==== 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 07-JAN-99 1ICF . COMPND 2 MOLECULE: PROTEIN (CATHEPSIN L: HEAVY CHAIN); . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR G.GUNCAR,G.PUNGERCIC,I.KLEMENCIC,V.TURK,D.TURK . 564 6 12 10 2 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25133.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 313 55.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 14 2.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 102 18.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 6 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 0.2 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 . 30 5.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 49 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 95 16.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 1.8 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 0 2 2 0 0 2 2 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 2 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 . 14 4 0 4 4 2 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 . 2 2 0 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 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 A 0 0 107 0, 0.0 123,-0.1 0, 0.0 122,-0.0 0.000 360.0 360.0 360.0 -51.0 17.8 0.9 52.8 2 2 A P - 0 0 66 0, 0.0 3,-0.1 0, 0.0 125,-0.0 -0.243 360.0-125.1 -67.3 161.0 18.6 -2.8 52.5 3 3 A R S S+ 0 0 190 1,-0.2 2,-0.3 169,-0.0 0, 0.0 0.735 93.1 27.4 -76.8 -23.7 22.2 -3.9 52.0 4 4 A S + 0 0 68 167,-0.1 2,-0.3 123,-0.0 167,-0.2 -0.999 60.9 177.1-145.1 138.2 21.4 -5.9 48.9 5 5 A V E +A 170 0A 13 165,-2.3 165,-1.9 -2,-0.3 2,-0.2 -0.996 5.4 170.6-141.6 138.4 18.8 -5.7 46.2 6 6 A D E > -A 169 0A 28 -2,-0.3 3,-1.8 163,-0.2 4,-0.5 -0.684 12.4-169.1-150.7 94.8 18.3 -7.9 43.1 7 7 A W T 3 >S+ 0 0 17 161,-2.5 5,-1.9 1,-0.3 6,-0.4 0.589 81.1 75.7 -62.5 -13.1 15.1 -7.4 41.2 8 8 A R T > 5S+ 0 0 96 160,-0.3 3,-1.1 1,-0.2 -1,-0.3 0.822 91.0 57.0 -65.8 -34.1 15.8 -10.5 39.1 9 9 A E T < 5S+ 0 0 161 -3,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.826 104.7 51.3 -65.7 -30.6 14.8 -12.6 42.1 10 10 A K T 3 5S- 0 0 105 -4,-0.5 -1,-0.2 -3,-0.2 -2,-0.2 0.227 118.5-106.9 -92.5 11.3 11.4 -10.9 42.3 11 11 A G T < 5S+ 0 0 30 -3,-1.1 -3,-0.2 2,-0.1 -2,-0.1 0.699 83.2 123.9 72.0 26.9 10.5 -11.5 38.6 12 12 A Y < + 