==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/STRUCTURAL PROTEIN 07-MAY-07 2Z0E . COMPND 2 MOLECULE: CYSTEINE PROTEASE ATG4B; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR K.SATOO,N.N.NODA,F.INAGAKI . 433 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18845.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 285 65.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 19 4.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 59 13.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.9 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 . 37 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 54 12.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 102 23.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 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 1 0 0 0 3 2 1 1 2 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 2 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 PARALLEL BRIDGES PER LADDER . 4 0 3 2 3 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 ANTIPARALLEL BRIDGES PER LADDER . 1 1 1 0 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 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 4 A A > 0 0 111 0, 0.0 3,-1.4 0, 0.0 4,-0.0 0.000 360.0 360.0 360.0 -68.4 -5.5 2.9 -13.3 2 5 A T G > + 0 0 101 1,-0.3 3,-2.0 2,-0.2 5,-0.1 0.736 360.0 77.8 -68.1 -21.5 -3.9 1.2 -10.3 3 6 A L G 3 S+ 0 0 97 1,-0.3 -1,-0.3 3,-0.1 0, 0.0 0.691 86.4 58.2 -61.8 -20.9 -0.6 2.5 -11.7 4 7 A T G < S+ 0 0 120 -3,-1.4 2,-0.3 2,-0.0 -1,-0.3 0.358 99.3 75.8 -92.3 6.4 -1.4 6.0 -10.4 5 8 A Y S < S- 0 0 178 -3,-2.0 2,-0.7 -4,-0.0 -3,-0.0 -0.809 75.0-131.1-117.8 158.6 -1.7 4.7 -6.8 6 9 A D - 0 0 130 -2,-0.3 -3,-0.1 1,-0.1 -2,-0.0 -0.943 17.1-160.1-105.9 109.9 0.8 3.7 -4.1 7 10 A T - 0 0 104 -2,-0.7 4,-0.2 -5,-0.1 3,-0.1 0.459 26.3-131.8 -71.9 -0.7 -0.6 0.3 -2.8 8 11 A L > - 0 0 117 1,-0.2 3,-1.9 2,-0.1 4,-0.2 0.890 29.8-153.1 49.5 45.7 1.4 0.6 0.4 9 12 A R T 3 S+ 0 0 147 1,-0.3 -1,-0.2 2,-0.1 -2,-0.0 -0.210 70.9 7.5 -53.1 130.2 2.6 -2.9 0.0 10 13 A F T > S+ 0 0 75 -3,-0.1 3,-1.6 1,-0.1 4,-0.4 0.612 79.1 143.7 72.0 15.0 3.5 -4.6 3.3 11 14 A A G X + 0 0 55 -3,-1.9 3,-1.7 1,-0.3 -2,-0.1 0.889 69.1 60.0 -49.5 -41.6 2.1 -1.8 5.4 12 15 A E G > S+ 0 0 93 1,-0.3 3,-0.7 -4,-0.2 -1,-0.3 0.789 97.6 58.6 -58.8 -30.7 0.9 -4.4 7.9 13 16 A F G X S+ 0 0 13 -3,-1.6 3,-1.3 1,-0.2 -1,-0.3 0.452 70.6 96.4 -83.2 1.1 4.4 -5.6 8.5 14 17 A E G < S+ 0 0 100 -3,-1.7 -1,-0.2 -4,-0.4 -2,-0.1 0.581 86.3 58.2 -63.9 -4.3 5.7 -2.3 9.7 15 18 A D G < S+ 0 0 61 -3,-0.7 -1,-0.3 -4,-0.1 -2,-0.1 -0.300 95.5 77.2-118.5 43.9 4.9 -4.0 13.0 16 19 A F S < S- 0 0 26 -3,-1.3 2,-0.4 16,-0.0 -3,-0.0 -0.985 80.0-112.6-152.1 142.8 7.2 -7.0 12.6 17 20 A P - 0 0 46 0, 0.0 2,-1.4 0, 0.0 15,-0.1 -0.656 21.5-134.9 -83.6 128.7 10.9 -7.6 12.9 18 21 A E + 0 0 79 -2,-0.4 2,-0.3 2,-0.0 -2,-0.0 -0.649 49.4 146.6 -82.6 90.7 12.9 -8.4 9.8 19 22 A T - 0 0 35 -2,-1.4 13,-0.3 2,-0.2 14,-0.2 -0.845 61.0-121.4-124.3 161.5 15.1 -11.3 11.0 20 23 A S S S+ 0 0 100 -2,-0.3 -1,-0.0 12,-0.1 -2,-0.0 0.600 79.0 115.6 -75.8 -11.2 16.5 -14.4 9.3 21 24 A E S S- 0 0 95 1,-0.1 11,-0.4 10,-0.1 -2,-0.2 -0.386 73.9-117.9 -60.0 126.5 14.6 -16.4 12.0 22 25 A P - 0 0 35 0, 0.0 2,-0.6 0, 0.0 216,-0.6 -0.326 19.4-129.3 -67.1 152.2 12.0 -18.5 10.3 23 26 A V E -AB 30 237A 0 7,-2.2 7,-2.2 214,-0.2 2,-0.5 -0.918 21.4-159.3-104.4 117.6 8.4 -17.9 11.2 24 27 A W E +AB 29 236A 37 212,-2.8 212,-1.6 -2,-0.6 2,-0.4 -0.846 11.9 178.8-100.2 133.1 6.5 -21.0 12.1 25 28 A I E > -AB 28 235A 0 3,-2.9 3,-1.7 -2,-0.5 210,-0.2 -0.933 67.7 -40.1-136.4 110.6 2.7 -21.1 11.9 26 29 A L T 3 S- 0 0 1 208,-2.7 189,-0.2 -2,-0.4 209,-0.1 0.867 126.7 -34.8 38.3 58.0 0.7 -24.2 12.8 27 30 A G T 3 S+ 0 0 13 187,-2.9 2,-0.4 1,-0.2 -1,-0.3 0.536 117.3 107.1 81.9 5.4 3.2 -26.6 11.1 28 31 A R E < -A 25 0A 72 -3,-1.7 -3,-2.9 186,-0.2 2,-0.4 -0.959 55.7-148.5-119.5 137.3 4.2 -24.3 8.2 29 32 A K E -A 24 0A 128 -2,-0.4 2,-0.3 -5,-0.2 -5,-0.2 -0.871 18.8-178.7-106.2 135.5 7.5 -22.5 7.9 30 33 A Y E -A 23 0A 16 -7,-2.2 -7,-2.2 -2,-0.4 2,-0.5 -0.893 26.0-126.6-130.8 162.3 7.9 -19.1 6.2 31 34 A S > - 0 0 39 -2,-0.3 4,-2.0 -9,-0.2 8,-0.2 -0.947 9.7-150.9-109.7 121.8 10.6 -16.6 5.4 32 35 A I T 4 S+ 0 0 4 -2,-0.5 4,-0.3 -11,-0.4 -1,-0.1 0.854 96.2 55.5 -57.3 -35.2 10.1 -13.1 6.6 33 36 A F T 4 S+ 0 0 119 -14,-0.2 3,-0.2 1,-0.2 -1,-0.2 0.939 124.6 14.2 -65.3 -52.4 12.2 -11.9 3.7 34 37 A T T 4 S+ 0 0 112 1,-0.1 -2,-0.2 2,-0.1 -1,-0.2 0.319 124.9 53.1-111.2 8.9 10.4 -13.5 0.7 35 38 A E X + 0 0 58 -4,-2.0 4,-2.5 2,-0.1 5,-0.2 -0.033 54.0 124.5-137.2 39.1 7.0 -14.6 2.2 36 39 A K H > S+ 0 0 45 -4,-0.3 4,-2.5 -3,-0.2 5,-0.2 0.901 82.7 51.2 -63.8 -39.2 5.3 -11.7 3.9 37 40 A D H > S+ 0 0 74 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.918 111.5 47.1 -62.8 -43.9 2.2 -12.2 1.8 38 41 A E H > S+ 0 0 84 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.905 111.9 50.2 -64.4 -43.2 2.1 -15.9 2.6 39 42 A I H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 5,-0.2 0.948 112.8 45.6 -60.7 -50.1 2.6 -15.2 6.3 40 43 A L H X S+ 0 0 25 -4,-2.5 4,-3.0 1,-0.2 5,-0.2 0.885 111.5 53.1 -61.5 -41.2 -0.2 -12.7 6.4 41 44 A S H X S+ 0 0 42 -4,-2.2 4,-1.8 -5,-0.2 54,-0.4 0.920 110.3 46.6 -61.3 -45.8 -2.6 -14.9 4.4 42 45 A D H X S+ 0 0 0 -4,-2.2 4,-1.1 2,-0.2 -2,-0.2 0.928 116.8 43.8 -63.8 -46.6 -2.2 -17.8 6.7 43 46 A V H >< S+ 0 0 1 -4,-2.3 3,-0.6 1,-0.2 221,-0.4 0.947 115.2 47.6 -64.8 -48.4 -2.6 -15.8 9.9 44 47 A A H 3< S+ 0 0 14 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.777 105.7 60.9 -64.8 -27.0 -5.6 -13.8 8.5 45 48 A S H 3< S+ 0 0 0 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.823 82.2 98.3 -70.0 -33.1 -7.3 -17.0 7.3 46 49 A R S << S- 0 0 1 -4,-1.1 2,-0.5 -3,-0.6 218,-0.5 -0.224 88.7-105.3 -56.0 144.7 -7.5 -18.5 10.8 47 50 A L - 0 0 3 31,-0.2 2,-0.5 216,-0.1 216,-0.2 -0.638 38.1-157.7 -76.8 123.3 -10.9 -18.0 12.4 48 51 A W - 0 0 30 214,-3.1 2,-0.5 -2,-0.5 27,-0.1 -0.910 9.0-170.3-107.9 127.0 -10.6 -15.3 15.0 49 52 A F + 0 0 1 -2,-0.5 2,-0.2 25,-0.2 29,-0.2 -0.970 11.1 171.9-123.5 117.8 -13.1 -15.1 17.9 50 53 A T - 0 0 0 -2,-0.5 197,-0.2 1,-0.2 199,-0.1 -0.539 46.4 -65.1-111.5 178.7 -13.1 -12.0 20.2 51 54 A Y E -i 249 0B 3 195,-2.1 199,-2.2 197,-0.6 2,-0.3 -0.310 57.1-156.0 -59.6 151.2 -15.3 -10.8 23.0 52 55 A R E -i 250 0B 2 197,-0.2 14,-1.5 -3,-0.1 15,-0.5 -0.930 7.2-154.3-132.8 155.7 -18.8 -10.0 21.6 53 56 A K E +iJ 251 65B 92 197,-1.7 199,-2.6 -2,-0.3 12,-0.2 -0.956 66.1 24.9-132.6 153.6 -21.6 -7.7 22.8 54 57 A N S S+ 0 0 123 10,-0.7 11,-0.2 -2,-0.3 -1,-0.1 0.824 76.9 140.0 68.6 35.3 -25.3 -7.5 22.3 55 58 A F - 0 0 5 9,-2.3 -1,-0.2 1,-0.2 3,-0.1 -0.652 67.0 -65.3 -99.8 164.7 -25.9 -11.2 21.7 56 59 A P - 0 0 74 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 -0.163 66.4 -92.1 -49.3 138.5 -28.9 -13.1 23.2 57 60 A A > - 0 0 26 3,-0.2 3,-2.0 1,-0.1 2,-0.5 -0.305 44.5-112.5 -55.1 129.0 -28.8 -13.3 27.0 58 61 A I T 3> S+ 0 0 3 5,-2.3 4,-1.2 1,-0.3 3,-0.3 -0.513 100.6 2.3 -69.4 117.4 -27.1 -16.5 28.0 59 62 A G T 34 S- 0 0 44 -2,-0.5 2,-0.9 1,-0.2 -1,-0.3 0.701 123.8 -78.1 79.5 18.4 -29.7 -18.8 29.6 60 63 A G T <4 S+ 0 0 46 -3,-2.0 -3,-0.2 1,-0.2 -1,-0.2 -0.182 133.6 38.1 85.3 -45.0 -32.4 -16.2 28.9 61 64 A T T 4 S+ 0 0 142 -2,-0.9 -2,-0.2 -3,-0.3 -1,-0.2 0.339 97.4 96.5-120.1 4.9 -31.4 -14.0 31.8 62 65 A G S < S- 0 0 25 -4,-1.2 -3,-0.1 1,-0.2 75,-0.0 0.051 84.1 -40.8 -82.4-165.3 -27.6 -14.2 31.7 63 66 A P - 0 0 44 0, 0.0 -5,-2.3 0, 0.0 -1,-0.2 -0.178 33.5-158.8 -58.8 148.3 -24.9 -11.9 30.2 64 67 A T S S+ 0 0 70 -7,-0.2 -9,-2.3 1,-0.1 -10,-0.7 0.229 83.0 36.6-108.8 7.9 -25.4 -10.4 26.7 65 68 A S B -J 53 0B 30 -12,-0.2 -12,-0.2 -11,-0.2 -1,-0.1 -0.982 62.1-151.9-155.2 148.8 -21.7 -9.9 26.4 66 69 A D >> + 0 0 0 -14,-1.5 4,-2.8 -2,-0.3 3,-2.0 0.254 45.2 142.7-110.1 14.6 -18.6 -11.9 27.4 67 70 A T T 34 S+ 0 0 58 -15,-0.5 -2,-0.1 1,-0.3 180,-0.1 -0.286 73.5 11.6 -55.0 129.9 -16.2 -9.0 27.7 68 71 A G T 34 S+ 0 0 12 1,-0.1 -1,-0.3 71,-0.0 367,-0.2 0.269 133.7 42.5 87.7 -13.9 -13.9 -9.6 30.7 69 72 A W T <4 S+ 0 0 29 -3,-2.0 71,-0.4 365,-0.2 3,-0.3 0.522 95.4 68.1-137.3 -17.9 -14.7 -13.2 31.3 70 73 A G X + 0 0 0 -4,-2.8 4,-2.8 1,-0.2 3,-0.4 0.435 64.0 110.4 -89.4 6.0 -14.9 -15.1 28.0 71 74 A C H > S+ 0 0 0 1,-0.3 4,-1.9 -5,-0.3 -1,-0.2 0.863 82.2 39.0 -49.6 -50.9 -11.3 -14.9 27.1 72 75 A M H > S+ 0 0 0 361,-0.7 4,-2.0 -3,-0.3 -1,-0.3 0.820 114.0 56.2 -72.9 -26.7 -10.3 -18.6 27.5 73 76 A L H > S+ 0 0 0 -3,-0.4 4,-2.4 -4,-0.2 -2,-0.2 0.917 108.4 48.7 -67.1 -39.9 -13.7 -19.7 26.1 74 77 A R H X S+ 0 0 1 -4,-2.8 4,-2.1 1,-0.2 -2,-0.2 0.880 110.1 50.2 -65.6 -38.9 -12.8 -17.6 23.0 75 78 A C H X S+ 0 0 0 -4,-1.9 4,-2.1 -5,-0.2 -1,-0.2 0.858 109.7 52.0 -67.7 -33.8 -9.3 -19.2 22.8 76 79 A G H X S+ 0 0 0 -4,-2.0 4,-2.4 2,-0.2 5,-0.3 0.925 108.5 50.9 -66.1 -44.4 -11.0 -22.6 23.0 77 80 A Q H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.896 109.9 51.2 -58.5 -42.1 -13.3 -21.7 20.2 78 81 A M H X S+ 0 0 1 -4,-2.1 4,-2.0 2,-0.2 -31,-0.2 0.906 112.0 43.2 -66.0 -43.7 -10.3 -20.6 18.1 79 82 A I H X S+ 0 