==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER DE NOVO PROTEIN 18-APR-09 2KI0 . COMPND 2 MOLECULE: DS119; . SOURCE 2 SYNTHETIC: YES; . AUTHOR H.LIANG,H.CHEN,K.FAN,P.WEI,X.GUO,C.JIN,C.ZENG,C.TANG,L.LAI . 36 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 3266.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 18 50.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 5.6 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 . 2 5.6 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+3), SAME NUMBER PER 100 RESIDUES . 11 30.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 2.8 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 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 RESIDUES PER ALPHA HELIX . 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 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 G 0 0 134 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 112.0 9.8 -5.9 -7.5 2 2 A S + 0 0 137 2,-0.0 2,-0.3 4,-0.0 3,-0.1 -0.204 360.0 134.7 -60.6 154.8 9.2 -5.6 -3.7 3 3 A G - 0 0 44 1,-0.2 -1,-0.0 2,-0.1 0, 0.0 -0.955 66.6 -79.7-179.9-179.0 12.3 -5.4 -1.3 4 4 A Q S S+ 0 0 128 -2,-0.3 -1,-0.2 2,-0.0 25,-0.1 0.977 104.1 79.9 -63.8 -55.6 13.6 -3.5 1.7 5 5 A V + 0 0 83 24,-0.1 2,-0.3 -3,-0.1 -2,-0.1 -0.275 58.9 144.4 -63.9 137.0 14.6 -0.4 -0.3 6 6 A R - 0 0 153 24,-0.1 24,-1.2 -4,-0.1 2,-0.3 -0.871 37.7-123.0-159.6 176.7 11.7 2.0 -1.1 7 7 A T - 0 0 85 -2,-0.3 2,-0.2 22,-0.1 24,-0.1 -0.923 15.9-147.9-139.9 155.6 11.1 5.7 -1.4 8 8 A I - 0 0 25 -2,-0.3 23,-0.0 2,-0.1 -2,-0.0 -0.719 14.1-165.5-121.0 167.4 8.7 8.2 0.3 9 9 A W + 0 0 172 -2,-0.2 2,-0.2 22,-0.0 24,-0.1 -0.243 33.5 158.0-147.3 43.4 6.8 11.4 -0.8 10 10 A V B -a 33 0A 16 22,-0.6 24,-2.3 1,-0.1 2,-0.3 -0.486 47.9-127.8 -75.3 150.4 5.7 12.8 2.6 11 11 A G - 0 0 33 22,-0.2 -1,-0.1 -2,-0.2 22,-0.1 -0.143 58.8 -91.7 -88.1 33.7 4.8 16.5 3.1 12 12 A G + 0 0 25 -2,-0.3 -1,-0.1 1,-0.2 21,-0.1 0.839 59.9 179.2 61.4 38.5 7.2 16.7 6.1 13 13 A T > - 0 0 65 1,-0.1 4,-3.0 2,-0.0 3,-0.4 -0.556 37.4-122.8 -62.8 136.1 4.5 15.9 8.8 14 14 A P H > S+ 0 0 109 0, 0.0 4,-0.7 0, 0.0 -1,-0.1 0.812 113.2 51.4 -51.3 -32.9 6.3 16.0 12.3 15 15 A E H > S+ 0 0 133 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.893 112.4 43.4 -73.5 -39.2 5.2 12.3 12.8 16 16 A E H >>S+ 0 0 68 -3,-0.4 4,-2.1 1,-0.2 5,-0.8 0.898 109.2 57.8 -77.1 -36.2 6.5 11.1 9.4 17 17 A L H <5S+ 0 0 75 -4,-3.0 -1,-0.2 3,-0.2 -2,-0.2 0.743 115.4 39.7 -59.4 -26.6 9.8 13.1 10.0 18 18 A K H X5S+ 0 0 158 -4,-0.7 4,-2.1 -5,-0.3 -2,-0.2 0.931 122.1 36.3 -83.8 -63.9 10.1 11.0 13.2 19 19 A K H X5S+ 0 0 126 -4,-2.9 4,-2.1 1,-0.2 -3,-0.2 0.902 120.9 43.2 -61.8 -49.2 9.0 7.5 12.1 20 20 A L H X5S+ 0 0 47 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.852 111.6 54.3 -75.8 -30.3 10.4 7.4 8.6 21 21 A K H >