==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HORMONE/GROWTH FACTOR 24-SEP-04 1W8P . COMPND 2 MOLECULE: INSULIN A-CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR L.ZAKOWA,O.AU-ALVAREZ,E.J.DODSON,G.G.DODSON,A.M.BRZOZOWSKI . 296 12 18 6 12 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15296.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 196 66.2 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 . 18 6.1 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 . 5 1.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 34 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 134 45.3 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 3 7 1 1 0 0 0 0 0 0 0 0 0 0 6 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 . 6 2 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 . 1 2 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 60 0, 0.0 48,-0.2 0, 0.0 50,-0.1 0.000 360.0 360.0 360.0 130.7 34.3 -0.9 14.2 2 2 A I > + 0 0 4 46,-0.1 4,-3.5 48,-0.0 5,-0.3 -0.417 360.0 63.4 129.0 -43.2 30.8 -2.1 13.4 3 3 A V H > S+ 0 0 16 2,-0.2 4,-1.5 3,-0.2 5,-0.3 0.902 105.1 47.1 -72.1 -44.6 31.2 -3.9 10.1 4 4 A E H > S+ 0 0 113 2,-0.1 4,-0.6 3,-0.1 -1,-0.2 0.952 123.3 36.9 -57.7 -47.2 33.6 -6.5 11.6 5 5 A Q H > S+ 0 0 61 1,-0.2 4,-0.9 2,-0.1 -2,-0.2 0.966 125.8 31.1 -72.0 -56.4 31.1 -7.0 14.4 6 6 A a H < S+ 0 0 7 -4,-3.5 5,-0.4 1,-0.2 -3,-0.2 0.495 115.8 53.5 -94.2 -7.5 27.7 -6.7 12.9 7 7 A b H < S+ 0 0 25 -4,-1.5 120,-0.2 -5,-0.3 -1,-0.2 0.597 111.3 44.8 -99.3 -14.6 28.2 -8.1 9.4 8 8 A T H < S+ 0 0 86 -4,-0.6 2,-0.3 -5,-0.3 119,-0.2 0.678 129.9 15.6 -96.6 -22.9 29.8 -11.4 10.5 9 9 A S S < S- 0 0 66 -4,-0.9 -1,-0.3 -5,-0.1 2,-0.2 -0.989 92.4 -92.0-143.8 154.4 27.1 -11.9 13.2 10 10 A I - 0 0 88 -2,-0.3 2,-0.4 -3,-0.1 -3,-0.1 -0.400 37.3-149.7 -62.3 121.3 23.7 -10.4 13.9 11 11 A a - 0 0 15 -5,-0.4 -1,-0.1 -2,-0.2 2,-0.0 -0.791 12.2-129.9 -90.4 136.5 23.8 -7.4 16.3 12 12 A S > - 0 0 57 -2,-0.4 4,-1.3 1,-0.1 5,-0.1 -0.312 29.3-106.3 -70.5 168.5 20.9 -6.8 18.6 13 13 A L H > S+ 0 0 21 2,-0.2 4,-1.8 1,-0.2 -1,-0.1 0.748 125.1 53.5 -64.0 -27.2 19.4 -3.2 18.7 14 14 A Y H > S+ 0 0 116 2,-0.2 4,-0.6 1,-0.2 -1,-0.2 