==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 25-SEP-02 1MVE . COMPND 2 MOLECULE: TRUNCATED 1,3-1,4-BETA-D-GLUCANASE; . SOURCE 2 ORGANISM_SCIENTIFIC: FIBROBACTER SUCCINOGENES; . AUTHOR L.-C.TSAI,L.-F.SHYUR,S.-H.LEE,S.-S.LIN,H.S.YUAN . 243 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10849.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 159 65.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 1.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 99 40.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 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 1.6 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 . 23 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 23 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 5 2.1 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 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 PARALLEL BRIDGES PER LADDER . 3 1 4 3 3 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 2 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 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 X 0 0 143 0, 0.0 2,-0.4 0, 0.0 202,-0.0 0.000 360.0 360.0 360.0 136.9 23.8 23.5 5.0 2 2 A V + 0 0 128 211,-0.0 2,-0.2 200,-0.0 202,-0.1 -0.993 360.0 175.3-138.4 135.0 25.0 21.4 2.0 3 3 A S - 0 0 41 -2,-0.4 208,-0.1 2,-0.2 200,-0.0 -0.690 47.9 -98.1-122.9 179.6 27.9 19.1 1.4 4 4 A A S S+ 0 0 95 -2,-0.2 207,-0.0 2,-0.0 -2,-0.0 0.491 74.7 133.0 -78.6 -2.5 28.9 16.9 -1.5 5 5 A K - 0 0 54 1,-0.1 -2,-0.2 205,-0.0 206,-0.1 -0.221 58.7-135.0 -52.1 135.3 27.3 13.8 0.1 6 6 A D S S+ 0 0 108 203,-0.2 225,-2.7 224,-0.1 2,-0.3 0.536 77.5 55.9 -73.1 -9.0 25.2 11.9 -2.4 7 7 A F E -aB 210 230A 4 202,-0.7 204,-2.4 223,-0.3 2,-0.4 -0.850 63.2-147.5-128.0 158.2 22.2 11.3 -0.2 8 8 A S E +aB 211 229A 0 221,-2.9 221,-2.2 -2,-0.3 204,-0.2 -0.964 19.5 170.4-126.8 145.0 19.8 13.2 1.9 9 9 A G E -a 212 0A 0 202,-2.8 204,-2.3 -2,-0.4 2,-0.3 -0.612 24.0-108.3-133.3-163.6 18.1 12.1 5.1 10 10 A A E -C 140 0B 0 130,-1.9 130,-2.7 202,-0.2 2,-0.4 -0.973 17.3-174.3-143.2 146.9 16.0 13.7 7.9 11 11 A E E -C 139 0B 9 -2,-0.3 190,-3.6 128,-0.2 2,-0.4 -0.952 9.7-168.6-140.2 118.7 16.0 14.8 11.5 12 12 A L E +CD 138 200B 0 126,-3.0 126,-2.3 -2,-0.4 2,-0.3 -0.884 17.1 175.4-101.6 133.3 12.8 16.0 13.2 13 13 A Y E -CD 137 199B 55 186,-2.1 186,-3.0 -2,-0.4 124,-0.2 -1.000 33.3-113.2-144.1 144.2 13.3 17.7 16.6 14 14 A T E - D 0 198B 15 122,-2.1 184,-0.2 -2,-0.3 183,-0.1 -0.523 21.2-138.7 -71.9 142.1 11.2 19.5 19.2 15 15 A L S S+ 0 0 90 182,-2.5 2,-0.3 -2,-0.2 -1,-0.1 0.812 87.0 53.2 -70.0 -30.0 12.1 23.2 19.5 16 16 A E S S- 0 0 143 181,-0.4 