==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 17-OCT-02 1O6X . COMPND 2 MOLECULE: PROCARBOXYPEPTIDASE A2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.A.JIMENEZ,V.VILLEGAS,J.SANTORO,L.SERRANO,J.VENDRELL, . 81 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6262.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 52 64.2 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 . 13 16.0 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 . 0 0.0 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 . 1 1.2 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 . 8 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 8 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 19 23.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 1.2 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 0 0 0 0 1 0 1 0 0 0 0 0 0 0 0 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 . 1 0 1 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 M 0 0 239 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 66.9 30.8 -24.0 1.1 2 2 A R + 0 0 238 2,-0.0 2,-0.3 0, 0.0 0, 0.0 -0.939 360.0 164.5-146.4 165.7 27.8 -21.9 0.3 3 3 A S - 0 0 101 -2,-0.3 2,-0.3 2,-0.0 0, 0.0 -0.882 11.0-165.4-179.8 149.2 25.1 -19.8 2.0 4 4 A L - 0 0 151 -2,-0.3 2,-0.3 2,-0.0 -2,-0.0 -0.995 8.8-149.9-147.2 145.0 22.5 -17.2 1.2 5 5 A E + 0 0 161 -2,-0.3 2,-0.3 2,-0.0 -2,-0.0 -0.845 20.5 162.4-116.7 153.3 20.4 -14.9 3.4 6 6 A T + 0 0 117 -2,-0.3 2,-0.3 2,-0.0 -2,-0.0 -0.943 5.6 168.3-157.1 173.4 16.9 -13.4 2.8 7 7 A F - 0 0 190 -2,-0.3 2,-0.3 2,-0.0 -2,-0.0 -0.955 16.2-137.6-172.4-175.8 13.9 -11.8 4.4 8 8 A V + 0 0 133 -2,-0.3 2,-0.1 2,-0.0 -2,-0.0 -0.833 11.7 178.8-147.9-177.0 10.7 -9.9 4.0 9 9 A G - 0 0 18 -2,-0.3 47,-1.9 2,-0.0 48,-0.3 -0.314 10.0-162.5 164.2 107.2 8.7 -7.0 5.3 10 10 A D E -A 55 0A 74 45,-0.2 2,-0.3 46,-0.1 44,-0.1 -0.180 6.6-160.4 -88.6-175.0 5.3 -5.6 4.2 11 11 A Q E -A 54 0A 15 43,-1.5 43,-1.9 -2,-0.1 67,-0.1 -0.834 9.3-138.1-172.2 131.1 3.8 -2.2 5.0 12 12 A V E -A 53 0A 10 65,-0.7 64,-0.5 41,-0.3 65,-0.3 -0.402 19.0-168.4 -88.2 167.9 0.3 -0.7 5.0 13 13 A L E -AB 52 75A 11 39,-0.6 39,-0.7 62,-0.2 2,-0.6 -0.979 21.0-123.4-157.9 146.7 -0.6 2.7 3.7 14 14 A E E -AB 51 74A 45 