0.819 105.6 52.2 -86.5 -29.0 21.0 -2.8 22.0 15 15 A Q H 4 S+ 0 0 72 2,-0.2 3,-0.3 1,-0.2 4,-0.2 0.796 111.0 48.5 -65.0 -31.7 24.3 -3.8 20.5 16 16 A L H >< S+ 0 0 10 -4,-1.3 3,-2.1 1,-0.2 -2,-0.2 0.845 95.1 74.2 -80.0 -30.9 23.7 -1.2 17.9 17 17 A E H >< S+ 0 0 53 -4,-1.8 3,-1.3 1,-0.3 -1,-0.2 0.773 85.0 67.3 -44.8 -37.3 22.8 1.4 20.7 18 18 A N T 3< S+ 0 0 119 -4,-0.6 -1,-0.3 -3,-0.3 -2,-0.2 0.792 92.6 60.2 -50.3 -36.0 26.6 1.6 21.5 19 19 A Y T < S+ 0 0 67 -3,-2.1 28,-0.7 -4,-0.2 2,-0.3 0.391 83.0 127.5 -92.1 1.2 27.3 3.2 18.1 20 20 A c < 0 0 13 -3,-1.3 26,-0.2 -4,-0.2 25,-0.1 -0.720 360.0 360.0 -75.2 143.8 25.2 6.3 18.7 21 21 A N 0 0 102 24,-0.4 25,-0.2 -2,-0.3 -1,-0.2 -0.784 360.0 360.0-161.1 360.0 25.9 9.2 18.4 22 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 23 1 B F > 0 0 171 0, 0.0 4,-1.4 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 121.6 33.5 -6.5 -1.5 24 2 B V H > + 0 0 9 189,-1.2 4,-2.7 1,-0.2 5,-0.2 0.861 360.0 61.7 -63.7 -42.6 29.8 -6.2 -2.4 25 3 B N H > S+ 0 0 119 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.889 107.3 43.8 -54.4 -45.2 28.5 -8.2 0.6 26 4 B Q H > S+ 0 0 105 -3,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.839 112.7 54.5 -65.8 -36.9 30.0 -5.8 3.2 27 5 B H H X S+ 0 0 47 -4,-1.4 4,-1.5 2,-0.2 -2,-0.2 0.947 110.1 44.4 -60.7 -49.6 28.8 -2.9 1.1 28 6 B L H X S+ 0 0 25 -4,-2.7 4,-1.4 2,-0.2 -2,-0.2 0.875 113.0 53.3 -61.0 -44.6 25.2 -4.2 1.1 29 7 B b H X S+ 0 0 6 -4,-2.2 4,-2.0 -5,-0.2 -2,-0.2 0.893 103.7 55.4 -56.1 -50.1 25.5 -4.9 4.8 30 8 B G H X S+ 0 0 1 -4,-2.6 4,-2.6 2,-0.2 5,-0.2 0.885 103.9 56.6 -43.7 -44.8 26.6 -1.3 5.5 31 9 B S H X S+ 0 0 2 -4,-1.5 4,-1.3 1,-0.2 -1,-0.2 0.916 109.6 43.0 -62.7 -43.1 23.4 -0.0 3.8 32 10 B H H X S+ 0 0 22 -4,-1.4 4,-2.4 2,-0.2 -1,-0.2 0.830 112.6 54.7 -67.7 -33.2 21.2 -2.1 6.2 33 11 B L H X S+ 0 0 14 -4,-2.0 4,-3.1 2,-0.2 5,-0.2 0.941 106.2 50.8 -67.3 -42.7 23.4 -1.0 9.2 34 12 B V H X S+ 0 0 0 -4,-2.6 4,-1.8 1,-0.2 -1,-0.2 0.861 111.2 48.1 -65.1 -37.9 22.9 2.7 8.4 35 13 B E H X S+ 0 0 39 -4,-1.3 4,-1.7 -5,-0.2 -1,-0.2 0.921 112.1 49.3 -63.2 -50.1 19.2 2.3 8.2 36 14 B A H X S+ 0 0 7 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.917 