==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ANTAGONIST 11-MAY-01 1IN2 . COMPND 2 MOLECULE: IGFBP-1 ANTAGONIST; . SOURCE 2 SYNTHETIC: YES; . AUTHOR N.J.SKELTON,Y.M.CHEN,N.DUBREE,C.QUAN,D.Y.JACKSON,A.G.COCHRAN . 14 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 1528.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 9 64.3 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 . 3 21.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 1 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 5 35.7 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+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 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 2 A R 0 0 188 0, 0.0 2,-1.8 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 85.6 5.5 8.9 -11.4 2 3 A A + 0 0 121 1,-0.2 0, 0.0 2,-0.0 0, 0.0 -0.432 360.0 24.8 -82.6 61.2 2.7 11.5 -10.9 3 4 A G S > S- 0 0 35 -2,-1.8 2,-2.2 2,-0.0 3,-1.2 0.336 72.4-155.2 142.1 75.7 0.6 9.1 -8.7 4 5 A P T 3 S+ 0 0 89 0, 0.0 -2,-0.0 0, 0.0 0, 0.0 -0.465 81.8 69.6 -75.1 76.0 2.6 6.3 -6.9 5 6 A L T 3> S+ 0 0 111 -2,-2.2 4,-2.5 3,-0.0 5,-0.2 0.322 77.2 68.6-156.8 -47.6 -0.3 4.0 -6.7 6 7 A Q H <> S+ 0 0 110 -3,-1.2 4,-2.2 1,-0.2 5,-0.2 0.905 102.7 48.8 -55.5 -47.2 -1.2 2.7 -10.2 7 8 A W H > S+ 0 0 104 -4,-0.4 4,-2.5 1,-0.2 -1,-0.2 0.866 110.8 51.2 -62.0 -38.4 2.1 0.7 -10.4 8 9 A L H > S+ 0 0 40 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.903 108.2 52.0 -64.7 -42.4 1.3 -0.8 -6.9 9 10 A A H X S+ 0 0 26 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.923 112.4 45.5 -60.1 -45.5 -2.2 -1.8 -8.1 10 11 A E H < S+ 0 0 116 -4,-2.2 -2,-0.2 2,-0.2 -1,-0.2 0.925 112.6 51.7 -58.7 -47.9 -0.7 -3.6 -11.2 11 12 A K H < S+ 0 0 141 -4,-2.5 3,-0.4 1,-0.2 -2,-0.2 0.891 109.6 48.8 -58.3 -45.0 1.9 -5.2 -8.9 12 13 A Y H < S+ 0 0 165 -4,-2.7 2,-2.0 1,-0.3 -1,-0.2 0.937 106.9 56.7 -61.0 -48.8 -0.7 -6.5 -6.5 13 14 A Q < 0 0 174 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.1 -0.419 360.0 360.0 -79.5 61.2 -2.7 -7.9 -9.5 14 15 A G 0 0 108 -2,-2.0 -2,-0.2 -3,-0.4 -1,-0.2 0.003 360.0 360.0-176.2 360.0 0.3 -9.9 -10.5