120,-0.4 120,-0.1 2,-0.3 -0.771 72.1-149.7-108.5 153.5 11.8 22.9 23.3 17 17 A E - 0 0 54 -2,-0.3 2,-0.3 118,-0.2 118,-0.3 -0.769 13.3-166.5-115.0 162.3 13.4 20.5 25.7 18 18 A V B -J 134 0C 58 116,-2.6 116,-2.6 -2,-0.3 2,-0.6 -0.916 24.2-115.7-144.3 167.2 12.1 19.3 29.0 19 19 A Q S S- 0 0 104 -2,-0.3 152,-0.3 114,-0.2 114,-0.1 -0.959 79.9 -20.6-110.1 117.3 13.2 17.4 32.2 20 20 A Y S S+ 0 0 51 -2,-0.6 151,-0.3 86,-0.1 2,-0.3 0.343 77.1 119.6 69.1 160.2 11.5 14.1 32.6 21 21 A G E -K 105 0D 0 84,-2.5 84,-2.8 149,-0.2 2,-0.4 -0.885 58.2 -77.4 144.3-175.3 8.3 12.7 31.1 22 22 A K E -KL 104 169D 35 147,-1.3 147,-3.0 -2,-0.3 2,-0.4 -0.956 37.4-167.5-120.1 142.6 6.8 10.0 28.8 23 23 A F E -KL 103 168D 4 80,-2.5 80,-2.4 -2,-0.4 2,-0.4 -0.989 5.6-177.2-137.1 122.2 7.2 10.3 25.1 24 24 A E E -KL 102 167D 30 143,-2.9 143,-2.5 -2,-0.4 2,-0.4 -0.947 5.1-177.4-124.1 143.8 5.2 8.1 22.7 25 25 A A E -KL 101 166D 0 76,-2.2 76,-2.8 -2,-0.4 2,-0.8 -0.975 18.1-148.3-143.4 127.7 5.3 7.9 18.9 26 26 A R E +KL 100 165D 49 139,-2.7 138,-2.7 -2,-0.4 139,-1.0 -0.837 44.2 149.0 -93.8 111.5 3.2 5.8 16.6 27 27 A X E -KL 99 163D 0 72,-2.6 72,-2.0 -2,-0.8 2,-0.5 -0.965 50.9-140.0-148.9 163.9 5.4 4.9 13.7 28 28 A K E - L 0 162D 40 134,-2.4 134,-2.5 -2,-0.3 67,-0.2 -0.987 38.3-142.4-119.8 119.7 6.5 2.6 10.8 29 29 A X - 0 0 1 65,-2.2 2,-0.4 -2,-0.5 131,-0.1 -0.251 4.7-123.4 -84.1 168.2 10.3 2.6 10.5 30 30 A A - 0 0 4 129,-0.1 2,-0.3 31,-0.1 131,-0.1 -0.857 30.8-179.2-106.8 146.7 12.5 2.5 7.4 31 31 A A + 0 0 2 -2,-0.4 2,-0.3 64,-0.1 31,-0.1 -0.934 18.5 139.3-155.2 126.9 15.1 -0.2 7.0 32 32 A A > - 0 0 1 -2,-0.3 3,-2.5 117,-0.1 32,-0.2 -0.948 65.6 -76.0-151.4 154.0 17.8 -1.3 4.5 33 33 A S T 3 S+ 0 0 38 -2,-0.3 120,-2.2 30,-0.3 117,-0.2 -0.313 123.1 26.9 -52.4 134.6 21.3 -2.6 5.2 34 34 A G T 3 S+ 0 0 0 115,-2.7 109,-1.3 1,-0.3 -1,-0.3 0.340 98.8 116.8 94.1 -6.6 23.3 0.4 6.2 35 35 A T E < -E 142 0B 0 -3,-2.5 28,-3.1 114,-0.4 2,-0.4 -0.588 47.6-156.1-102.8 162.2 20.5 2.6 7.6 36 36 A V E +EF 141 62B 0 105,-2.7 105,-2.4 26,-0.2 2,-0.4 -1.000 12.1 179.1-130.5 128.2 19.5 4.1 11.0 37 37 A S E +EF 140 61B 0 24,-1.7 24,-3.1 -2,-0.4 2,-0.2 -0.995 26.7 168.2-132.6 119.2 15.8 4.9 11.7 38 38 A S E - F 0 60B 0 101,-2.6 2,-0.3 -2,-0.4 22,-0.2 -0.746 46.3-156.5-139.3 179.4 15.2 6.3 15.2 39 39 A X E + F 0 59B 3 20,-2.1 20,-1.7 -2,-0.2 2,-0.3 -0.937 38.0 158.6-150.3 125.1 13.4 8.0 18.1 40 40 A F E -GF 137 58B 14 97,-2.8 97,-3.1 -2,-0.3 2,-0.4 -0.999 40.8-128.4-154.6 151.8 15.6 9.6 20.8 41 41 A L E -GF 136 57B 1 16,-2.5 16,-2.0 -2,-0.3 2,-0.4 -0.815 37.5-175.4 -94.1 142.9 15.7 12.1 23.6 42 42 A Y E -GF 135 56B 