0 0 26 -5,-1.9 2,-0.4 156,-0.1 27,-0.2 0.576 57.3 72.0 -89.9 -16.1 10.9 -7.9 37.4 13 13 A V - 0 0 21 -6,-0.4 3,-0.1 -5,-0.2 -2,-0.1 -0.914 65.0-147.7-115.8 132.4 13.5 -8.6 34.7 14 14 A T - 0 0 6 -2,-0.4 3,-0.1 1,-0.2 -2,-0.0 -0.328 46.0 -75.0 -81.2 168.3 13.2 -10.3 31.3 15 15 A P - 0 0 73 0, 0.0 -1,-0.2 0, 0.0 2,-0.1 -0.195 64.3 -79.4 -61.9 160.2 16.2 -12.3 29.8 16 16 A V - 0 0 14 178,-0.2 173,-0.3 -3,-0.1 2,-0.2 -0.352 51.6-157.2 -63.4 132.7 19.2 -10.4 28.4 17 17 A K - 0 0 10 168,-0.4 171,-2.2 171,-0.2 2,-0.4 -0.524 8.9-130.2-106.5 175.8 18.5 -9.0 24.8 18 18 A N B -I 187 0B 71 169,-0.3 169,-0.2 539,-0.2 168,-0.0 -0.977 10.0-167.2-136.0 118.3 20.9 -8.0 22.0 19 19 A Q > - 0 0 0 167,-2.8 3,-0.6 -2,-0.4 5,-0.1 0.564 28.8-158.6 -78.9 -12.6 20.8 -4.7 20.2 20 20 A G T 3 - 0 0 30 166,-0.3 2,-0.4 1,-0.2 -1,-0.2 -0.316 57.9 -26.8 67.0-147.3 23.1 -5.8 17.4 21 21 A Q T 3 S+ 0 0 116 72,-0.1 2,-0.4 2,-0.1 -1,-0.2 -0.234 110.2 101.7 -99.5 49.0 24.9 -3.1 15.5 22 22 A a S < S- 0 0 1 -3,-0.6 2,-2.6 -2,-0.4 3,-0.2 -0.995 76.1-126.7-129.7 131.3 22.3 -0.4 16.0 23 23 A G B S+j 66 0C 1 42,-2.0 44,-0.7 -2,-0.4 3,-0.2 -0.347 71.1 122.4 -77.4 60.8 22.7 2.4 18.6 24 24 A S >> + 0 0 0 -2,-2.6 3,-1.7 1,-0.1 4,-1.6 0.092 22.6 118.0-106.9 16.9 19.3 1.6 20.1 25 25 A C H 3> S+ 0 0 0 1,-0.3 4,-2.6 2,-0.2 5,-0.2 0.868 72.0 63.3 -55.3 -32.7 20.6 0.9 23.7 26 26 A W H 3> S+ 0 0 0 -3,-0.2 4,-1.2 1,-0.2 -1,-0.3 0.828 103.8 48.4 -58.9 -34.1 18.5 3.9 24.8 27 27 A A H <> S+ 0 0 0 -3,-1.7 4,-2.5 2,-0.2 5,-0.2 0.864 110.5 49.1 -75.2 -38.1 15.4 1.8 23.7 28 28 A F H X S+ 0 0 15 -4,-1.6 4,-1.9 2,-0.2 -2,-0.2 0.886 110.6 51.3 -68.5 -35.2 16.5 -1.4 25.5 29 29 A S H X S+ 0 0 2 -4,-2.6 4,-1.7 -5,-0.2 -1,-0.2 0.861 112.4 47.7 -68.4 -37.5 17.1 0.6 28.7 30 30 A A H X S+ 0 0 2 -4,-1.2 4,-2.2 -5,-0.2 -2,-0.2 0.900 111.8 45.9 -72.2 -43.7 13.6 2.1 28.4 31 31 A T H X S+ 0 0 1 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.879 110.9 57.3 -68.8 -32.4 11.8 -1.2 27.7 32 32 A G H X S+ 0 0 4 -4,-1.9 4,-1.4 -5,-0.2 -2,-0.2 0.931 109.1 42.8 -59.2 -46.5 13.8 -2.6 30.6 33 33 A A H X S+ 0 0 0 -4,-1.7 4,-1.7 1,-0.2 -2,-0.2 0.876 115.8 49.4 -68.6 -38.4 12.5 0.0 33.1 34 34 A L H X S+ 0 0 2 -4,-2.2 4,-2.5 2,-0.2 5,-0.2 0.810 105.3 57.2 -70.9 -31.8 8.9 -0.3 31.7 35 35 A E H X S+ 0 0 2 -4,-2.3 4,-1.8 2,-0.2 11,-0.2 0.895 109.1 46.6 -65.0 -41.9 8.9 -4.1 32.0 36 36 A G H X S+ 0 0 0 -4,-1.4 4,-2.1 -5,-0.2 -2,-0.2 0.902 114.4 46.2 -66.3 -42.5 9.7 -3.8 35.7 37 37 A Q H X S+ 0 0 10 -4,-1.7 4,-2.0 2,-0.2 -2,-0.2 0.883 113.0 48.8 -70.1 -38.6 7.1 -1.1 36.4 38 38 A M H X S+ 0 0 28 -4,-2.5 4,-2.7 2,-0.2 5,-0.5 0.882 112.0 50.1 -66.9 -39.6 4.4 -3.0 34.4 39 39 A F H X S+ 0 0 41 -4,-1.8 4,-2.5 -5,-0.2 -2,-0.2 0.915 110.1 49.6 -64.3 -42.7 5.2 -6.2 36.3 40 40 A R H < S+ 0 0 104 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.879 116.5 43.8 -63.1 -35.8 5.0 -4.3 39.6 41 41 A K H < S+ 0 0 128 -4,-2.0 -2,-0.2 -5,-0.1 -1,-0.2 0.850 131.9 16.1 -80.0 -34.4 1.6 -2.9 38.6 42 42 A T H < S- 0 0 73 -4,-2.7 -3,-0.2 2,-0.2 -2,-0.2 0.581 91.6-121.9-116.5 -16.7 0.0 -6.1 37.1 43 43 A G S < S+ 0 0 51 -4,-2.5 2,-0.4 -5,-0.5 -4,-0.2 0.551 78.0 111.3 84.8 5.8 2.1 -9.0 38.3 44 44 A R - 0 0 179 -6,-0.5 2,-0.7 -9,-0.1 -1,-0.2 -0.955 58.7-146.9-120.6 126.9 2.8 -10.1 34.7 45 45 A L + 0 0 68 -2,-0.4 2,-0.4 -3,-0.1 -9,-0.1 -0.831 26.0 170.7 -94.3 114.8 6.2 -9.9 33.0 46 46 A I - 0 0 64 -2,-0.7 2,-0.1 -11,-0.2 -8,-0.1 -0.985 33.9-122.8-130.3 122.1 5.9 -9.1 29.3 47 47 A S - 0 0 35 -2,-0.4 39,-2.3 1,-0.1 40,-0.3 -0.387 31.8-142.7 -63.3 128.1 8.8 -8.3 27.0 48 48 A L B -K 85 0D 2 37,-0.3 2,-0.6 38,-0.1 37,-0.2 -0.606 18.9 -97.1 -97.6 158.6 8.3 -4.9 25.3 49 49 A S > + 0 0 0 35,-2.5 4,-0.9 -2,-0.2 35,-0.1 -0.643 29.0 178.3 -83.1 115.1 9.1 -3.8 21.8 50 50 A E H > S+ 0 0 0 -2,-0.6 4,-2.5 2,-0.2 3,-0.4 0.885 87.5 57.7 -75.5 -38.1 12.4 -1.9 21.2 51 51 A Q H > S+ 0 0 0 38,-0.4 4,-3.1 1,-0.2 5,-0.3 0.873 99.2 58.7 -58.7 -40.1 11.6 -1.8 17.4 52 52 A N H > S+ 0 0 0 37,-0.4 4,-1.6 1,-0.2 -1,-0.2 0.913 112.1 41.5 -56.0 -40.6 8.3 -0.0 18.1 53 53 A L H X S+ 0 0 2 -4,-0.9 4,-1.9 -3,-0.4 -2,-0.2 0.898 113.4 51.8 -74.5 -43.1 10.4 2.7 19.8 54 54 A V H < S+ 0 0 7 -4,-2.5 10,-0.3 1,-0.2 -2,-0.2 0.951 118.4 37.7 -59.0 -45.7 13.2 2.7 17.2 55 55 A D H < S+ 0 0 22 -4,-3.1 43,-0.4 1,-0.2 3,-0.2 0.798 126.3 32.1 -77.1 -33.5 10.7 3.2 14.3 56 56 A b H < S+ 0 0 12 -4,-1.6 -2,-0.2 -5,-0.3 -3,-0.2 0.557 94.1 76.9-108.9 -6.8 8.2 5.5 16.0 57 57 A S ><> + 0 0 0 -4,-1.9 5,-2.0 1,-0.2 3,-0.6 0.134 55.9 109.9 -99.0 29.1 9.7 7.9 18.4 58 58 A G G > 5S+ 0 0 45 1,-0.2 3,-1.5 -3,-0.2 -1,-0.2 0.881 75.3 56.7 -65.7 -40.5 11.3 10.4 16.0 59 59 A P G 3 5S+ 0 0 118 