0 4 -4,-2.1 4,-1.3 2,-0.2 -1,-0.2 0.896 117.1 46.8 -72.5 -34.4 -8.2 -23.7 18.5 80 83 A F H X S+ 0 0 1 -4,-2.4 4,-2.1 -5,-0.2 -2,-0.2 0.892 110.2 54.2 -71.4 -36.2 -11.3 -26.0 18.0 81 84 A A H X S+ 0 0 0 -4,-2.4 4,-2.7 -5,-0.3 -2,-0.2 0.909 104.9 53.6 -60.9 -43.0 -12.3 -23.9 14.9 82 85 A Q H X S+ 0 0 2 -4,-2.0 4,-2.2 1,-0.2 -1,-0.2 0.863 106.7 52.8 -61.7 -34.1 -8.8 -24.5 13.5 83 86 A A H X S+ 0 0 0 -4,-1.3 4,-2.4 2,-0.2 -1,-0.2 0.931 110.3 47.3 -65.8 -43.0 -9.4 -28.2 13.9 84 87 A L H X S+ 0 0 0 -4,-2.1 4,-2.8 2,-0.2 5,-0.4 0.876 109.3 53.9 -64.6 -38.6 -12.7 -27.9 12.0 85 88 A V H X>S+ 0 0 0 -4,-2.7 4,-2.8 2,-0.2 5,-2.3 0.936 111.5 45.0 -60.6 -46.9 -11.0 -25.9 9.3 86 89 A C H <5S+ 0 0 24 -4,-2.2 5,-0.2 3,-0.2 -2,-0.2 0.899 115.2 48.7 -64.5 -39.0 -8.4 -28.6 8.8 87 90 A R H <5S+ 0 0 85 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.891 127.3 21.7 -69.6 -40.0 -11.1 -31.3 8.9 88 91 A H H <5S+ 0 0 37 -4,-2.8 -3,-0.2 -5,-0.1 -2,-0.2 0.813 139.5 20.2 -97.9 -36.9 -13.5 -29.7 6.4 89 92 A L T <5S- 0 0 36 -4,-2.8 -3,-0.2 -5,-0.4 -4,-0.1 0.721 101.2-120.2-106.7 -30.5 -11.3 -27.3 4.4 90 93 A G > < - 0 0 24 -5,-2.3 3,-1.2 -6,-0.2 -3,-0.1 0.011 25.7 -87.6 101.4 150.6 -7.8 -28.5 4.8 91 94 A R T 3 S+ 0 0 27 1,-0.3 -1,-0.1 -5,-0.2 -5,-0.1 0.752 125.1 59.8 -64.1 -24.0 -4.6 -26.9 6.2 92 95 A D T 3 S+ 0 0 119 -6,-0.1 -1,-0.3 -3,-0.1 -2,-0.1 0.643 79.8 111.9 -80.2 -15.1 -3.9 -25.5 2.7 93 96 A W < - 0 0 26 -3,-1.2 2,-0.4 -8,-0.1 -3,-0.1 -0.316 48.3-168.2 -61.7 140.0 -7.2 -23.6 2.6 94 97 A R - 0 0 60 -5,-0.1 2,-0.3 -50,-0.0 -52,-0.1 -0.983 13.9-131.6-132.9 144.3 -6.9 -19.8 2.6 95 98 A W - 0 0 10 -54,-0.4 2,-0.4 -2,-0.4 3,-0.1 -0.692 17.6-169.2 -96.4 146.0 -9.5 -17.1 3.1 96 99 A T - 0 0 72 3,-0.3 -2,-0.0 -2,-0.3 -55,-0.0 -0.993 23.5-140.6-138.4 128.8 -9.9 -14.0 0.9 97 100 A Q S S+ 0 0 135 -2,-0.4 -1,-0.1 1,-0.1 162,-0.1 0.871 102.0 37.1 -53.2 -42.5 -12.2 -11.0 1.6 98 101 A R S S+ 0 0 92 -3,-0.1 3,-0.1 2,-0.1 -1,-0.1 0.983 98.9 76.3 -72.8 -80.0 -13.2 -10.8 -2.0 99 102 A K S S- 0 0 56 1,-0.1 -3,-0.3 -4,-0.0 2,-0.2 0.120 89.1-104.2 -38.2 139.7 -13.6 -14.3 -3.4 100 103 A R - 0 0 180 1,-0.1 -1,-0.1 0, 0.0 -2,-0.1 -0.470 40.8-135.3 -67.4 135.3 -16.6 -16.3 -2.5 101 104 A Q - 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