22 93,-2.4 93,-2.9 -2,-0.4 2,-0.9 -0.963 29.8-140.8-149.3 127.6 18.6 14.5 23.2 43 43 A Q > - 0 0 26 12,-2.7 3,-2.0 -2,-0.4 12,-0.3 -0.767 39.3-123.1 -84.8 109.0 20.2 17.3 25.3 44 44 A N T 3 S+ 0 0 95 -2,-0.9 89,-0.1 1,-0.3 -1,-0.0 -0.225 95.2 31.5 -53.7 136.3 21.1 19.8 22.6 45 45 A G T > S+ 0 0 7 7,-0.0 3,-3.0 9,-0.0 -1,-0.3 0.238 76.8 122.0 98.6 -13.2 24.8 20.7 22.7 46 46 A S T < S+ 0 0 0 -3,-2.0 32,-0.3 1,-0.3 -2,-0.1 0.794 70.3 62.6 -51.1 -30.8 25.9 17.2 24.0 47 47 A E T 3 S+ 0 0 92 30,-0.1 2,-0.7 2,-0.1 -1,-0.3 0.598 77.4 107.6 -73.2 -9.2 28.1 17.0 20.9 48 48 A I < - 0 0 64 -3,-3.0 2,-1.8 5,-0.1 4,-0.5 -0.602 63.1-150.8 -74.5 111.8 30.1 20.1 22.2 49 49 A A + 0 0 85 -2,-0.7 -1,-0.1 1,-0.2 -2,-0.1 -0.337 62.4 112.8 -81.4 58.5 33.5 18.8 23.3 50 50 A D S S- 0 0 97 -2,-1.8 -1,-0.2 3,-0.1 -2,-0.1 0.134 104.4 -83.2-113.5 17.9 34.1 21.5 25.9 51 51 A G S S+ 0 0 53 1,-0.3 -2,-0.1 -3,-0.2 -3,-0.0 0.367 87.2 143.9 96.5 -3.6 33.9 19.1 28.9 52 52 A R - 0 0 92 -4,-0.5 26,-0.6 -7,-0.1 -1,-0.3 -0.291 55.6-101.5 -67.1 150.6 30.1 19.4 28.9 53 53 A P B -R 77 0E 61 0, 0.0 2,-0.4 0, 0.0 24,-0.3 -0.412 26.6-131.3 -74.5 151.6 28.1 16.3 29.8 54 54 A W - 0 0 33 22,-2.4 2,-0.4 -2,-0.1 22,-0.2 -0.901 25.5-178.1-103.3 132.6 26.4 14.1 27.1 55 55 A V + 0 0 0 -2,-0.4 -12,-2.7 -12,-0.3 2,-0.3 -0.963 19.5 136.0-136.5 114.4 22.7 13.3 27.8 56 56 A E E -FH 42 74B 19 18,-1.3 18,-2.5 -2,-0.4 2,-0.4 -0.978 32.4-160.8-159.5 143.8 20.8 11.1 25.3 57 57 A V E -FH 41 73B 0 -16,-2.0 -16,-2.5 -2,-0.3 2,-0.3 -0.996 27.5-155.0-129.7 125.6 18.3 8.1 25.3 58 58 A D E +FH 40 72B 1 14,-2.8 14,-1.4 -2,-0.4 2,-0.4 -0.810 33.5 177.4-118.5 149.6 18.0 6.1 22.1 59 59 A I E +FH 39 71B 0 -20,-1.7 -20,-2.1 -2,-0.3 2,-0.4 -0.969 28.5 173.5-132.0 111.0 15.7 3.8 20.1 60 60 A E E -FH 38 70B 18 10,-2.6 10,-3.2 -2,-0.4 2,-0.7 -0.971 25.6-154.9-130.4 121.9 17.5 2.9 16.8 61 61 A V E -F 37 0B 1 -24,-3.1 -24,-1.7 -2,-0.4 2,-0.6 -0.857 18.5-149.0 -91.0 116.1 16.4 0.5 14.2 62 62 A L E > -F 36 0B 11 -2,-0.7 3,-2.4 3,-0.4 -26,-0.2 -0.814 15.5-131.1 -88.7 120.7 19.6 -0.7 12.4 63 63 A G T 3 S+ 0 0 4 -28,-3.1 -30,-0.3 -2,-0.6 -1,-0.1 0.663 99.7 64.9 -45.7 -32.9 18.6 -1.4 8.8 64 64 A K T 3 S+ 0 0 89 85,-0.7 -1,-0.3 -29,-0.3 -31,-0.2 0.749 111.8 36.3 -66.0 -23.8 20.3 -4.8 8.6 65 65 A N X + 0 0 85 -3,-2.4 3,-1.0 -33,-0.1 -3,-0.4 -0.754 62.5 169.1-132.4 83.3 17.9 -6.2 11.2 66 66 A P T 3 S+ 0 0 39 0, 0.0 28,-2.8 0, 0.0 29,-0.3 0.604 71.1 75.1 -69.3 -13.7 14.4 -4.7 10.8 67 67 A G T 3 S+ 0 0 34 26,-0.3 23,-2.4 27,-0.1 2,-0.3 0.235 105.0 23.0 -84.7 14.3 13.0 -7.2 13.3 68 68 A S E < - 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