==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=31-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HORMONE 13-JUL-11 3ZU1 . COMPND 2 MOLECULE: INSULIN A CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR G.SCHLUCKEBIER,J.WHITTINGHAM . 98 4 6 2 4 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6306.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 67 68.4 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 . 8 8.2 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 . 4 4.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 10 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 44 44.9 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 2 2 0 0 0 0 0 0 0 0 0 0 0 0 2 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 . 2 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 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 74 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 178.6 -16.0 -10.5 -12.8 2 2 A I H > + 0 0 4 47,-0.3 4,-2.8 2,-0.2 5,-0.3 0.843 360.0 53.8 -57.6 -35.9 -14.5 -7.7 -10.8 3 3 A V H > S+ 0 0 17 46,-0.5 4,-2.0 2,-0.2 5,-0.3 0.944 110.8 45.3 -69.2 -44.0 -11.3 -7.8 -12.9 4 4 A E H 4 S+ 0 0 58 1,-0.2 4,-0.4 2,-0.2 -2,-0.2 0.920 122.2 37.8 -61.6 -44.8 -13.1 -7.5 -16.2 5 5 A Q H X S+ 0 0 118 -4,-2.6 4,-0.5 1,-0.1 -2,-0.2 0.878 126.9 31.6 -73.5 -38.4 -15.4 -4.7 -15.0 6 6 A a H < S+ 0 0 14 -4,-2.8 5,-0.4 -5,-0.2 -3,-0.2 0.503 112.1 55.1-111.8 -7.0 -13.0 -2.7 -12.8 7 7 A b T < S+ 0 0 42 -4,-2.0 -3,-0.1 -5,-0.3 -1,-0.1 0.580 114.3 43.4 -96.9 -5.2 -9.5 -3.1 -14.4 8 8 A T T 4 S+ 0 0 111 -4,-0.4 2,-0.3 -5,-0.3 -2,-0.2 0.624 126.7 21.9-108.0 -24.3 -10.8 -1.9 -17.8 9 9 A S S < S- 0 0 78 -4,-0.5 2,-0.7 -5,-0.1 -1,-0.3 -0.967 92.8 -97.7-134.8 154.5 -13.0 1.1 -16.5 10 10 A I - 0 0 172 -2,-0.3 2,-0.4 -3,-0.1 -3,-0.1 -0.664 40.6-146.0 -75.5 116.2 -12.7 3.0 -13.2 11 11 A a - 0 0 21 -2,-0.7 -5,-0.1 -5,-0.4 -1,-0.0 -0.704 10.4-131.7 -77.3 132.2 -15.3 1.4 -10.8 12 12 A S > - 0 0 52 -2,-0.4 4,-2.5 1,-0.1 5,-0.2 -0.233 28.1-105.2 -70.9 164.1 -17.0 3.8 -8.3 13 13 A L H > S+ 0 0 121 2,-0.2 4,-1.3 1,-0.2 -1,-0.1 0.844 124.0 55.9 -56.7 -38.6 -17.3 2.9 -4.7 14 14 A Y H 4 S+ 0 0 67 2,-0.2 4,-0.3 1,-0.2 -1,-0.2 