111.2 49.7 -59.1 -44.1 19.1 0.3 11.5 37 15 B L H X S+ 0 0 1 -4,-3.1 4,-2.9 1,-0.2 5,-0.3 0.887 105.7 57.0 -59.2 -42.1 21.2 3.0 13.2 38 16 B Y H X S+ 0 0 26 -4,-1.8 4,-0.9 -5,-0.2 -1,-0.2 0.913 112.6 41.2 -57.0 -41.8 18.9 5.7 11.9 39 17 B L H < S+ 0 0 32 -4,-1.7 129,-0.3 2,-0.2 -2,-0.2 0.920 119.4 42.3 -73.3 -43.6 16.0 4.0 13.6 40 18 B V H < S+ 0 0 13 -4,-2.5 -2,-0.2 1,-0.2 -3,-0.2 0.900 117.9 45.1 -68.2 -43.3 17.8 3.1 17.0 41 19 B c H >< S+ 0 0 3 -4,-2.9 3,-1.4 -5,-0.2 4,-0.4 0.574 79.1 173.6 -88.0 -16.3 19.6 6.5 17.4 42 20 B G G >< - 0 0 37 -4,-0.9 3,-1.9 -5,-0.3 -1,-0.2 -0.034 68.5 -4.8 46.6-137.1 16.9 8.9 16.6 43 21 B E G 3 S+ 0 0 175 1,-0.3 -1,-0.2 58,-0.1 -2,-0.1 0.709 125.0 70.9 -68.8 -21.3 17.7 12.5 17.2 44 22 B R G < S- 0 0 110 -3,-1.4 -1,-0.3 1,-0.1 -23,-0.2 0.705 86.6-163.1 -59.6 -24.7 21.1 11.8 18.6 45 23 B G < - 0 0 0 -3,-1.9 -24,-0.4 -4,-0.4 2,-0.3 -0.169 2.2-132.5 63.0-160.1 22.4 10.7 15.2 46 24 B F E -A 100 0A 1 54,-1.4 54,-0.5 -25,-0.2 2,-0.5 -0.958 8.8-110.0-179.5 166.4 25.6 8.6 14.7 47 25 B Y E -A 99 0A 97 -28,-0.7 2,-0.8 -2,-0.3 52,-0.1 -0.973 20.0-159.1-122.1 124.1 28.8 8.5 12.7 48 26 B F + 0 0 4 50,-0.6 50,-0.3 -2,-0.5 -46,-0.1 -0.749 17.8 169.1-106.6 87.4 29.3 5.8 10.2 49 27 B T - 0 0 77 -2,-0.8 47,-0.1 -48,-0.2 46,-0.1 -0.863 11.5-178.3 -93.3 115.2 33.0 5.3 9.5 50 28 B P 0 0 36 0, 0.0 -1,-0.1 0, 0.0 46,-0.1 0.460 360.0 360.0 -87.5 -2.0 33.5 2.1 7.4 51 29 B K 0 0 123 44,-0.3 -2,-0.1 -50,-0.1 45,-0.0 -0.076 360.0 360.0 -44.7 360.0 37.4 2.6 7.5 52 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 53 1 C G > 0 0 52 0, 0.0 4,-1.8 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0-133.3 20.9 20.7 9.5 54 2 C I H > + 0 0 4 47,-0.2 4,-2.9 1,-0.2 5,-0.3 0.864 360.0 61.2 -70.7 -37.2 20.7 18.2 6.7 55 3 C V H > S+ 0 0 16 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.899 111.5 38.5 -63.7 -40.4 17.2 16.9 7.4 56 4 C E H > S+ 0 0 96 -3,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.862 118.2 50.1 -71.8 -39.0 15.5 20.4 6.9 57 5 C Q H X S+ 0 0 125 -4,-1.8 4,-0.7 1,-0.2 -2,-0.2 0.892 124.7 26.9 -64.5 -38.9 17.8 21.3 3.9 58 6 C d H < S+ 0 0 10 -4,-2.9 5,-0.3 2,-0.2 -2,-0.2 0.519 119.8 51.3-109.5 -6.6 