==== 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 17-JUL-06 2HPL . COMPND 2 MOLECULE: PNGASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR G.ZHAO,X.ZHOU,L.WANG,G.LI,W.LENNARZ,H.SCHINDELIN . 105 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 5959.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 70 66.7 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 . 7 6.7 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 1.0 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 . 2 1.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 11 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 46 43.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 2.9 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 2 0 1 0 0 0 0 0 0 1 0 0 0 0 1 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 . 0 1 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 12 A S 0 0 117 0, 0.0 2,-0.5 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 84.6 29.0 46.1 3.6 2 13 A A - 0 0 93 4,-0.0 0, 0.0 5,-0.0 0, 0.0 -0.775 360.0-172.2-122.1 88.8 29.7 49.4 1.7 3 14 A S > - 0 0 9 -2,-0.5 4,-2.1 1,-0.2 5,-0.2 -0.644 20.6-159.2 -81.7 118.9 31.7 51.6 4.1 4 15 A P H > S+ 0 0 98 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.919 95.8 51.8 -58.5 -40.2 32.3 55.3 3.0 5 16 A A H > S+ 0 0 4 2,-0.2 4,-2.7 1,-0.2 58,-0.2 0.900 109.4 47.4 -65.1 -43.9 35.3 55.4 5.4 6 17 A V H > S+ 0 0 10 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.937 111.0 51.9 -66.2 -43.7 36.9 52.3 4.1 7 18 A A H < S+ 0 0 59 -4,-2.1 4,-0.4 1,-0.2 -2,-0.2 0.907 112.5 46.3 -56.1 -43.3 36.5 53.5 0.5 8 19 A E H >< S+ 0 0 77 -4,-2.3 3,-1.5 1,-0.2 4,-0.3 0.926 108.5 55.3 -64.6 -45.6 38.1 56.8 1.4 9 20 A L H >< S+ 0 0 0 -4,-2.7 3,-1.4 50,-0.3 -2,-0.2 0.857 103.0 57.3 -51.8 -40.4 40.9 55.0 3.3 10 21 A C T 3< S+ 0 0 46 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.577 91.0 71.7 -71.0 -12.4 41.7 53.0 0.0 11 22 A Q T < S+ 0 0 131 -3,-1.5 -1,-0.2 -4,-0.4 -2,-0.2 0.609 80.4 97.9 -78.9 -11.7 42.2 56.3 -1.9 12 23 A N S < S- 0 0 30 -3,-1.4 45,-0.0 -4,-0.3 -3,-0.0 -0.221 91.2 -83.1 -68.4 161.6 45.5 56.8 -0.0 13 24 A T > - 0 0 80 1,-0.1 4,-3.2 4,-0.1 5,-0.3 -0.264 45.2-106.0 -60.5 155.3 48.9 55.9 -1.5 14 25 A P H > S+ 0 0 107 