60,-1.9 60,-1.0 -2,-0.3 2,-0.4 -0.845 27.5-170.1 -98.6 123.8 -3.6 5.0 3.8 15 15 A I E -AB 50 73A 5 35,-2.2 35,-1.9 -2,-0.6 58,-0.2 -0.908 11.8-160.6-115.2 141.4 -5.0 6.1 0.5 16 16 A V - 0 0 82 56,-2.5 56,-0.4 -2,-0.4 33,-0.1 -0.839 18.4-176.9-124.3 91.9 -7.7 8.8 0.0 17 17 A P + 0 0 8 0, 0.0 30,-0.6 0, 0.0 3,-0.1 0.001 20.2 160.7 -75.0-174.4 -9.3 8.5 -3.4 18 18 A S + 0 0 79 1,-0.7 2,-0.2 28,-0.2 53,-0.0 0.159 58.0 62.6-174.1 -39.2 -11.9 10.8 -4.9 19 19 A N S > S- 0 0 84 1,-0.1 4,-0.9 26,-0.1 -1,-0.7 -0.609 77.0-123.7-102.3 164.3 -11.9 10.3 -8.7 20 20 A E H > S+ 0 0 140 -2,-0.2 4,-2.7 2,-0.2 5,-0.2 0.874 111.3 56.8 -72.8 -39.4 -12.7 7.2 -10.7 21 21 A E H > S+ 0 0 144 1,-0.3 4,-0.9 2,-0.2 -1,-0.2 0.883 106.8 49.5 -58.5 -40.9 -9.3 7.2 -12.4 22 22 A Q H > S+ 0 0 29 1,-0.2 4,-1.3 2,-0.2 -1,-0.3 0.800 112.3 48.5 -68.1 -30.0 -7.6 7.1 -9.1 23 23 A I H X S+ 0 0 17 -4,-0.9 4,-1.5 1,-0.2 -2,-0.2 0.833 109.3 51.4 -77.6 -34.9 -9.8 4.2 -8.1 24 24 A K H X S+ 0 0 154 -4,-2.7 4,-1.9 1,-0.2 -2,-0.2 0.668 103.1 64.4 -74.2 -17.4 -9.1 2.4 -11.3 25 25 A N H X S+ 0 0 13 -4,-0.9 4,-2.2 -5,-0.2 -2,-0.2 0.982 102.7 43.1 -68.2 -60.0 -5.4 3.0 -10.5 26 26 A L H >X S+ 0 0 11 -4,-1.3 4,-2.8 1,-0.2 3,-0.8 0.955 113.9 51.2 -49.1 -61.1 -5.3 0.8 -7.4 27 27 A L H 3X S+ 0 0 93 -4,-1.5 4,-2.5 1,-0.3 -1,-0.2 0.897 109.7 51.0 -42.4 -51.7 -7.4 -1.9 -9.0 28 28 A Q H 3X S+ 0 0 107 -4,-1.9 4,-1.5 2,-0.2 -1,-0.3 0.865 112.9 47.4 -55.4 -38.9 -5.0 -1.8 -11.9 29 29 A L H X< S+ 0 0 19 -4,-2.2 3,-0.9 -3,-0.8 6,-0.3 0.988 115.2 41.4 -66.0 -61.9 -2.1 -2.1 -9.4 30 30 A E H 3< S+ 0 0 57 -4,-2.8 6,-0.3 1,-0.3 4,-0.2 0.744 109.5 64.7 -57.6 -23.6 -3.6 -5.0 -7.4 31 31 A A H 3< S+ 0 0 60 -4,-2.5 2,-0.7 -5,-0.5 -1,-0.3 0.907 73.3 100.0 -66.0 -43.4 -4.6 -6.4 -10.7 32 32 A Q S XX S- 0 0 112 -4,-1.5 2,-1.4 -3,-0.9 3,-1.4 -0.241 83.9-130.8 -48.7 94.2 -1.0 -6.8 -11.7 33 33 A E T 34 S+ 0 0 156 -2,-0.7 -1,-0.2 1,-0.2 -2,-0.1 -0.307 91.6 58.4 -54.3 88.6 -0.8 -10.5 -10.9 34 34 A H T 34 S+ 0 0 166 -2,-1.4 -1,-0.2 -4,-0.2 -4,-0.1 0.011 98.6 45.8-176.4 -56.1 2.4 -10.3 -8.9 35 35 A L T <4 S- 0 0 48 -3,-1.4 -2,-0.1 -6,-0.3 -5,-0.1 0.901 75.2-168.9 -72.7 -43.2 2.0 -8.0 -5.9 36 36 A Q < - 0 0 137 -4,-0.8 2,-0.2 -6,-0.3 -6,-0.1 0.955 15.2-174.3 49.4 