159.5-123.4 119.5 50.2 47.4 7.8 78 97 A T + 0 0 67 -2,-0.5 -1,-0.1 112,-0.2 112,-0.0 0.157 47.6 103.7-121.9 15.3 53.1 46.2 5.6 79 98 A D S S- 0 0 129 -76,-0.1 110,-0.1 1,-0.0 -1,-0.1 0.734 94.5-103.6 -73.1 -17.3 56.1 47.3 7.7 80 99 A G - 0 0 44 108,-0.3 109,-0.2 107,-0.1 2,-0.2 0.713 35.7-139.9 93.7 101.8 56.6 43.6 8.8 81 100 A L - 0 0 16 107,-2.8 2,-0.2 -4,-0.2 107,-0.0 -0.534 11.0-126.4 -85.4 163.2 55.5 42.6 12.3 82 101 A E - 0 0 117 -2,-0.2 2,-1.6 3,-0.1 78,-0.1 -0.575 28.0-104.4-101.5 161.5 57.3 40.3 14.8 83 102 A K S S+ 0 0 85 -2,-0.2 78,-0.2 78,-0.1 2,-0.1 -0.291 88.1 98.6 -78.1 53.9 56.0 37.2 16.6 84 103 A G S S- 0 0 15 -2,-1.6 76,-2.2 76,-0.1 77,-0.6 -0.381 81.0 -70.4-118.7-156.3 55.6 39.1 19.9 85 104 A I E -F 159 0A 38 129,-0.4 129,-3.0 74,-0.2 2,-0.3 -0.814 44.4-173.8-107.4 140.8 52.9 40.8 21.9 86 105 A Y E -FG 158 213A 8 72,-2.5 72,-3.0 -2,-0.4 2,-0.4 -0.970 15.1-141.6-131.9 148.4 51.2 44.1 20.8 87 106 A V E -FG 157 212A 10 125,-2.7 125,-2.2 -2,-0.3 2,-0.5 -0.933 7.2-160.9-112.3 134.1 48.7 46.4 22.3 88 107 A L E +FG 156 211A 1 68,-2.9 68,-2.3 -2,-0.4 2,-0.3 -0.974 19.7 173.4-109.4 124.3 46.0 48.2 20.4 89 108 A T E +FG 155 210A 22 121,-2.5 121,-3.1 -2,-0.5 2,-0.3 -0.974 7.1 146.5-129.6 146.4 44.6 51.2 22.1 90 109 A F E -F 154 0A 0 64,-2.1 64,-3.3 -2,-0.3 2,-0.4 -0.956 40.2-109.3-162.6 173.9 42.1 53.9 21.1 91 110 A Y E -FG 153 207A 48 116,-2.8 116,-2.6 -2,-0.3 2,-0.3 -0.928 32.2-173.5-112.9 141.5 39.4 56.2 22.4 92 111 A A E -FG 152 206A 0 60,-2.2 60,-2.4 -2,-0.4 2,-0.4 -0.973 12.1-162.9-135.6 152.9 35.7 55.7 21.6 93 112 A K E - 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