==== 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 1GJG . 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 . 12 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 1540.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 6 50.0 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 4 33.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 16.7 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 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 4 A R 0 0 279 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 143.8 3.8 9.4 -6.3 2 5 A P - 0 0 91 0, 0.0 4,-0.2 0, 0.0 0, 0.0 -0.478 360.0-179.3 -69.5 128.1 2.8 6.8 -8.9 3 6 A L > + 0 0 108 -2,-0.2 4,-2.8 2,-0.1 3,-0.5 0.592 66.9 88.1 -90.5 -20.1 0.8 3.8 -7.6 4 7 A Q H > S+ 0 0 130 1,-0.3 4,-2.6 2,-0.2 5,-0.2 0.884 87.4 46.7 -49.2 -53.8 0.6 2.2 -11.1 5 8 A W H > S+ 0 0 124 2,-0.2 4,-2.6 1,-0.2 -1,-0.3 0.866 115.5 47.5 -56.6 -39.9 3.9 0.2 -10.8 6 9 A L H >>S+ 0 0 48 -3,-0.5 4,-2.2 -4,-0.2 5,-0.8 0.947 111.8 49.3 -68.4 -50.7 2.8 -1.0 -7.3 7 10 A A H <>S+ 0 0 30 -4,-2.8 5,-2.3 1,-0.2 -2,-0.2 0.903 117.4 41.6 -50.4 -52.1 -0.7 -2.0 -8.4 8 11 A E H <5S+ 0 0 107 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.923 118.4 45.1 -64.1 -50.7 0.8 -3.9 -11.4 9 12 A K H <5S+ 0 0 130 -4,-2.6 -2,-0.2 -5,-0.2 -3,-0.2 0.965 126.9 15.0 -64.2 -63.7 3.7 -5.5 -9.5 10 13 A Y T <5S+ 0 0 144 -4,-2.2 -3,-0.2 -5,-0.2 -2,-0.1 0.962 131.0 36.0 -84.0 -59.0 2.3 -6.8 -6.2 11 14 A F T < 0 0 175 -5,-0.8 -3,-0.2 1,-0.3 -4,-0.1 0.940 360.0 360.0 -69.9 -49.1 -1.5 -6.9 -6.4 12 15 A Q < 0 0 174 -5,-2.3 -1,-0.3 -6,-0.2 -2,-0.1 -0.127 360.0 360.0 -94.9 360.0 -1.8 -7.9 -10.1