62.1 -1.4 -9.5 -5.0 37 37 A L - 0 0 5 -7,-0.1 2,-0.5 -8,-0.1 -1,-0.1 -0.544 17.3-135.3 -87.0 153.7 -2.2 -6.8 -2.5 38 38 A D - 0 0 91 -2,-0.2 15,-0.7 15,-0.2 2,-0.5 -0.937 10.9-138.4-114.1 131.9 -5.3 -6.9 -0.3 39 39 A F B -C 52 0A 43 -2,-0.5 3,-0.2 1,-0.2 13,-0.2 -0.772 10.2-167.2 -92.1 127.4 -7.5 -3.9 0.3 40 40 A W S S+ 0 0 140 11,-0.5 2,-0.8 -2,-0.5 -1,-0.2 0.984 83.8 34.3 -72.9 -63.2 -8.8 -3.3 3.8 41 41 A K S S- 0 0 94 8,-0.1 -1,-0.3 1,-0.0 10,-0.1 -0.855 101.4-111.4 -99.5 107.6 -11.4 -0.7 3.0 42 42 A S > - 0 0 75 -2,-0.8 3,-0.8 -3,-0.2 6,-0.1 -0.097 30.9-167.6 -38.9 99.3 -13.0 -1.5 -0.4 43 43 A P T 3 + 0 0 11 0, 0.0 -1,-0.2 0, 0.0 5,-0.1 0.408 54.9 117.4 -75.0 3.0 -11.6 1.5 -2.3 44 44 A T T 3 S+ 0 0 90 -20,-0.0 -2,-0.1 -17,-0.0 -21,-0.1 0.828 80.9 32.1 -36.1 -44.5 -14.1 0.6 -5.0 45 45 A T S X S- 0 0 64 -3,-0.8 3,-0.7 1,-0.1 -26,-0.1 -0.836 92.4-107.5-118.7 156.6 -15.6 4.0 -4.3 46 46 A P T 3 S+ 0 0 47 0, 0.0 -28,-0.2 0, 0.0 -1,-0.1 -0.203 94.6 50.4 -75.0 169.8 -14.1 7.3 -3.2 47 47 A G T 3 S+ 0 0 75 -30,-0.6 2,-0.7 1,-0.1 -29,-0.1 0.061 90.9 95.1 89.3 -24.1 -14.6 8.8 0.3 48 48 A E S < S- 0 0 41 -3,-0.7 -1,-0.1 -6,-0.1 -3,-0.1 -0.891 75.4-135.0-105.9 108.4 -13.5 5.5 1.8 49 49 A T - 0 0 42 -2,-0.7 2,-0.3 -33,-0.1 -33,-0.2 -0.204 18.2-136.2 -58.3 149.2 -9.8 5.4 2.6 50 50 A A E -A 15 0A 0 -35,-1.9 -35,-2.2 -10,-0.1 2,-0.3 -0.835 17.0-171.3-111.6 149.3 -7.9 2.3 1.7 51 51 A H E +A 14 0A 31 -2,-0.3 -11,-0.5 -37,-0.2 2,-0.4 -0.756 16.0 165.1-143.1 90.9 -5.4 0.4 3.7 52 52 A V E -AC 13 39A 4 -39,-0.7 2,-1.5 -2,-0.3 -39,-0.6 -0.846 42.5-117.5-109.8 145.3 -3.6 -2.4 1.9 53 53 A R E -A 12 0A 136 -15,-0.7 -41,-0.3 -2,-0.4 -15,-0.2 -0.640 39.0-170.2 -82.8 87.8 -0.4 -4.1 3.1 54 54 A V E -A 11 0A 3 -43,-1.9 -43,-1.5 -2,-1.5 2,-0.2 -0.588 24.9-111.8 -81.6 141.1 2.0 -3.2 0.4 55 55 A P E > -A 10 0A 22 0, 0.0 3,-2.6 0, 0.0 4,-0.3 -0.528 16.3-129.4 -75.0 135.7 5.4 -4.9 0.3 56 56 A F G >> S+ 0 0 132 -47,-1.9 3,-1.1 1,-0.3 4,-0.8 0.847 113.4 56.7 -49.6 -38.7 8.4 -2.7 1.1 57 57 A V G 34 S+ 0 0 129 -48,-0.3 4,-0.4 1,-0.3 -1,-0.3 0.714 118.1 34.0 -66.4 -20.5 10.0 -4.0 -2.1 58 58 A N G <> S+ 0 0 25 -3,-2.6 4,-0.9 2,-0.1 -1,-0.3 0.181 96.4 89.6-116.8 11.4 6.9 -2.7 -3.8 59 59 A V H <> S+ 0 0 10 -3,-1.1 