==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HORMONE/GROWTH FACTOR 31-JAN-02 1KX6 . COMPND 2 MOLECULE: GLUCAGON; . SOURCE 2 SYNTHETIC: YES; . AUTHOR W.BRAUN,G.WIDER,K.H.LEE,K.WUTHRICH . 29 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 3763.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 8 27.6 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 . 2 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 3 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 3 10.3 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 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 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 H 0 0 239 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 96.8 -31.4 0.3 -22.3 2 2 A S - 0 0 119 0, 0.0 2,-0.3 0, 0.0 3,-0.1 -0.964 360.0-168.6-156.7 136.9 -28.5 0.4 -24.7 3 3 A Q + 0 0 189 -2,-0.3 0, 0.0 1,-0.1 0, 0.0 -0.815 50.4 75.5-124.2 164.5 -25.0 2.0 -24.7 4 4 A G - 0 0 60 -2,-0.3 -1,-0.1 7,-0.0 0, 0.0 0.871 69.3-135.7 98.6 60.6 -22.3 2.6 -27.2 5 5 A T - 0 0 89 1,-0.1 -2,-0.1 -3,-0.1 5,-0.0 0.116 13.3-122.2 -39.2 159.1 -23.5 5.4 -29.4 6 6 A F S S+ 0 0 197 3,-0.1 4,-0.2 4,-0.0 -1,-0.1 0.779 77.4 112.8 -78.6 -29.4 -23.0 5.0 -33.1 7 7 A T S > S+ 0 0 80 2,-0.1 3,-1.1 0, 0.0 0, 0.0 0.054 77.6 0.8 -41.1 153.4 -20.9 8.2 -33.4 8 8 A S T 3 S- 0 0 77 1,-0.2 5,-0.0 5,-0.0 0, 0.0 0.075 115.0 -57.1 52.7-171.9 -17.3 7.6 -34.3 9 9 A D T 3> S+ 0 0 117 3,-0.0 4,-0.6 4,-0.0 -1,-0.2 0.014 85.2 161.0 -89.3 27.2 -16.0 4.1 -34.9 10 10 A Y T <4 + 0 0 88 -3,-1.1 3,-0.2 -4,-0.2 -2,-0.0 0.145 30.6 75.4 -42.2 166.0 -17.2 3.2 -31.4 11 11 A S T 4 S- 0 0 102 1,-0.2 2,-2.0 0, 0.0 -7,-0.0 0.877 120.7 -17.2 86.0 91.2 -17.7 -0.5 -30.6 12 12 A K T 4 S+ 0 0 170 1,-0.2 -1,-0.2 2,-0.0 -2,-0.1 -0.378 119.1 88.2 82.6 -58.4 -14.4 -2.3 -30.1 13 13 A Y < + 0 0 139 -2,-2.0 -3,-0.2 -4,-0.6 -1,-0.2 0.809 58.9 113.6 -37.7 -39.8 -12.5 0.5 -31.8 14 14 A L + 0 0 115 -5,-0.2 2,-0.3 2,-0.0 -2,-0.0 -0.132 45.4 161.9 -41.2 113.5 -12.3 2.0 -28.3 15 15 A D + 0 0 142 1,-0.0 -2,-0.0 0, 0.0 -1,-0.0 -0.997 17.0 144.9-143.7 142.8 -8.6 1.8 -27.5 16 16 A S + 0 0 121 -2,-0.3 3,-0.1 1,-0.0 -2,-0.0 -0.292 23.5 124.8-178.7 81.8 -6.4 3.6 -25.0 17 17 A R + 0 0 192 1,-0.1 -1,-0.0 2,-0.1 0, 0.0 -0.291 16.0 149.5-142.2 50.5 -3.5 1.7 -23.4 18 18 A R S S+ 0 0 238 4,-0.0 4,-0.2 0, 0.0 -1,-0.1 0.937 72.5 43.4 -48.3 -57.2 -0.5 3.8 -24.1 19 19 A A S S+ 0 0 51 3,-0.1 3,-0.3 2,-0.1 -2,-0.1 0.586 71.9 107.0 -62.2-137.2 1.2 2.7 -20.9 20 20 A Q S S+ 0 0 114 1,-0.2 2,-1.8 2,-0.1 -3,-0.0 0.791 95.0 10.4 60.0 118.5 1.1 -0.9 -19.9 21 21 A D S > S+ 0 0 133 1,-0.2 3,-1.1 4,-0.0 -1,-0.2 -0.261 124.0 66.0 80.7 -49.9 4.3 -2.9 -20.3 22 22 A F T >> S+ 0 0 128 -2,-1.8 3,-2.1 -3,-0.3 4,-1.9 0.698 79.8 79.1 -73.9 -20.5 6.1 0.4 -21.0 23 23 A V H 3> S+ 0 0 34 1,-0.3 4,-1.1 2,-0.2 -1,-0.3 0.717 79.6 71.2 -59.1 -20.3 5.3 1.4 -17.4 24 24 A Q H <4 S+ 0 0 130 -3,-1.1 -1,-0.3 1,-0.2 4,-0.3 0.276 108.0 34.4 -79.5 11.6 8.3 -0.8 -16.6 25 25 A W H <4 S+ 0 0 206 -3,-2.1 3,-0.4 2,-0.1 -2,-0.2 0.582 115.7 49.1-127.8 -48.9 10.4 1.9 -18.2 26 26 A L H < S- 0 0 106 -4,-1.9 -3,-0.2 1,-0.2 -2,-0.2 0.620 144.1 -3.5 -70.5 -12.5 8.7 5.2 -17.3 27 27 A M S < S- 0 0 120 -4,-1.1 -1,-0.2 -5,-0.3 -2,-0.1 -0.131 78.2-162.3-178.7 67.0 8.6 3.8 -13.8 28 28 A N 0 0 99 -3,-0.4 -4,-0.1 -4,-0.3 -3,-0.1 -0.374 360.0 360.0 -61.0 131.6 10.0 0.3 -13.3 29 29 A T 0 0 168 -2,-0.1 -4,-0.1 0, 0.0 0, 0.0 -0.192 360.0 360.0 45.1 360.0 8.8 -1.1 -10.0