==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-MAR-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 11-OCT-09 2KPA . COMPND 2 MOLECULE: ARNO(375-400); . SOURCE 2 SYNTHETIC: YES; . AUTHOR M.MERKULOVA,A.BAKULINA,Y.R.THAKER,G.GRUBER,V.MARSHANSKY . 26 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 3064.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 14 53.8 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 . 0 0.0 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 . 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 4 15.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 9 34.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 3.8 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 1 1 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 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 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 V 0 0 163 0, 0.0 3,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -31.3 2.5 -0.5 -1.8 2 2 A S + 0 0 76 1,-0.2 4,-0.2 2,-0.2 0, 0.0 0.689 360.0 58.2 -80.2 -19.7 2.1 -4.0 -3.2 3 3 A V S > S+ 0 0 80 1,-0.2 4,-0.7 2,-0.2 3,-0.3 0.682 93.5 68.5 -82.2 -19.5 -1.6 -3.8 -2.8 4 4 A D H >> S+ 0 0 108 1,-0.2 3,-1.2 2,-0.2 4,-0.6 0.959 100.9 44.2 -63.1 -53.1 -1.8 -0.8 -5.1 5 5 A P H 34 S+ 0 0 53 0, 0.0 -1,-0.2 0, 0.0 -2,-0.2 0.549 115.2 52.2 -69.7 -6.6 -0.8 -2.7 -8.3 6 6 A F H 3> S+ 0 0 110 -3,-0.3 4,-3.0 -4,-0.2 5,-0.4 0.496 87.4 82.7-105.4 -9.2 -3.2 -5.4 -7.2 7 7 A Y H S+ 0 0 148 -3,-1.2 4,-3.0 -4,-0.7 5,-0.6 0.962 91.4 47.5 -59.3 -54.9 -6.2 -3.1 -6.7 8 8 A E H <5S+ 0 0 120 -4,-0.6 7,-0.3 3,-0.2 -1,-0.2 0.726 116.1 50.1 -59.8 -20.9 -7.1 -3.0 -10.4 9 9 A M H 45S+ 0 0 66 -3,-0.2 6,-0.4 2,-0.1 7,-0.3 0.964 117.9 31.9 -81.2 -62.9 -6.8 -6.8 -10.2 10 10 A L H <5S+ 0 0 131 -4,-3.0 -2,-0.2 1,-0.1 -3,-0.2 0.916 130.0 39.8 -61.8 -44.7 -8.9 -7.7 -7.2 11 11 A A T <5S+ 0 0 78 -4,-3.0 2,-0.4 -5,-0.4 -3,-0.2 0.998 112.8 53.0 -67.8 -69.3 -11.3 -4.9 -7.8 12 12 A A > < - 0 0 28 -5,-0.6 3,-1.1 -4,-0.2 4,-0.2 -0.568 68.1-155.8 -73.8 124.0 -11.6 -4.9 -11.6 13 13 A R T 3> S+ 0 0 159 -2,-0.4 4,-0.9 1,-0.3 3,-0.3 0.523 79.7 92.5 -76.0 -4.8 -12.6 -8.4 -12.9 14 14 A K H 3> S+ 0 0 146 1,-0.2 4,-2.6 -6,-0.2 -1,-0.3 0.698 71.9 73.2 -61.7 -18.0 -11.0 -7.4 -16.2 15 15 A K H <> S+ 0 0 111 -3,-1.1 4,-0.5 -6,-0.4 3,-0.3 0.985 98.3 40.4 -59.9 -62.4 -7.8 -9.0 -14.8 16 16 A R H 4 S+ 0 0 181 -3,-0.3 6,-0.2 -7,-0.3 -1,-0.2 0.720 117.0 54.7 -60.2 -20.2 -9.0 -12.6 -15.1 17 17 A I H < S+ 0 0 76 -4,-0.9 -1,-0.2 1,-0.2 -2,-0.2 0.867 105.9 47.8 -81.0 -39.6 -10.5 -11.6 -18.5 18 18 A S H < S+ 0 0 93 -4,-2.6 -2,-0.2 -3,-0.3 -1,-0.2 0.426 87.1 128.9 -80.8 1.5 -7.3 -10.1 -19.9 19 19 A V >X - 0 0 59 -4,-0.5 3,-0.9 1,-0.1 4,-0.7 -0.276 68.8-128.6 -59.3 141.0 -5.5 -13.3 -18.8 20 20 A K H 3> S+ 0 0 168 1,-0.2 4,-0.9 2,-0.2 3,-0.2 0.718 104.5 73.5 -63.4 -20.1 -3.5 -15.0 -21.5 21 21 A K H >4 S+ 0 0 152 1,-0.2 3,-0.7 2,-0.2 -1,-0.2 0.907 97.1 45.5 -60.5 -43.6 -5.3 -18.2 -20.6 22 22 A K H <4 S+ 0 0 138 -3,-0.9 -1,-0.2 1,-0.2 -2,-0.2 0.708 105.7 62.8 -72.9 -20.1 -8.5 -16.9 -22.3 23 23 A Q H 3< S+ 0 0 128 -4,-0.7 -1,-0.2 -3,-0.2 -2,-0.2 0.701 91.6 84.8 -76.9 -20.1 -6.4 -15.8 -25.2 24 24 A E S << S- 0 0 136 -4,-0.9 -3,-0.0 -3,-0.7 0, 0.0 -0.208 95.4 -83.4 -76.5 171.4 -5.4 -19.4 -25.9 25 25 A Q 0 0 186 1,-0.1 -1,-0.1 -2,-0.0 -2,-0.1 -0.561 360.0 360.0 -80.0 139.3 -7.5 -21.9 -27.9 26 26 A P 0 0 170 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.387 360.0 360.0 -69.8 360.0 -10.3 -23.8 -26.1