4,-2.3 -4,-0.3 -2,-0.2 0.826 91.1 45.1 -76.2 -33.8 6.5 0.3 -1.5 60 60 A Q H X S+ 0 0 131 -4,-0.8 4,-2.8 2,-0.2 5,-0.3 0.986 111.9 46.9 -72.0 -63.4 8.6 2.4 -3.8 61 61 A A H > S+ 0 0 60 -4,-0.4 4,-1.2 1,-0.3 -1,-0.2 0.805 118.9 46.7 -48.1 -31.5 7.2 1.5 -7.2 62 62 A V H X S+ 0 0 4 -4,-0.9 4,-2.9 2,-0.2 -1,-0.3 0.898 107.4 53.8 -77.6 -43.9 3.9 2.0 -5.4 63 63 A K H X S+ 0 0 70 -4,-2.3 4,-1.4 1,-0.3 -2,-0.2 0.827 112.1 46.9 -58.7 -32.6 5.0 5.3 -3.9 64 64 A V H X S+ 0 0 93 -4,-2.8 4,-2.6 2,-0.2 -1,-0.3 0.835 110.8 52.9 -77.1 -35.0 5.9 6.4 -7.4 65 65 A F H X S+ 0 0 47 -4,-1.2 4,-3.4 -5,-0.3 5,-0.3 0.968 105.9 51.0 -63.7 -56.6 2.6 5.2 -8.7 66 66 A L H <>S+ 0 0 3 -4,-2.9 5,-2.5 1,-0.2 -2,-0.2 0.927 115.4 43.3 -45.5 -56.5 0.4 7.0 -6.3 67 67 A E H ><5S+ 0 0 136 -4,-1.4 3,-2.2 3,-0.2 -1,-0.2 0.915 111.9 54.2 -56.6 -46.7 2.2 10.2 -7.1 68 68 A S H 3<5S+ 0 0 86 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.902 109.5 47.0 -54.1 -45.0 2.1 9.4 -10.8 69 69 A Q T 3<5S- 0 0 19 -4,-3.4 -1,-0.3 -5,-0.1 -2,-0.2 0.368 117.4-120.4 -78.6 5.3 -1.6 9.0 -10.6 70 70 A G T < 5 + 0 0 56 -3,-2.2 -3,-0.2 -5,-0.3 2,-0.2 0.924 64.3 145.1 54.2 50.2 -1.6 12.3 -8.7 71 71 A I < - 0 0 20 -5,-2.5 2,-0.4 -6,-0.1 -1,-0.2 -0.521 47.8-122.8-109.3 178.1 -3.1 10.7 -5.6 72 72 A A + 0 0 60 -56,-0.4 -56,-2.5 -2,-0.2 2,-0.2 -0.987 37.2 156.1-129.8 121.9 -2.7 11.2 -1.9 73 73 A Y E -B 15 0A 61 -2,-0.4 2,-0.3 -58,-0.2 -58,-0.3 -0.584 20.8-149.5-128.2-169.9 -1.7 8.5 0.5 74 74 A S E -B 14 0A 52 -60,-1.0 -60,-1.9 -2,-0.2 2,-0.8 -0.978 24.8-106.0-161.5 161.1 -0.0 8.0 3.9 75 75 A I E +B 13 0A 74 -2,-0.3 -62,-0.2 -62,-0.2 3,-0.2 -0.858 32.1 176.3 -99.6 109.6 2.1 5.6 5.9 76 76 A M - 0 0 103 -2,-0.8 2,-0.4 -64,-0.5 -1,-0.2 0.993 68.3 -2.4 -72.6 -69.7 0.1 3.8 8.5 77 77 A I - 0 0 103 -65,-0.3 -65,-0.7 1,-0.1 -1,-0.3 -0.989 65.3-166.0-130.7 137.5 2.6 1.4 10.0 78 78 A E - 0 0 103 -2,-0.4 2,-0.3 -3,-0.2 -66,-0.2 0.253 27.3-102.6 -93.6-141.7 6.2 0.9 9.0 79 79 A D - 0 0 93 -68,-0.1 2,-0.6 -70,-0.1 -68,-0.0 -0.812 23.6-165.9-158.2 110.7 8.6 -1.9 10.0 80 80 A V 0 0 122 -2,-0.3 -2,-0.0 1,-0.1 0, 0.0 -0.894 360.0 360.0-103.9 118.7 11.3 -1.7 12.6 81 81 A Q 0 0 232 -2,-0.6 -1,-0.1 0, 0.0 0, 0.0 0.752 360.0 360.0 -43.1 360.0 13.8 -4.5 12.5