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.754 102.9 56.1 -65.3 -20.7 8.8 13.1 17.0 60 60 A Q G < 5S- 0 0 36 -3,-0.6 -2,-0.2 -4,-0.1 15,-0.1 0.514 131.5 -92.5 -86.2 -6.8 9.9 12.8 20.7 61 61 A G T < 5S+ 0 0 39 -3,-1.5 -3,-0.2 1,-0.3 2,-0.1 0.361 80.1 137.2 114.7 -2.6 13.4 13.4 19.6 62 62 A N < - 0 0 10 -5,-2.0 -1,-0.3 10,-0.1 6,-0.2 -0.368 39.9-155.8 -78.1 154.1 14.9 9.9 19.1 63 63 A E > - 0 0 127 4,-2.5 3,-2.8 1,-0.3 4,-0.1 -0.226 27.2-132.7-124.7 44.2 17.1 9.0 16.1 64 64 A G T > S+ 0 0 4 -10,-0.3 3,-1.0 1,-0.3 -1,-0.3 -0.158 85.1 0.9 48.5-118.3 16.6 5.3 15.8 65 65 A a T 3 S+ 0 0 19 1,-0.2 -42,-2.0 -3,-0.1 -1,-0.3 0.387 128.8 65.0 -82.6 2.1 19.9 3.5 15.4 66 66 A N B < S-j 23 0C 94 -3,-2.8 -1,-0.2 1,-0.4 -2,-0.2 0.283 115.9 -69.7-107.1 10.1 21.9 6.8 15.7 67 67 A G < + 0 0 2 -3,-1.0 -4,-2.5 -44,-0.7 -1,-0.4 -0.525 51.2 171.6 127.7 167.0 21.0 7.6 19.3 68 68 A G - 0 0 12 386,-1.8 2,-0.4 -6,-0.2 388,-0.1 -0.962 30.1 -98.0 173.4-173.9 18.2 8.7 21.6 69 69 A L > - 0 0 46 -2,-0.3 4,-1.5 1,-0.1 3,-0.4 -0.989 18.2-131.5-135.2 143.1 17.2 9.2 25.2 70 70 A M H > S+ 0 0 7 -2,-0.4 4,-2.1 1,-0.2 3,-0.2 0.891 109.1 55.2 -58.9 -39.1 15.3 7.0 27.7 71 71 A D H > S+ 0 0 29 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.850 104.6 52.1 -64.9 -35.7 13.1 9.9 28.7 72 72 A Y H > S+ 0 0 99 -3,-0.4 4,-2.1 2,-0.2 -1,-0.2 0.838 109.8 51.0 -66.4 -35.0 12.1 10.6 25.1 73 73 A A H X S+ 0 0 0 -4,-1.5 4,-2.1 2,-0.2 -2,-0.2 0.878 110.2 47.6 -67.4 -40.8 11.1 7.0 24.8 74 74 A F H X S+ 0 0 1 -4,-2.1 4,-1.5 2,-0.2 -2,-0.2 0.875 111.7 52.2 -67.2 -38.9 9.0 7.3 28.1 75 75 A Q H X S+ 0 0 58 -4,-2.3 4,-2.9 -5,-0.2 5,-0.2 0.923 106.7 53.6 -63.3 -42.0 7.5 10.4 26.6 76 76 A Y H X S+ 0 0 9 -4,-2.1 4,-3.1 1,-0.2 5,-0.3 0.941 105.9 51.3 -58.1 -50.3 6.6 8.5 23.4 77 77 A V H X>S+ 0 0 0 -4,-2.1 4,-1.4 1,-0.2 5,-1.0 0.863 113.9 45.6 -56.7 -36.0 4.7 5.8 25.2 78 78 A Q H <5S+ 0 0 78 -4,-1.5 -1,-0.2 2,-0.2 -2,-0.2 0.937 115.3 45.0 -72.3 -48.2 2.7 8.4 27.1 79 79 A D H <5S+ 0 0 100 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.851 118.6 45.1 -62.3 -37.8 2.0 10.5 23.9 80 80 A N H <5S- 0 0 55 -4,-3.1 -1,-0.2 -5,-0.2 -2,-0.2 0.689 101.5-132.0 -79.7 -27.9 1.1 7.3 22.0 81 81 A G T <5S+ 0 0 39 -4,-1.4 2,-0.3 -5,-0.3 -3,-0.2 0.664 74.5 21.0 82.4 16.7 -1.0 5.7 24.6 82 82 A G < - 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