17.2 18.0 2.0 59 7 C e H < S+ 0 0 13 -4,-1.3 -3,-0.2 -5,-0.3 -2,-0.1 0.432 107.4 56.6-106.4 -2.9 13.8 16.8 3.1 60 8 C T H < S- 0 0 95 -4,-0.6 2,-0.3 1,-0.4 221,-0.3 0.810 129.9 -2.4 -87.8 -44.1 12.3 20.3 2.3 61 9 C S S < S- 0 0 67 -4,-0.7 -1,-0.4 -5,-0.2 2,-0.1 -0.936 94.5 -88.0-138.2 163.9 13.5 20.1 -1.3 62 10 C I - 0 0 74 -2,-0.3 2,-0.5 -3,-0.1 -3,-0.1 -0.386 38.5-140.5 -72.2 145.2 15.6 17.4 -3.0 63 11 C d - 0 0 16 -5,-0.3 -5,-0.1 -2,-0.1 -1,-0.0 -0.912 16.1-128.2-106.1 140.6 19.3 17.8 -2.7 64 12 C S > - 0 0 58 -2,-0.5 4,-2.1 1,-0.1 5,-0.1 -0.197 31.4 -97.9 -74.0 176.3 21.4 16.9 -5.7 65 13 C L H > S+ 0 0 55 2,-0.2 4,-2.0 1,-0.2 -1,-0.1 0.875 125.3 51.4 -60.9 -41.1 24.3 14.6 -5.5 66 14 C Y H > S+ 0 0 179 2,-0.2 4,-0.7 1,-0.2 -1,-0.2 0.928 109.2 50.7 -66.4 -40.9 26.8 17.5 -5.2 67 15 C Q H >4 S+ 0 0 103 1,-0.2 3,-0.6 2,-0.2 4,-0.2 0.886 108.7 51.9 -65.8 -40.1 24.8 19.0 -2.4 68 16 C L H >< S+ 0 0 7 -4,-2.1 3,-2.2 1,-0.2 -1,-0.2 0.881 98.9 64.3 -56.8 -43.1 24.8 15.7 -0.6 69 17 C E H >< S+ 0 0 80 -4,-2.0 3,-1.6 1,-0.3 -1,-0.2 0.744 83.9 78.7 -54.8 -26.0 28.6 15.5 -0.9 70 18 C N T << S+ 0 0 110 -4,-0.7 -1,-0.3 -3,-0.6 -2,-0.2 0.809 93.3 49.8 -47.5 -31.8 28.6 18.6 1.3 71 19 C Y T < S+ 0 0 47 -3,-2.2 28,-3.0 -4,-0.2 -1,-0.2 0.283 88.3 99.8-104.1 5.9 28.1 16.2 4.3 72 20 C f B < B 98 0B 15 -3,-1.6 26,-0.3 26,-0.3 25,-0.1 -0.584 360.0 360.0 -77.5 154.7 30.8 13.6 3.6 73 21 C N 0 0 116 24,-1.6 23,-0.1 -2,-0.2 -1,-0.1 -0.441 360.0 360.0 -79.0 360.0 34.1 13.7 5.4 74 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 75 1 D F > 0 0 188 0, 0.0 4,-1.2 0, 0.0 3,-0.4 0.000 360.0 360.0 360.0 101.6 5.9 14.5 11.3 76 2 D V H > + 0 0 8 86,-0.4 4,-3.7 1,-0.2 5,-0.3 0.701 360.0 81.6 -65.5 -20.3 6.6 11.0 10.1 77 3 D N H > S+ 0 0 111 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.936 100.1 31.0 -41.7 -62.5 7.0 12.9 6.8 78 4 D Q H > S+ 0 0 68 -3,-0.4 4,-2.6 2,-0.2 -1,-0.2 0.808 115.4 61.1 -75.5 -29.5 10.5 14.0 7.6 79 5 D H H X S+ 0 0 45 -4,-1.2 4,-1.1 2,-0.2 -2,-0.2 0.943 109.5 42.4 -62.3 -48.6 11.1 10.8 9.6 80 6 D L H >X S+ 0 0 27 -4,-3.7 4,-1.3 1,-0.2 3,-0.7 0.945 114.3 51.7 -59.1 -53.0 10.5 8.7 6.4 81 7 D e H 3X S+ 0 0 9 -4,-2.3 4,-2.5 -5,-0.3 