0.901 109.4 46.2 -59.3 -44.2 -21.0 2.1 -5.4 15 15 A Q H >4 S+ 0 0 91 1,-0.2 3,-1.6 2,-0.2 -2,-0.2 0.882 109.2 53.9 -67.9 -40.4 -20.0 -0.3 -8.1 16 16 A L H >< S+ 0 0 8 -4,-2.5 3,-2.1 1,-0.3 -1,-0.2 0.820 93.5 72.1 -62.5 -25.5 -17.3 -1.9 -5.9 17 17 A E G >< S+ 0 0 87 -4,-1.3 3,-1.5 1,-0.3 -1,-0.3 0.663 79.4 75.9 -68.0 -17.2 -20.0 -2.5 -3.2 18 18 A N G < S+ 0 0 124 -3,-1.6 -1,-0.3 -4,-0.3 -2,-0.2 0.646 92.9 54.3 -64.6 -17.0 -21.4 -5.3 -5.5 19 19 A Y G < S+ 0 0 43 -3,-2.1 28,-1.9 -4,-0.2 -1,-0.3 0.225 84.0 109.7-103.1 11.1 -18.5 -7.5 -4.4 20 20 A c B < A 46 0A 13 -3,-1.5 26,-0.3 26,-0.2 25,-0.1 -0.516 360.0 360.0 -76.2 158.6 -19.1 -7.1 -0.7 21 21 A N 0 0 94 24,-2.0 -1,-0.1 78,-0.2 24,-0.1 -0.338 360.0 360.0 -78.7 360.0 -20.4 -10.1 1.3 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 0 116 0, 0.0 4,-2.3 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0 -31.5 -0.4 -10.2 -17.0 24 2 B V H > + 0 0 97 1,-0.2 4,-2.4 2,-0.2 5,-0.3 0.931 360.0 58.2 -60.3 -41.4 1.4 -8.0 -14.7 25 3 B N H > S+ 0 0 143 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.863 107.6 43.8 -58.1 -42.2 -1.1 -5.2 -15.2 26 4 B Q H > S+ 0 0 126 -3,-0.3 4,-2.7 1,-0.2 -1,-0.2 0.873 114.2 53.2 -67.7 -43.0 -4.2 -7.3 -14.1 27 5 B H H X S+ 0 0 86 -4,-2.3 4,-1.3 2,-0.2 -2,-0.2 0.918 112.3 42.9 -54.4 -45.9 -2.1 -8.6 -11.2 28 6 B L H X S+ 0 0 95 -4,-2.4 4,-1.4 2,-0.2 3,-0.3 0.934 112.3 54.0 -73.0 -37.8 -1.2 -5.0 -10.0 29 7 B b H X S+ 0 0 35 -4,-2.4 4,-2.7 -5,-0.3 3,-0.3 0.913 104.7 55.6 -57.2 -44.0 -4.8 -3.8 -10.6 30 8 B G H X S+ 0 0 0 -4,-2.7 4,-2.3 1,-0.3 -1,-0.2 0.861 100.7 57.8 -57.8 -39.3 -6.1 -6.6 -8.3 31 9 B S H X S+ 0 0 52 -4,-1.3 4,-1.4 -3,-0.3 -1,-0.3 0.886 110.8 42.3 -57.2 -49.8 -3.9 -5.5 -5.5 32 10 B H H X S+ 0 0 139 -4,-1.4 4,-2.4 -3,-0.3 -2,-0.2 0.887 112.5 55.6 -61.7 -42.6 -5.5 -2.0 -5.7 33 11 B L H X S+ 0 0 13 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.910 104.6 52.0 -59.1 -44.2 -9.0 -3.6 -6.1 34 12 B V H X S+ 0 0 2 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.897 109.6 49.0 -61.2 -44.8 -8.5 -5.6 -2.9 35 13 B E H X S+ 0 0 61 -4,-1.4 4,-2.0 1,-0.2 -1,-0.2 0.892 112.0 49.1 -64.1 -43.3 -7.6 -2.5 -0.8 36 14 B A H X S+ 0 0 27 -4,-2.4 4,-2.7 2,-0.2 