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.926 119.8 49.1 -49.5 -47.1 49.8 52.2 -1.1 15 26 A E H > S+ 0 0 161 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.926 115.9 40.0 -58.4 -52.9 52.4 53.1 1.6 16 27 A T H > S+ 0 0 42 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.878 112.7 56.4 -67.6 -41.4 50.1 55.3 3.7 17 28 A F H X S+ 0 0 18 -4,-3.2 4,-2.9 2,-0.2 5,-0.3 0.947 109.7 46.3 -51.4 -51.9 47.2 52.9 3.2 18 29 A L H X S+ 0 0 85 -4,-2.5 4,-2.1 -5,-0.3 -2,-0.2 0.936 113.4 48.5 -58.7 -43.7 49.2 50.1 4.6 19 30 A E H X S+ 0 0 91 -4,-2.1 4,-1.5 1,-0.2 -2,-0.2 0.942 118.1 38.5 -63.6 -54.1 50.5 52.1 7.6 20 31 A A H X S+ 0 0 0 -4,-2.7 4,-2.4 2,-0.2 -1,-0.2 0.902 115.1 51.1 -65.3 -47.2 47.1 53.4 8.6 21 32 A S H X S+ 0 0 0 -4,-2.9 4,-2.2 -5,-0.3 -1,-0.2 0.864 106.5 57.3 -60.1 -34.9 45.0 50.2 7.9 22 33 A K H X S+ 0 0 129 -4,-2.1 4,-1.9 -5,-0.3 -1,-0.2 0.946 108.7 45.0 -60.9 -48.5 47.6 48.2 10.0 23 34 A L H X S+ 0 0 14 -4,-1.5 4,-2.5 1,-0.2 -2,-0.2 0.911 111.3 53.4 -60.3 -44.4 46.9 50.5 13.0 24 35 A L H X S+ 0 0 0 -4,-2.4 4,-1.9 1,-0.2 -1,-0.2 0.875 108.2 49.9 -60.7 -41.5 43.1 50.3 12.5 25 36 A L H X S+ 0 0 18 -4,-2.2 4,-3.1 2,-0.2 -1,-0.2 0.901 110.2 50.9 -63.1 -39.8 43.2 46.5 12.4 26 37 A T H X S+ 0 0 41 -4,-1.9 4,-2.4 1,-0.2 5,-0.2 0.897 109.2 50.1 -65.5 -42.9 45.2 46.5 15.7 27 38 A Y H X S+ 0 0 1 -4,-2.5 4,-1.0 1,-0.2 -1,-0.2 0.897 116.6 42.2 -63.7 -40.4 42.7 48.8 17.4 28 39 A A H X S+ 0 0 0 -4,-1.9 4,-2.6 -5,-0.2 3,-0.4 0.960 114.6 48.8 -67.5 -51.2 39.9 46.6 16.3 29 40 A D H X S+ 0 0 22 -4,-3.1 4,-2.6 1,-0.2 5,-0.3 0.847 104.6 58.8 -63.3 -38.9 41.5 43.3 17.0 30 41 A N H X S+ 0 0 42 -4,-2.4 4,-0.7 -5,-0.2 -1,-0.2 0.906 113.5 39.4 -59.0 -39.2 42.6 44.3 20.5 31 42 A I H < S+ 0 0 4 -4,-1.0 3,-0.4 -3,-0.4 -2,-0.2 0.927 115.5 51.3 -69.9 -48.4 39.0 44.9 21.5 32 43 A L H < S+ 0 0 37 -4,-2.6 -2,-0.2 1,-0.2 -3,-0.2 0.876 118.0 38.1 -57.6 -37.5 37.6 41.9 19.6 33 44 A R H < S+ 0 0 175 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.559 127.2 34.2 -98.2 -8.6 40.0 39.5 21.2 34 45 A N >< + 0 0 63 -4,-0.7 3,-2.3 -3,-0.4 -1,-0.2 -0.426 66.0 162.1-139.1 60.3 40.0 41.1 24.7 35 46 A P T 3 S+ 0 0 73 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.751 76.0 51.4 -61.8 -24.3 36.4 42.4 25.1 36 47 A S T 3 S+ 0 0 114 -3,-0.1 2,-1.0 1,-0.1 3,-0.1 0.358 85.9 96.2 -88.1 -1.4 36.8 42.6 29.0 37 48 A D X - 0 0 46 -3,-2.3 3,-1.5 -6,-0.2 4,-0.2 -0.800 54.5-169.6 -96.5 100.5 40.0 44.7 28.9 38 49 A E G > S+ 0 0 141 -2,-1.0 3,-1.6 1,-0.3 -1,-0.2 0.698 75.6 77.1 -59.9 -20.9 39.0 48.3 29.2 39 50 A K G > S+ 0 0 119 1,-0.3 3,-0.8 2,-0.1 -1,-0.3 0.817 91.2 54.3 -67.1 -23.2 42.5 49.5 28.3 40 51 A Y G < S+ 0 0 41 -3,-1.5 -1,-0.3 1,-0.2 -9,-0.2 0.533 94.5 72.0 -84.6 -4.5 41.8 48.8 24.6 41 52 A R G < S+ 0 0 54 -3,-1.6 37,-2.8 -4,-0.2 2,-0.4 0.302 92.5 57.2 -91.8 4.7 38.7 50.9 24.6 42 53 A S E < -A 77 0A 35 -3,-0.8 2,-0.5 35,-0.2 35,-0.2 -0.996 58.0-171.9-140.4 135.9 40.4 54.3 24.8 43 54 A I E -A 76 0A 0 33,-2.5 33,-2.5 -2,-0.4 2,-0.3 -0.991 27.8-124.7-127.6 122.9 42.9 55.8 22.5 44 55 A R E > -A 75 0A 90 61,-2.3 3,-1.7 -2,-0.5 31,-0.3 -0.487 10.3-143.5 -74.9 128.3 44.6 59.1 23.5 45 56 A I T 3 S+ 0 0 39 29,-2.9 -1,-0.2 -2,-0.3 30,-0.1 0.844 102.0 48.4 -61.6 -31.4 44.2 61.7 20.8 46 57 A G T 3 S+ 0 0 39 28,-0.5 -1,-0.3 4,-0.1 29,-0.1 0.398 78.0 128.7 -87.8 -1.4 47.7 63.1 21.5 47 58 A N <> - 0 0 7 -3,-1.7 4,-2.8 58,-0.2 5,-0.3 -0.313 66.1-125.9 -52.7 135.3 49.4 59.6 21.5 48 59 A T H > S+ 0 0 95 1,-0.2 4,-2.0 2,-0.2 5,-0.3 0.943 105.0 42.5 -57.5 -52.7 52.4 59.9 19.1 49 60 A A H >>S+ 0 0 0 54,-0.5 4,-2.7 1,-0.2 5,-0.6 0.932 118.9 45.0 -57.4 -50.0 51.5 57.0 16.8 50 61 A F H >>S+ 0 0 0 1,-0.2 5,-2.9 3,-0.2 4,-1.1 0.906 115.9 44.0 -61.5 -47.1 47.8 57.8 16.7 51 62 A S H <5S+ 0 0 42 -4,-2.8 -1,-0.2 3,-0.2 -2,-0.2 0.757 125.3 32.3 -73.8 -29.1 48.2 61.6 16.1 52 63 A T H <5S+ 0 0 84 -4,-2.0 -2,-0.2 -5,-0.3 -3,-0.2 0.761 129.3 29.0 -99.6 -33.5 51.0 61.3 13.5 53 64 A R H <5S+ 0 0 63 -4,-2.7 -3,-0.2 -5,-0.3 -2,-0.1 0.543 130.8 23.5-107.4 -14.4 50.3 58.0 11.6 54 65 A L T >< S- 0 0 18 -3,-2.4 3,-2.3 1,-0.1 4,-0.6 -0.704 82.8-111.4 -94.0 125.6 45.2 60.0 7.0 58 69 A R T 34 S+ 0 0 114 -2,-0.5 -46,-0.2 1,-0.3 -47,-0.1 -0.229 99.3 5.7 -58.6 127.8 42.2 60.6 4.9 59 70 A G T 3> S+ 0 0 3 -4,-0.1 4,-1.4 -48,-0.1 -50,-0.3 0.108 101.9 102.5 92.6 -19.5 39.4 58.1 5.9 60 71 A A H <> S+ 0 0 0 -3,-2.3 4,-1.4 -6,-0.2 3,-0.4 0.938 79.9 43.3 -74.9 -44.2 41.2 56.7 8.9 61 72 A V H X S+ 0 0 20 -4,-0.6 4,-2.1 -7,-0.3 3,-0.4 0.930 111.7 57.2 -67.6 -35.7 39.5 58.4 11.8 62 73 A E