==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER DE NOVO PROTEIN 17-NOV-03 1RIM . COMPND 2 MOLECULE: E6APC2 PEPTIDE; . SOURCE 2 SYNTHETIC: YES; . AUTHOR Y.LIU,Z.LIU,E.ANDROPHY,J.CHEN,J.D.BALEJA . 33 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 3203.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 18 54.5 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 . 1 3.0 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 3.0 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 . 2 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 2 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 9 27.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 3.0 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 0 1 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 Y 0 0 195 0, 0.0 12,-0.3 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 147.6 -13.8 11.8 0.9 2 2 A K + 0 0 175 10,-1.3 11,-0.2 1,-0.6 2,-0.1 0.133 360.0 51.8-176.3 -43.7 -11.5 13.3 -1.7 3 3 A F - 0 0 91 9,-2.0 -1,-0.6 11,-0.1 2,-0.2 -0.341 59.4-153.1-101.8-174.5 -8.6 11.0 -2.5 4 4 A A - 0 0 64 7,-0.2 7,-0.2 -2,-0.1 6,-0.0 -0.793 21.1-117.1-167.2 119.1 -8.5 7.3 -3.5 5 5 A C - 0 0 9 5,-1.3 14,-0.0 -2,-0.2 10,-0.0 -0.201 20.7-130.1 -55.8 144.8 -5.7 4.7 -3.0 6 6 A P S S+ 0 0 120 0, 0.0 -1,-0.1 0, 0.0 16,-0.0 0.665 108.0 35.6 -71.0 -16.5 -4.2 3.2 -6.3 7 7 A E S S+ 0 0 127 1,-0.1 -2,-0.0 3,-0.1 15,-0.0 0.834 120.3 38.0-102.1 -50.3 -4.7 -0.3 -4.9 8 8 A C S S- 0 0 18 2,-0.1 -1,-0.1 1,-0.1 18,-0.0 -0.638 73.2-124.8-105.3 164.0 -8.0 -0.1 -2.9 9 9 A P + 0 0 111 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 0.344 65.1 133.4 -84.1 3.5 -11.3 1.8 -3.5 10 10 A K - 0 0 80 1,-0.1 -5,-1.3 -6,-0.0 2,-0.6 -0.379 46.3-150.0 -61.5 128.2 -11.1 3.4 -0.1 11 11 A R - 0 0 161 -7,-0.2 -7,-0.2 -2,-0.1 2,-0.2 -0.899 15.9-172.3-105.8 116.0 -11.8 7.2 -0.3 12 12 A F - 0 0 35 -2,-0.6 -9,-2.0 -11,-0.1 -10,-1.3 -0.522 31.2-121.4-100.6 170.4 -10.0 9.3 2.3 13 13 A M S S+ 0 0 121 -12,-0.3 2,-0.3 -11,-0.2 -1,-0.1 0.852 93.7 27.7 -79.9 -37.3 -10.5 13.0 3.1 14 14 A R S >> S- 0 0 131 1,-0.1 3,-0.6 -12,-0.1 4,-0.6 -0.937 75.4-122.7-128.6 151.7 -6.8 14.0 2.4 15 15 A S H >> S+ 0 0 54 -2,-0.3 4,-2.8 1,-0.2 3,-1.3 0.876 114.2 55.8 -55.7 -41.6 -4.0 12.7 0.2 16 16 A D H 3> S+ 0 0 52 1,-0.3 4,-1.7 2,-0.2 5,-0.3 0.834 94.3 67.8 -62.0 -32.7 -1.8 12.2 3.3 17 17 A H H <4 S+ 0 0 73 -3,-0.6 4,-0.4 1,-0.2 -1,-0.3 0.789 114.0 30.7 -57.5 -26.9 -4.5 10.0 4.9 18 18 A L H S+ 0 0 30 -3,-0.4 4,-4.1 -4,-0.4 5,-0.3 0.800 106.9 59.3 -78.4 -32.7 -2.1 4.0 4.5 22 22 A I H X S+ 0 0 42 -4,-4.6 4,-3.8 2,-0.2 5,-0.3 0.941 97.9 57.2 -63.8 -48.3 -1.1 3.0 1.0 23 23 A T H < S+ 0 0 92 -4,-1.0 -1,-0.2 -5,-0.3 -2,-0.2 0.832 122.3 28.9 -51.5 -34.3 2.4 2.0 1.8 24 24 A L H >X>S+ 0 0 83 -4,-0.6 4,-1.8 -3,-0.2 5,-0.7 0.846 121.3 50.2 -93.6 -43.3 0.9 -0.5 4.3 25 25 A H H 3<5S+ 0 0 13 -4,-4.1 -3,-0.2 1,-0.3 -2,-0.2 0.832 107.4 56.6 -66.0 -29.9 -2.4 -1.2 2.6 26 26 A E T 3<5S+ 0 0 96 -4,-3.8 -1,-0.3 -5,-0.3 -2,-0.2 0.752 107.2 52.7 -71.3 -22.4 -0.5 -1.9 -0.6 27 27 A L T <45S- 0 0 113 -3,-0.7 -2,-0.2 -5,-0.3 -1,-0.1 0.989 140.5 -18.1 -74.3 -68.9 1.4 -4.5 1.4 28 28 A L T <5S- 0 0 168 -4,-1.8 -3,-0.2 2,-0.0 -2,-0.1 0.814 86.9-122.2-105.3 -53.9 -1.4 -6.6 2.9 29 29 A G < - 0 0 41 -5,-0.7 2,-0.8 1,-0.1 -4,-0.2 0.811 20.9-157.7 104.5 75.1 -4.5 -4.5 2.7 30 30 A E - 0 0 138 2,-0.0 2,-0.4 0, 0.0 -1,-0.1 -0.748 13.7-171.0 -87.6 111.4 -6.2 -3.8 6.1 31 31 A E - 0 0 86 -2,-0.8 0, 0.0 1,-0.1 0, 0.0 -0.823 22.7-147.9-105.0 142.1 -9.9 -2.9 5.6 32 32 A R 0 0 191 -2,-0.4 -1,-0.1 1,-0.0 -2,-0.0 0.947 360.0 360.0 -69.9 -50.6 -12.2 -1.7 8.3 33 33 A R 0 0 278 0, 0.0 -2,-0.1 0, 0.0 -1,-0.0 0.790 360.0 360.0-111.2 360.0 -15.4 -3.3 7.0