5,-0.2 0.932 110.4 50.0 -65.7 -39.5 -10.6 -0.6 -2.2 37 15 B L H X S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 5,-0.2 0.908 107.0 56.1 -65.8 -37.2 -13.0 -3.5 -1.4 38 16 B Y H X S+ 0 0 19 -4,-2.4 4,-1.2 -5,-0.2 -1,-0.2 0.916 112.6 41.6 -57.8 -50.1 -11.5 -3.7 2.1 39 17 B L H < S+ 0 0 109 -4,-2.0 3,-0.3 1,-0.2 -2,-0.2 0.948 118.3 43.8 -66.9 -45.7 -12.4 0.0 2.6 40 18 B V H < S+ 0 0 34 -4,-2.7 -2,-0.2 1,-0.2 -3,-0.2 0.869 114.2 48.5 -72.1 -33.2 -15.9 0.0 1.0 41 19 B c H >< S+ 0 0 3 -4,-2.6 3,-2.1 -5,-0.2 4,-0.3 0.714 77.6 173.0 -79.2 -22.5 -17.1 -3.2 2.5 42 20 B G G >< S- 0 0 41 -4,-1.2 3,-1.2 -3,-0.3 -1,-0.2 -0.225 70.8 -2.0 48.9-132.8 -16.2 -2.6 6.2 43 21 B E G 3 S+ 0 0 95 1,-0.3 -1,-0.3 57,-0.1 -2,-0.1 0.632 126.9 68.7 -66.8 -15.2 -17.5 -5.3 8.5 44 22 B R G < S- 0 0 105 -3,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.815 88.8-155.5 -70.6 -31.8 -19.2 -7.2 5.7 45 23 B G < - 0 0 1 -3,-1.2 -24,-2.0 -4,-0.3 2,-0.3 -0.320 8.1-120.6 73.2-173.8 -16.0 -8.2 4.1 46 24 B F E -AB 20 99A 0 53,-1.2 53,-3.0 -26,-0.3 2,-0.4 -0.910 6.5-116.1-153.7 175.1 -15.8 -9.1 0.5 47 25 B F E - B 0 98A 59 -28,-1.9 2,-0.5 -2,-0.3 51,-0.2 -0.970 19.2-158.2-127.6 139.3 -14.9 -11.8 -1.9 48 26 B Y E + B 0 97A 4 49,-3.0 49,-1.8 -2,-0.4 -2,-0.0 -0.964 13.7 173.5-126.3 116.2 -12.1 -11.6 -4.4 49 27 B T 0 0 87 -2,-0.5 -46,-0.5 47,-0.2 -47,-0.3 -0.941 360.0 360.0-125.7 104.9 -12.2 -13.8 -7.4 50 28 B P 0 0 71 0, 0.0 44,-0.1 0, 0.0 -48,-0.0 0.209 360.0 360.0 -83.0 360.0 -9.5 -13.3 -10.1 51 !* 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 52 1 C G > 0 0 65 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0-115.5 -11.1 -15.9 12.5 53 2 C I H > + 0 0 5 47,-0.6 4,-3.6 1,-0.2 5,-0.3 0.890 360.0 47.7 -71.5 -39.9 -8.4 -14.1 10.6 54 3 C V H > S+ 0 0 8 46,-0.3 4,-1.9 2,-0.2 5,-0.2 0.944 114.4 44.5 -69.3 -48.5 -8.2 -10.8 12.5 55 4 C E H 4 S+ 0 0 113 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.939 121.7 42.4 -60.7 -44.8 -8.0 -12.4 16.0 56 5 C Q H X S+ 0 0 73 -4,-2.3 4,-0.8 1,-0.2 3,-0.3 0.944 124.5 29.9 -63.7 -52.4 -5.5 -14.9 14.7 57 6 C d H < S+ 0 0 13 -4,-3.6 5,-0.5 1,-0.2 -3,-0.2 0.487 113.8 56.1 -99.3 -3.9 -3.2 -12.7 12.5 58 7 C e T < S+ 0 0 44 -4,-1.9 -1,-0.2 -5,-0.3 -3,-0.1 0.445 109.9 48.6 -99.5 -3.6 -3.3 -9.3 14.2 59 8 C T T 4 S+ 0 0 113 -4,-0.4 2,-0.3 1,-0.3 -2,-0.2 0.658 125.6 15.6-103.5 -24.1 -2.2 -10.8 17.5 60 9 C S S < S- 0 0 81 -4,-0.8 2,-0.7 -5,-0.1 -1,-0.3 -0.970 93.7 -92.8-139.6 153.5 0.8 -12.9 16.1 61 10 C I - 0 0 167 -2,-0.3 2,-0.3 -3,-0.1 -3,-0.1 -0.577 40.8-147.0 -65.9 113.8 2.6 -12.7 12.8 62 11 C d - 0 0 16 -2,-0.7 2,-0.1 -5,-0.5 -5,-0.0 -0.688 12.5-136.3 -77.7 133.7 0.9 -15.2 10.5 63 12 C S > - 0 0 48 -2,-0.3 4,-2.4 1,-0.1 3,-0.2 -0.374 30.5 -99.2 -77.3 175.4 3.3 -16.8 8.1 64 13 C L H > S+ 0 0 113 1,-0.3 4,-1.5 2,-0.2 -1,-0.1 0.822 126.5 56.9 -69.7 -26.7 2.4 -17.2 4.4 65 14 C Y H 4 S+ 0 0 185 2,-0.2 4,-0.4 1,-0.2 -1,-0.3 0.893 107.1 46.6 -70.1 -40.6 1.5 -20.8 5.3 66 15 C Q H >4 S+ 0 0 76 -3,-0.2 3,-1.1 1,-0.2 -2,-0.2 0.900 112.5 51.1 -61.0 -41.8 -1.0 -19.7 8.0 67 16 C L H >< S+ 0 0 6 -4,-2.4 3,-2.5 1,-0.3 4,-0.3 0.862 96.5 69.0 -66.8 -30.7 -2.5 -17.2 5.7 68 17 C E G >< S+ 0 0 82 -4,-1.5 3,-1.3 1,-0.3 -1,-0.3 0.708 83.4 72.2 -67.1 -21.4 -2.9 -19.7 3.0 69 18 C N G < S+ 0 0 124 -3,-1.1 -1,-0.3 -4,-0.4 -2,-0.2 0.666 93.4 56.7 -60.7 -19.4 -5.6 -21.4 5.1 70 19 C Y G < S+ 0 0 63 -3,-2.5 28,-0.6 -4,-0.2 -1,-0.2 0.469 85.9 104.9 -96.0 -3.6 -7.9 -18.5 4.3 71 20 C f B < C 97 0A 16 -3,-1.3 26,-0.3 -4,-0.3 25,-0.1 -0.322 360.0 360.0 -68.4 158.9 -7.6 -19.0 0.5 72 21 C N 0 0 110 24,-2.5 -1,-0.1 -2,-0.0 -2,-0.1 -0.419 360.0 360.0 -74.8 360.0 -10.4 -20.5 -1.5 73 !* 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 74 1 D F > 0 0 185 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 165.5 -10.2 0.1 16.8 75 2 D V H > + 0 0 107 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.939 360.0 56.3 -61.2 -43.6 -7.9 1.8 14.5 76 3 D N H > S+ 0 0 124 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.874 109.6 45.4 -57.4 -40.7 -5.0 -0.7 15.0 77 4 D Q H > S+ 0 0 76 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.907 111.4 51.9 -68.1 -45.7 -7.2 -3.7 14.0 78 5 D H H X S+ 0 0 93 -4,-2.2 4,-1.1 2,-0.2 -2,-0.2 0.927 113.0 46.1 -52.4 -48.2 -8.7 -1.8 10.9 79 6 D L H X S+ 0 0 92 -4,-2.4 4,-1.4 -5,-0.2 3,-0.4 0.937 110.2 52.7 -65.1 -43.3 -5.1 -1.0 9.7 80 7 D e H X S+ 0 0 33 -4,-2.5 4,-2.3 