==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 14-MAY-08 2VTF . COMPND 2 MOLECULE: ENDO-BETA-N-ACETYLGLUCOSAMINIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ARTHROBACTER PROTOPHORMIAE; . AUTHOR Z.LING,R.J.BINGHAM,M.D.L.SUITS,J.W.B.MOIR,A.J.FAIRBANKS, E.J . 1232 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 48041.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 797 64.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 76 6.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 266 21.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 . 11 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 0.5 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 0.1 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 . 110 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 130 10.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 145 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 0.8 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 2 2 1 3 0 4 0 0 2 2 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 4 6 4 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 . 14 8 9 2 7 6 4 2 2 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 . 4 6 0 4 0 2 0 0 0 2 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 T 0 0 172 0, 0.0 2,-0.5 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 94.0 30.4 -32.2 -5.3 2 3 A Y + 0 0 101 1,-0.1 64,-0.0 64,-0.1 0, 0.0 -0.672 360.0 178.9 -86.0 125.1 27.4 -30.0 -4.8 3 4 A N + 0 0 84 -2,-0.5 -1,-0.1 539,-0.0 542,-0.1 0.195 43.8 110.7-111.9 16.6 24.2 -31.7 -3.7 4 5 A G S S- 0 0 4 1,-0.2 21,-0.1 577,-0.1 -2,-0.0 -0.202 80.3 -62.8 -82.3 178.1 21.8 -28.7 -3.4 5 6 A P - 0 0 3 0, 0.0 64,-2.0 0, 0.0 2,-0.3 -0.283 54.2-155.9 -67.0 146.9 18.8 -27.9 -5.6 6 7 A L B -A 68 0A 54 62,-0.3 23,-0.1 63,-0.1 22,-0.1 -0.919 24.4 -96.6-126.6 151.9 19.5 -27.2 -9.3 7 8 A S - 0 0 4 60,-2.9 60,-0.3 -2,-0.3 59,-0.2 -0.365 55.2-105.1 -65.8 146.2 17.8 -25.3 -12.1 8 9 A S + 0 0 12 96,-0.2 2,-0.3 57,-0.1 -1,-0.1 -0.230 39.3 170.5 -80.1 159.2 15.6 -27.7 -14.2 9 10 A H - 0 0 51 93,-0.1 2,-0.3 89,-0.1 93,-0.2 -0.872 12.9-172.6-162.4 140.6 16.1 -29.1 -17.7 10 11 A W B -B 101 0B 17 91,-2.5 91,-2.4 -2,-0.3 90,-1.1 -0.943 26.9-137.6-135.1 152.4 14.2 -31.9 -19.4 11 12 A F >> - 0 0 43 -2,-0.3 4,-2.5 88,-0.3 3,-1.2 -0.728 51.1 -99.2 -90.1 158.6 13.8 -34.1 -22.4 12 13 A P H 3> S+ 0 0 1 0, 0.0 4,-2.5 0, 0.0 5,-0.1 0.838 123.0 53.8 -47.8 -42.9 10.3 -34.4 -23.7 13 14 A E H 3> S+ 0 0 134 1,-0.2 4,-0.6 2,-0.2 5,-0.0 0.829 111.9 46.0 -67.3 -29.2 9.6 -37.7 -21.9 14 15 A E H X4 S+ 0 0 100 -3,-1.2 3,-0.8 2,-0.2 4,-0.4 0.923 111.4 50.4 -75.4 -48.4 10.6 -36.1 -18.6 15 16 A L H >< S+ 0 0 0 -4,-2.5 3,-1.8 1,-0.2 -2,-0.2 0.882 101.2 64.1 -53.0 -42.7 8.6 -33.0 -19.1 16 17 A A H 3< S+ 0 0 39 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.836 111.4 37.0 -54.4 -32.9 5.5 -35.0 -20.0 17 18 A Q T << S+ 0 0 151 -3,-0.8 -1,-0.3 -4,-0.6 -2,-0.2 0.386 88.6 131.3 -98.4 0.6 5.5 -36.4 -16.4 18 19 A W < + 0 0 13 -3,-1.8 3,-0.1 -4,-0.4 -3,-0.1 -0.335 24.4 168.1 -68.5 131.0 6.7 -33.2 -14.6 19 20 A E > - 0 0 86 1,-0.1 3,-1.5 -2,-0.1 4,-0.3 -0.985 35.2-137.9-139.9 130.6 4.8 -32.1 -11.6 20 21 A P G > S+ 0 0 20 0, 0.0 3,-1.7 0, 0.0 6,-0.3 0.902 101.8 59.7 -52.9 -43.2 6.0 -29.4 -9.2 21 22 A D G 3 S+ 0 0 158 1,-0.3 -3,-0.0 5,-0.1 0, 0.0 0.661 107.8 44.1 -64.7 -17.8 4.9 -31.4 -6.1 22 23 A S G < S+ 0 0 96 -3,-1.5 -1,-0.3 1,-0.1 3,-0.1 0.249 95.5 82.3-111.1 13.8 7.1 -34.4 -6.9 23 24 A D X - 0 0 34 -3,-1.7 3,-1.2 -4,-0.3 -1,-0.1 -0.961 63.6-159.2-116.9 110.3 10.3 -32.5 -7.8 24 25 A P T 3 S+ 0 0 56 0, 0.0 4,-0.2 0, 0.0 -1,-0.1 0.729 92.5 51.1 -63.5 -22.0 12.2 -31.6 -4.6 25 26 A D T >> S+ 0 0 27 1,-0.2 3,-1.0 2,-0.1 4,-1.0 0.643 85.9 88.1 -85.3 -17.9 14.0 -28.9 -6.5 26 27 A A G X4 S+ 0 0 0 -3,-1.2 3,-0.9 -6,-0.3 4,-0.4 0.872 83.8 52.0 -58.2 -43.8 10.9 -27.2 -8.0 27 28 A P G >4 S+ 0 0 25 0, 0.0 3,-0.8 0, 0.0 -1,-0.3 0.854 108.0 54.0 -61.6 -28.5 10.2 -24.8 -5.1 28 29 A F G <4 S+ 0 0 4 -3,-1.0 -2,-0.2 1,-0.2 78,-0.1 0.692 104.7 55.6 -75.5 -21.4 13.8 -23.6 -5.2 29 30 A N G << S+ 0 0 1 -4,-1.0 2,-0.3 -3,-0.9 -1,-0.2 0.385 82.0 108.7 -93.7 0.2 13.5 -22.7 -8.9 30 31 A R < - 0 0 93 -3,-0.8 2,-0.4 -4,-0.4 133,-0.2 -0.626 63.8-136.9 -78.5 134.9 10.4 -20.5 -8.6 31 32 A S - 0 0 16 131,-3.1 546,-0.1 -2,-0.3 76,-0.1 -0.779 16.5-173.4 -87.1 136.2 10.9 -16.8 -9.2 32 33 A H + 0 0 77 -2,-0.4 -1,-0.1 544,-0.3 131,-0.1 0.239 61.0 90.8-110.2 6.1 9.1 -14.5 -6.7 33 34 A V S S- 0 0 20 130,-0.1 80,-0.2 3,-0.0 3,-0.1 -0.907 73.2-141.9-102.9 110.2 9.9 -11.2 -8.3 34 35 A P - 0 0 101 0, 0.0 2,-0.2 0, 0.0 82,-0.2 -0.307 30.7 -86.4 -73.5 155.4 7.2 -10.4 -10.8 35 36 A L - 0 0 62 1,-0.1 79,-0.1 81,-0.1 78,-0.1 -0.402 47.0-128.6 -56.4 119.0 7.8 -8.7 -14.2 36 37 A E - 0 0 63 77,-2.0 3,-0.3 -2,-0.2 2,-0.1 -0.599 25.1-152.5 -76.3 122.2 7.9 -5.0 -13.5 37 38 A P + 0 0 95 0, 0.0 80,-0.1 0, 0.0 -1,-0.0 -0.443 62.4 42.8 -86.2 166.9 5.5 -3.1 -15.8 38 39 A G - 0 0 57 1,-0.2 310,-0.1 -2,-0.1 78,-0.0 0.794 62.8-176.4 78.6 32.0 5.8 0.5 -17.0 39 40 A R - 0 0 51 -3,-0.3 2,-0.3 77,-0.2 310,-0.2 -0.293 16.9-139.4 -56.6 146.9 9.5 1.1 -17.8 40 41 A V E -L 348 0C 22 308,-2.4 308,-2.3 394,-0.1 2,-0.3 -0.849 12.3-134.4-111.5 148.8 10.3 4.6 -18.9 41 42 A A E -L 347 0C 47 -2,-0.3 306,-0.2 306,-0.2 394,-0.1 -0.731 7.6-134.3-105.1 150.5 12.8 5.6 -21.7 42 43 A D - 0 0 8 304,-2.8 -1,-0.1 -2,-0.3 306,-0.0 -0.232 1.4-154.4 -84.9-177.6 15.5 8.1 -21.9 43 44 A R + 0 0 145 302,-0.1 -1,-0.1 -2,-0.1 -2,-0.0 0.066 54.5 118.7-145.2 24.7 16.2 10.5 -24.8 44 45 A V + 0 0 43 302,-0.1 2,-0.6 1,-0.1 0, 0.0 0.756 61.8 70.1 -74.1 -24.7 19.9 11.2 -24.5 45 46 A N > - 0 0 13 1,-0.1 3,-0.6 296,-0.1 285,-0.1 -0.839 63.7-159.1-102.7 120.7 20.9 9.8 -27.9 46 47 A A T 3 S+ 0 0 108 -2,-0.6 -1,-0.1 283,-0.5 296,-0.1 0.728 92.9 49.8 -71.8 -20.7 19.8 11.8 -30.9 47 48 A N T 3 S+ 0 0 80 294,-0.1 -1,-0.2 297,-0.1 295,-0.1 0.741 90.8 95.1 -84.8 -24.6 20.2 8.8 -33.2 48 49 A A < - 0 0 19 -3,-0.6 2,-0.3 293,-0.2 296,-0.2 -0.289 54.2-175.9 -69.5 150.8 18.2 6.4 -31.1 49 50 A D - 0 0 95 294,-2.3 -2,-0.0 3,-0.1 -1,-0.0 -0.882 32.2-118.9-145.4 178.1 14.5 5.8 -31.8 50 51 A T S S+ 0 0 103 -2,-0.3 294,-0.1 1,-0.1 -2,-0.0 0.284 88.8 76.3-108.9 8.5 11.5 4.0 -30.5 51 52 A D S S+ 0 0 41 242,-0.0 -1,-0.1 2,-0.0 2,-0.1 0.948 81.7 67.5 -82.5 -54.5 10.4 1.7 -33.3 52 53 A A - 0 0 10 291,-0.2 2,-0.2 241,-0.1 242,-0.1 -0.380 65.1-155.5 -73.5 143.9 12.9 -1.1 -33.2 53 54 A H - 0 0 61 209,-0.2 242,-2.8 -2,-0.1 2,-0.4 -0.677 8.1-136.8-107.1 170.0 13.1 -3.6 -30.3 54 55 A L E -c 295 0B 0 -2,-0.2 33,-2.8 240,-0.2 34,-1.2 -0.988 12.8-170.4-133.2 125.3 16.1 -5.7 -29.1 55 56 A V E -cd 296 88B 0 240,-2.4 242,-2.9 -2,-0.4 2,-0.5 -0.925 10.2-154.3-108.1 141.1 16.2 -9.3 -28.0 56 57 A S E -cd 297 89B 0 32,-2.0 34,-3.4 -2,-0.4 2,-0.8 -0.961 6.3-160.1-113.6 128.7 19.3 -10.9 -26.4 57 58 A L E +cd 298 90B 0 240,-2.9 242,-2.7 -2,-0.5 2,-0.5 -0.906 33.1 173.0-102.8 98.0 20.0 -14.6 -26.7 58 59 A S E - d 0 91B 2 32,-2.0 34,-2.8 -2,-0.8 2,-1.9 -0.925 44.2-138.5-122.5 132.1 22.4 -14.9 -23.8 59 60 A A + 0 0 2 -2,-0.5 32,-0.1 1,-0.2 34,-0.1 -0.633 31.8 171.4 -77.4 80.1 24.0 -17.8 -22.0 60 61 A L S S+ 0 0 2 -2,-1.9 2,-0.4 1,-0.2 18,-0.4 0.792 77.0 38.9 -66.7 -26.9 23.4 -16.3 -18.6 61 62 A N S S- 0 0 8 31,-0.4 -1,-0.2 -3,-0.2 6,-0.0 -0.997 84.6-141.9-116.6 132.8 24.6 -19.6 -17.3 62 63 A R S S+ 0 0 143 -2,-0.4 2,-0.3 31,-0.0 -1,-0.1 0.844 85.4 38.6 -59.8 -36.3 27.5 -21.2 -19.2 63 64 A H - 0 0 74 1,-0.1 4,-0.0 2,-0.1 0, 0.0 -0.840 67.6-142.4-116.1 156.2 26.0 -24.7 -18.8 64 65 A T S S+ 0 0 8 -2,-0.3 3,-0.4 2,-0.1 2,-0.2 0.926 87.1 48.1 -77.0 -49.1 22.5 -26.1 -18.9 65 66 A S S S+ 0 0 45 1,-0.2 -2,-0.1 -59,-0.0 -57,-0.1 -0.483 100.2 34.7 -94.1 162.3 23.0 -28.6 -16.1 66 67 A G S S+ 0 0 46 -59,-0.2 -1,-0.2 1,-0.2 -64,-0.1 0.609 71.6 146.2 76.5 13.4 24.5 -28.2 -12.7 67 68 A V - 0 0 11 -3,-0.4 -60,-2.9 -60,-0.3 -1,-0.2 -0.733 50.3-126.1 -85.6 114.9 23.3 -24.7 -12.1 68 69 A P B > -A 6 0A 30 0, 0.0 3,-0.7 0, 0.0 -62,-0.3 -0.351 20.9-122.4 -62.0 147.5 22.4 -24.1 -8.4 69 70 A S T 3 S+ 0 0 1 -64,-2.0 38,-0.7 1,-0.2 37,-0.4 0.822 98.7 17.8 -62.0 -35.9 18.9 -22.8 -8.0 70 71 A Q T 3 S- 0 0 34 1,-0.5 -1,-0.2 -65,-0.3 504,-0.2 0.003 120.8 -66.6-133.9 27.2 19.6 -19.6 -6.2 71 72 A G < - 0 0 16 -3,-0.7 -1,-0.5 310,-0.1 310,-0.2 -0.488 45.7-126.0 109.3 178.8 23.3 -18.7 -6.6 72 73 A A B -M 380 0D 28 308,-1.2 2,-2.1 2,-0.2 308,-2.0 -0.972 34.0 -88.3-163.4 162.2 26.6 -20.1 -5.6 73 74 A P S S+ 0 0 97 0, 0.0 2,-0.4 0, 0.0 305,-0.3 -0.300 86.0 110.4 -84.0 60.0 29.9 -19.1 -3.8 74 75 A V - 0 0 63 -2,-2.1 -2,-0.2 1,-0.1 290,-0.1 -0.989 49.2-165.4-138.7 121.0 31.6 -17.9 -7.0 75 76 A F S S+ 0 0 27 -2,-0.4 2,-1.6 1,-0.2 -1,-0.1 0.927 79.3 69.5 -70.2 -48.5 32.4 -14.2 -7.8 76 77 A Y S S+ 0 0 53 232,-0.1 2,-0.3 2,-0.1 -1,-0.2 -0.564 70.4 130.0 -81.3 90.3 33.1 -14.6 -11.5 77 78 A E S S- 0 0 36 -2,-1.6 2,-1.9 -16,-0.0 -16,-0.1 -0.903 72.3 -84.2-137.8 161.3 29.6 -15.3 -12.8 78 79 A N + 0 0 3 -18,-0.4 2,-1.2 -2,-0.3 -2,-0.1 -0.483 49.0 170.7 -79.0 84.2 27.6 -13.7 -15.7 79 80 A T - 0 0 0 -2,-1.9 -1,-0.1 2,-0.0 284,-0.1 -0.404 18.7-163.5 -92.0 57.0 26.1 -10.7 -14.0 80 81 A F - 0 0 5 -2,-1.2 3,-0.1 1,-0.1 234,-0.0 -0.103 12.1-178.6 -39.5 131.7 24.8 -9.1 -17.2 81 82 A S + 0 0 2 1,-0.1 3,-0.4 233,-0.0 -1,-0.1 0.267 55.7 87.8-125.6 9.4 24.0 -5.4 -16.4 82 83 A Y > + 0 0 4 1,-0.2 3,-2.0 2,-0.1 4,-0.3 -0.071 40.0 128.0-107.4 35.4 22.5 -3.9 -19.7 83 84 A W G > + 0 0 9 1,-0.3 3,-1.8 2,-0.2 -1,-0.2 0.820 63.4 74.2 -50.1 -33.9 18.9 -4.9 -19.1 84 85 A H G 3 S+ 0 0 10 -3,-0.4 263,-2.4 1,-0.3 -1,-0.3 0.702 98.7 42.5 -61.4 -19.7 18.2 -1.2 -19.9 85 86 A Y G < S+ 0 0 2 -3,-2.0 2,-0.4 261,-0.2 -1,-0.3 0.318 101.2 87.4-106.6 4.4 18.8 -1.7 -23.7 86 87 A T < - 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