==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE INHIBITOR 10-MAY-00 1EZE . COMPND 2 MOLECULE: CHOLESTERYL ESTER TRANSFERASE INHIBITOR PROTEIN; . SOURCE 2 SYNTHETIC: YES; . AUTHOR G.W.BUCHKO,A.ROZEK,P.KANDA,M.A.KENNEDY,R.J.CUSHLEY . 38 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 4131.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 31 81.6 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 . 1 2.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 11 28.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 17 44.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 5.3 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 1 0 0 0 0 0 0 0 1 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 A 0 0 149 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 153.5 28.8 -5.6 8.1 2 2 A P > - 0 0 98 0, 0.0 3,-0.6 0, 0.0 5,-0.0 -0.379 360.0-128.4 -77.2 155.8 25.2 -5.8 7.0 3 3 A D G > S+ 0 0 99 1,-0.2 3,-1.3 -2,-0.1 5,-0.2 0.428 80.0 112.1 -86.0 4.2 23.8 -3.4 4.4 4 4 A V G > S+ 0 0 78 1,-0.3 2,-1.0 2,-0.2 3,-0.9 0.895 77.1 54.4 -43.6 -40.1 21.0 -2.5 6.8 5 5 A S G < S+ 0 0 107 -3,-0.6 -1,-0.3 1,-0.3 -2,-0.1 -0.211 125.9 22.8 -88.0 47.0 22.6 0.9 6.8 6 6 A S G < S+ 0 0 89 -3,-1.3 -1,-0.3 -2,-1.0 -2,-0.2 0.297 110.7 69.0 163.0 33.7 22.4 0.9 3.0 7 7 A A S < S+ 0 0 49 -3,-0.9 4,-0.4 -5,-0.0 -3,-0.1 0.121 77.1 75.9-153.8 24.1 19.6 -1.4 2.0 8 8 A L S > S+ 0 0 101 -5,-0.2 4,-2.1 -4,-0.2 5,-0.2 0.530 74.9 77.0-114.6 -12.6 16.3 0.2 3.1 9 9 A D H > S+ 0 0 98 2,-0.2 4,-0.8 1,-0.1 -1,-0.1 0.797 96.8 50.8 -69.3 -24.5 16.1 2.9 0.4 10 10 A K H >> S+ 0 0 167 2,-0.2 4,-1.6 3,-0.1 3,-1.0 0.980 112.2 41.2 -76.2 -61.7 14.9 0.2 -2.0 11 11 A L H 3> S+ 0 0 125 -4,-0.4 4,-2.3 1,-0.3 3,-0.3 0.919 108.8 61.7 -53.6 -43.0 12.1 -1.3 0.1 12 12 A K H 3< S+ 0 0 133 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.902 105.8 47.7 -52.3 -36.8 11.0 2.1 1.2 13 13 A E H XX S+ 0 0 98 -3,-1.0 4,-2.4 -4,-0.8 3,-0.9 0.855 106.0 58.4 -73.0 -32.5 10.3 2.8 -2.5 14 14 A F H 3<>S+ 0 0 141 -4,-1.6 5,-0.9 -3,-0.3 -2,-0.2 0.932 108.0 44.4 -63.9 -42.8 8.4 -0.5 -2.8 15 15 A G T 3<5S+ 0 0 15 -4,-2.3 5,-0.3 1,-0.2 -1,-0.3 0.467 114.0 56.6 -79.9 2.1 5.9 0.5 -0.1 16 16 A N T <>5S+ 0 0 101 -3,-0.9 4,-0.9 -5,-0.3 -2,-0.2 0.879 104.3 44.0 -96.8 -56.8 5.8 3.9 -1.8 17 17 A T H >X5S+ 0 0 95 -4,-2.4 4,-1.1 2,-0.2 3,-1.0 0.624 130.3 3.9 -60.6-131.6 4.8 3.2 -5.4 18 18 A L H 3>5S+ 0 0 101 1,-0.2 4,-2.4 2,-0.2 3,-0.4 0.743 127.4 67.1 -22.8 -44.8 1.9 0.6 -6.0 19 19 A E H >>X S+ 0 0 186 -4,-1.8 3,-0.7 1,-0.2 4,-0.5 0.870 105.6 60.5 -68.0 -32.9 -4.4 2.7 -0.1 24 24 A E H >< S+ 0 0 129 -4,-1.6 3,-0.6 -5,-0.3 4,-0.4 0.797 100.4 56.6 -64.4 -24.1 -5.7 5.0 -2.8 25 25 A V H XX S+ 0 0 50 -4,-1.5 4,-1.7 -3,-0.6 3,-0.9 0.786 90.5 70.4 -78.3 -25.6 -8.1 2.2 -3.7 26 26 A I H S+ 0 0 53 -4,-1.7 5,-1.1 2,-0.1 4,-0.6 0.725 115.1 56.0-105.7 -33.4 -14.1 1.2 -2.3 30 30 A K H <5S+ 0 0 145 -4,-1.5 3,-0.5 -5,-0.4 -3,-0.2 0.867 101.5 58.2 -70.2 -33.8 -14.6 2.8 1.1 31 31 A Q T <5S+ 0 0 140 -4,-0.6 -1,-0.2 1,-0.3 -2,-0.1 0.897 107.1 48.4 -64.1 -34.0 -16.8 5.5 -0.4 32 32 A S T 45S- 0 0 64 -4,-0.2 -1,-0.3 1,-0.1 -2,-0.2 0.689 110.7-129.3 -77.3 -15.1 -19.1 2.7 -1.7 33 33 A E T <5 - 0 0 156 -4,-0.6 -3,-0.2 -3,-0.5 -2,-0.1 0.464 23.9-124.5 80.2 0.2 -19.0 1.2 1.8 34 34 A F < + 0 0 120 -5,-1.1 -1,-0.2 1,-0.2 -4,-0.1 0.794 48.5 166.2 23.0 62.8 -18.0 -2.1 0.1 35 35 A P + 0 0 101 0, 0.0 2,-0.5 0, 0.0 -1,-0.2 0.546 21.8 135.3 -79.4 -8.8 -21.0 -3.8 1.9 36 36 A A - 0 0 64 1,-0.1 -3,-0.0 0, 0.0 0, 0.0 -0.146 56.5-137.0 -44.1 95.4 -20.6 -6.8 -0.4 37 37 A K 0 0 198 -2,-0.5 -1,-0.1 1,-0.1 -3,-0.0 -0.131 360.0 360.0 -54.6 156.6 -21.0 -9.4 2.4 38 38 A T 0 0 174 -3,-0.0 -1,-0.1 0, 0.0 0, 0.0 -0.318 360.0 360.0-122.3 360.0 -18.6 -12.3 2.2