H > S+ 0 0 93 1,-0.3 4,-2.8 2,-0.2 -1,-0.2 0.807 99.2 59.2 -62.7 -30.1 36.2 57.9 10.1 63 74 A C H X S+ 0 0 0 -4,-1.4 4,-2.2 -3,-0.4 -1,-0.3 0.914 105.7 49.4 -61.2 -42.7 36.9 54.1 10.1 64 75 A L H X>S+ 0 0 0 -4,-1.4 5,-2.6 -3,-0.4 4,-1.2 0.917 110.8 49.7 -60.8 -43.6 37.2 54.3 13.9 65 76 A F H ><5S+ 0 0 77 -4,-2.1 3,-0.6 3,-0.2 -2,-0.2 0.947 110.5 48.9 -62.2 -44.7 33.9 56.2 14.1 66 77 A E H 3<5S+ 0 0 47 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.883 106.2 57.9 -63.6 -33.1 32.2 53.6 11.8 67 78 A M H 3<5S- 0 0 0 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.793 130.5 -96.7 -61.7 -29.4 33.7 50.9 14.1 68 79 A G T <<5S+ 0 0 22 -4,-1.2 -3,-0.2 -3,-0.6 -2,-0.1 0.429 74.8 143.7 124.7 2.7 31.8 52.5 17.0 69 80 A F < - 0 0 6 -5,-2.6 2,-0.4 9,-0.2 -1,-0.3 -0.481 34.6-151.5 -69.0 146.0 34.4 54.8 18.7 70 81 A E E -B 77 0A 86 7,-3.2 7,-2.7 -2,-0.1 2,-0.7 -0.905 16.6-118.5-115.8 145.2 33.2 58.2 20.0 71 82 A E E +B 76 0A 123 -2,-0.4 5,-0.2 5,-0.2 2,-0.1 -0.747 33.3 177.0 -89.4 118.6 35.3 61.2 20.3 72 83 A G - 0 0 34 3,-3.1 -27,-0.0 -2,-0.7 0, 0.0 -0.330 48.7 -86.9 -97.3-169.2 35.8 62.7 23.8 73 84 A E S S+ 0 0 187 1,-0.2 3,-0.1 -2,-0.1 -2,-0.0 0.884 121.0 8.0 -69.7 -41.9 38.0 65.7 24.6 74 85 A T S S+ 0 0 90 1,-0.2 -29,-2.9 -29,-0.1 -28,-0.5 0.522 129.8 36.8-116.1 -16.4 41.3 63.8 25.1 75 86 A H E -A 44 0A 53 -31,-0.3 -3,-3.1 -30,-0.1 2,-0.5 -0.980 65.1-127.2-137.9 151.0 40.4 60.3 23.9 76 87 A L E -AB 43 71A 1 -33,-2.5 -33,-2.5 -2,-0.3 2,-0.4 -0.864 38.8-161.0 -86.7 134.6 38.5 58.3 21.4 77 88 A I E -AB 42 70A 67 -7,-2.7 -7,-3.2 -2,-0.5 -35,-0.2 -0.958 23.4-142.3-123.7 133.2 36.4 55.8 23.4 78 89 A F - 0 0 3 -37,-2.8 -9,-0.2 -2,-0.4 -37,-0.0 -0.845 40.7-143.5 -86.7 100.9 34.8 52.6 22.3 79 90 A P > - 0 0 19 0, 0.0 3,-1.7 0, 0.0 -37,-0.0 -0.181 18.1-110.7 -75.9 164.1 31.6 52.9 24.5 80 91 A K T 3 S+ 0 0 204 1,-0.3 -2,-0.0 3,-0.0 0, 0.0 0.841 116.8 58.0 -54.7 -37.5 29.6 50.2 26.4 81 92 A K T 3 S+ 0 0 160 2,-0.1 -1,-0.3 -13,-0.1 2,-0.2 0.652 82.9 105.1 -68.5 -17.7 26.7 50.7 24.0 82 93 A A < - 0 0 22 -3,-1.7 2,-0.2 -14,-0.1 -14,-0.1 -0.436 69.0-127.0 -75.8 136.6 28.8 49.9 20.9 83 94 A S > - 0 0 52 -2,-0.2 4,-1.5 1,-0.1 3,-0.2 -0.580 4.6-141.7 -84.3 144.7 28.3 46.5 19.2 84 95 A V H > S+ 0 0 84 -2,-0.2 4,-3.8 1,-0.2 