3,-0.5 0.898 103.6 58.2 -47.1 -45.4 12.5 11.1 4.3 82 8 D G H 3X S+ 0 0 0 -4,-2.6 4,-2.0 1,-0.3 -1,-0.2 0.834 100.4 57.1 -60.8 -32.2 15.4 10.9 6.7 83 9 D S H < S+ 0 0 3 -4,-2.9 3,-1.4 -5,-0.2 -1,-0.2 0.738 81.5 171.0 -82.3 -21.4 30.2 9.3 0.6 94 20 D G G >< S- 0 0 33 -4,-1.2 3,-1.7 -5,-0.3 -1,-0.2 -0.155 70.4 -1.1 45.9-134.8 31.5 5.8 0.2 95 21 D E G 3 S+ 0 0 156 1,-0.3 -44,-0.3 -45,-0.1 -1,-0.3 0.809 125.6 70.3 -53.7 -34.0 34.6 5.1 2.2 96 22 D R G < S- 0 0 117 -3,-1.4 -1,-0.3 1,-0.1 -2,-0.2 0.695 89.0-149.7 -55.4 -27.7 34.8 8.7 3.6 97 23 D G < - 0 0 1 -3,-1.7 -24,-1.6 -7,-0.2 2,-0.3 -0.185 14.7-110.1 68.9-175.0 31.7 8.3 5.8 98 24 D F B -B 72 0B 2 -50,-0.3 2,-0.7 -26,-0.3 -50,-0.6 -0.938 12.2-103.3-155.1 164.7 29.5 11.3 6.6 99 25 D Y E +A 47 0A 117 -28,-3.0 2,-0.4 -2,-0.3 -52,-0.1 -0.874 34.1 176.9 -97.9 112.6 28.3 13.8 9.2 100 26 D F E +A 46 0A 0 -2,-0.7 -54,-1.4 -54,-0.5 -79,-0.1 -0.725 22.4 138.8-123.4 84.9 24.8 12.9 10.5 101 27 D T 0 0 56 -2,-0.4 -47,-0.2 -56,-0.2 -56,-0.1 -0.808 360.0 360.0-118.7 81.1 23.8 15.3 13.3 102 28 D P 0 0 68 0, 0.0 -57,-0.1 0, 0.0 -2,-0.0 0.114 360.0 360.0 -45.7 360.0 20.1 16.1 12.6 103 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 104 1 E G > 0 0 53 0, 0.0 4,-1.5 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0-162.5 9.8 -21.3 8.1 105 2 E I H > + 0 0 7 47,-0.2 4,-2.8 1,-0.2 5,-0.3 0.910 360.0 52.7 -62.7 -42.4 9.4 -18.5 5.5 106 3 E V H > S+ 0 0 16 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.906 108.7 49.2 -62.7 -39.9 13.0 -17.3 5.9 107 4 E E H 4 S+ 0 0 83 1,-0.2 4,-0.4 46,-0.2 -1,-0.2 0.846 117.2 44.1 -64.7 -34.1 14.5 -20.8 5.3 108 5 E Q H X S+ 0 0 121 -4,-1.5 4,-0.6 2,-0.1 -2,-0.2 0.864 122.6 30.5 -82.7 -41.0 12.3 -21.2 2.2 109 6 E g H < S+ 0 0 7 -4,-2.8 5,-0.5 2,-0.1 -2,-0.2 0.518 118.9 52.4-106.1 -4.1 12.6 -17.8 0.5 110 7 E h T < S+ 0 0 7 -4,-1.7 -3,-0.2 -5,-0.3 -2,-0.1 0.467 107.1 50.5-108.1 -4.1 16.1 -16.9 1.6 111 8 E T T 4 S+ 0 0 99 -4,-0.4 2,-0.3 1,-0.4 118,-0.3 0.732 130.3 8.3 -96.7 -26.7 17.8 -20.1 0.4 112 9 E S S < S- 0 0 71 -4,-0.6 2,-0.5 -5,-0.1 -1,-0.4 -0.968 94.3 -91.3-145.3 157.9 16.2 -19.8 -3.0 113 10 E I - 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