1,-0.2 3,-0.4 0.904 105.4 57.2 -58.0 -45.2 -3.9 -4.6 10.3 81 8 D G H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.3 -1,-0.2 0.833 100.7 56.1 -52.1 -40.9 -6.8 -5.9 8.2 82 9 D S H X S+ 0 0 43 -4,-1.1 4,-1.3 -3,-0.4 -1,-0.3 0.907 110.2 43.9 -67.6 -37.8 -5.7 -3.8 5.3 83 10 D H H X S+ 0 0 140 -4,-1.4 4,-2.3 -3,-0.4 -2,-0.2 0.888 109.8 58.5 -65.7 -35.4 -2.3 -5.5 5.4 84 11 D L H X S+ 0 0 12 -4,-2.3 4,-2.6 1,-0.3 -2,-0.2 0.893 103.9 49.5 -64.6 -43.8 -3.9 -8.8 5.8 85 12 D V H X S+ 0 0 1 -4,-2.3 4,-2.2 1,-0.2 -1,-0.3 0.804 110.0 51.7 -66.0 -38.1 -5.9 -8.5 2.6 86 13 D E H X S+ 0 0 44 -4,-1.3 4,-1.9 -5,-0.2 -1,-0.2 0.907 110.9 47.8 -63.8 -43.2 -2.8 -7.6 0.6 87 14 D A H X S+ 0 0 31 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.930 112.7 48.9 -60.7 -46.8 -1.0 -10.6 2.1 88 15 D L H X S+ 0 0 0 -4,-2.6 4,-2.9 1,-0.2 5,-0.4 0.914 107.2 55.2 -58.8 -41.8 -3.9 -12.9 1.2 89 16 D Y H X S+ 0 0 17 -4,-2.2 4,-1.4 1,-0.2 -1,-0.2 0.915 113.2 42.9 -52.8 -50.5 -4.1 -11.4 -2.4 90 17 D L H < S+ 0 0 116 -4,-1.9 -2,-0.2 2,-0.2 -1,-0.2 0.909 119.2 41.3 -67.1 -43.8 -0.4 -12.4 -2.8 91 18 D V H < S+ 0 0 34 -4,-2.4 -2,-0.2 1,-0.2 -3,-0.2 0.893 115.1 48.4 -71.5 -41.2 -0.6 -15.9 -1.2 92 19 D f H >< S+ 0 0 4 -4,-2.9 3,-1.7 -5,-0.2 -1,-0.2 0.788 81.7 171.9 -78.7 -27.1 -3.9 -17.0 -2.7 93 20 D G G >< - 0 0 37 -4,-1.4 3,-1.3 -5,-0.4 -1,-0.2 -0.280 68.9 -4.6 57.3-137.0 -3.1 -16.0 -6.3 94 21 D E G 3 S+ 0 0 188 1,-0.3 -1,-0.2 -45,-0.1 -2,-0.1 0.651 127.4 72.0 -73.5 -6.0 -5.6 -17.1 -8.9 95 22 D R G < S- 0 0 121 -3,-1.7 -1,-0.3 1,-0.1 -2,-0.2 0.794 86.0-162.4 -70.0 -32.0 -7.5 -19.0 -6.2 96 23 D G < - 0 0 1 -3,-1.3 -24,-2.5 -7,-0.2 2,-0.3 -0.127 2.6-123.3 70.7-172.8 -8.9 -15.8 -4.5 97 24 D F E -BC 48 71A 1 -49,-1.8 -49,-3.0 -26,-0.3 2,-0.4 -0.987 6.1-123.1-162.9 155.6 -10.3 -15.5 -1.1 98 25 D F E -B 47 0A 105 -28,-0.6 2,-0.5 -2,-0.3 -51,-0.2 -0.903 27.5-152.9 -96.0 135.6 -13.2 -14.5 1.1 99 26 D Y E +B 46 0A 2 -53,-3.0 -53,-1.2 -2,-0.4 -78,-0.2 -0.983 21.8 166.3-112.5 122.0 -12.4 -11.9 3.6 100 27 D T 0 0 86 -2,-0.5 -47,-0.6 -55,-0.2 -46,-0.3 -0.982 360.0 360.0-135.9 119.6 -14.5 -11.9 6.7 101 28 D P 0 0 63 0, 0.0 -48,-0.1 0, 0.0 -58,-0.0 0.200 360.0 360.0 -91.3 360.0 -13.3 -9.9 9.8