5,-0.3 0.846 102.2 66.4 -64.8 -32.0 31.1 44.1 18.4 85 96 A E H > S+ 0 0 144 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.893 102.3 41.9 -57.4 -46.8 29.2 43.4 15.2 86 97 A Q H > S+ 0 0 66 2,-0.2 4,-1.6 -3,-0.2 -1,-0.2 0.874 115.9 51.8 -69.0 -37.1 29.7 46.8 13.8 87 98 A L H X S+ 0 0 0 -4,-1.5 4,-2.2 1,-0.2 -2,-0.2 0.957 111.6 46.2 -59.9 -52.5 33.3 46.7 15.0 88 99 A Q H X S+ 0 0 76 -4,-3.8 4,-2.9 1,-0.2 5,-0.2 0.889 106.3 60.3 -55.3 -44.7 33.9 43.3 13.3 89 100 A K H X S+ 0 0 60 -4,-2.3 4,-1.9 -5,-0.3 -1,-0.2 0.935 109.8 40.7 -52.3 -47.5 32.2 44.6 10.1 90 101 A I H X S+ 0 0 0 -4,-1.6 4,-2.6 2,-0.2 5,-0.2 0.901 112.2 54.8 -73.3 -39.6 34.8 47.4 9.6 91 102 A R H X S+ 0 0 49 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.954 109.8 48.2 -53.6 -49.7 37.7 45.2 10.7 92 103 A D H X S+ 0 0 74 -4,-2.9 4,-1.9 1,-0.2 -2,-0.2 0.892 110.6 51.0 -62.2 -39.5 36.7 42.6 8.0 93 104 A L H X S+ 0 0 27 -4,-1.9 4,-1.3 -5,-0.2 -1,-0.2 0.917 112.1 45.5 -66.0 -42.0 36.3 45.3 5.3 94 105 A I H X S+ 0 0 0 -4,-2.6 4,-1.6 2,-0.2 -1,-0.2 0.896 109.6 55.3 -68.2 -42.2 39.8 46.8 6.0 95 106 A A H X S+ 0 0 22 -4,-2.4 4,-1.5 -5,-0.2 -2,-0.2 0.897 104.4 54.0 -59.7 -41.7 41.4 43.3 6.1 96 107 A I H < S+ 0 0 92 -4,-1.9 -1,-0.2 1,-0.2 4,-0.2 0.898 108.8 49.2 -54.6 -43.4 40.1 42.4 2.6 97 108 A E H < S+ 0 0 73 -4,-1.3 3,-0.5 1,-0.2 -1,-0.2 0.797 109.0 52.4 -73.9 -25.8 41.7 45.6 1.3 98 109 A R H < S+ 0 0 80 -4,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.743 110.7 46.7 -76.4 -24.6 45.0 44.8 2.9 99 110 A S < 0 0 100 -4,-1.5 -1,-0.2 -3,-0.2 -2,-0.2 0.431 360.0 360.0 -89.1 -1.0 45.0 41.4 1.4 100 111 A S 0 0 126 -3,-0.5 -2,-0.2 -4,-0.2 -3,-0.1 0.541 360.0 360.0-117.8 360.0 44.1 43.1 -1.9 101 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 102 802 B D 0 0 143 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 101.6 55.4 51.5 20.3 103 803 B D - 0 0 99 1,-0.1 -54,-0.5 2,-0.0 -55,-0.1 -0.631 360.0-176.9 -81.8 131.1 52.5 52.2 22.6 104 804 B L S S+ 0 0 23 -2,-0.4 -1,-0.1 -55,-0.1 -57,-0.1 0.431 73.3 42.8-100.1 -3.9 49.2 52.9 20.7 105 805 B Y 0 0 24 -62,-0.1 -61,-2.3 -56,-0.0 -58,-0.2 0.852 360.0 360.0-114.1 -51.8 47.0 53.7 23.7 106 806 B G 0 0 63 -63,-0.1 -62,-0.1 -60,-0.1 -67,-0.0 -0.065 360.0 360.0 -86.3 360.0 48.4 55.9 26.4