==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-OCT-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HORMONE 31-DEC-10 3Q6E . COMPND 2 MOLECULE: INSULIN A CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.M.CHINAI,A.B.TAYLOR,N.D.HARGREAVES,L.M.RYNO,C.A.MORRIS,P.J . 101 4 6 2 4 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6051.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 65 64.4 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 7.9 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 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 15.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 31 30.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 3.0 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 3 0 1 0 0 0 2 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 . 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 64 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0-148.1 1.0 6.0 -22.8 2 2 A I H > + 0 0 8 47,-0.3 4,-2.3 2,-0.2 5,-0.3 0.921 360.0 55.2 -71.7 -49.1 0.4 4.8 -19.2 3 3 A V H 4 S+ 0 0 19 46,-0.4 27,-0.2 1,-0.2 -1,-0.2 0.813 117.6 40.0 -54.2 -31.6 -3.3 5.7 -18.9 4 4 A E H >> S+ 0 0 74 47,-0.1 4,-2.8 3,-0.1 3,-1.0 0.952 115.8 47.0 -82.1 -55.3 -3.9 3.7 -22.0 5 5 A Q H 3X S+ 0 0 90 -4,-2.5 4,-3.5 1,-0.3 -2,-0.2 0.903 109.9 49.7 -57.5 -52.6 -1.7 0.7 -21.5 6 6 A a H 3< S+ 0 0 1 -4,-2.3 22,-2.9 1,-0.2 5,-0.3 0.636 116.4 46.0 -66.8 -14.3 -2.6 -0.1 -17.9 7 7 A b H <4 S+ 0 0 38 -3,-1.0 -2,-0.2 -5,-0.3 -1,-0.2 0.894 121.1 32.7 -89.5 -54.6 -6.2 0.0 -18.8 8 8 A T H < S+ 0 0 104 -4,-2.8 -2,-0.2 20,-0.1 -3,-0.2 0.871 134.8 16.5 -74.0 -37.0 -6.2 -2.0 -22.1 9 9 A S S < S- 0 0 63 -4,-3.5 2,-0.5 -5,-0.4 19,-0.4 -0.370 94.2 -88.6-113.2-160.5 -3.4 -4.3 -20.9 10 10 A I - 0 0 77 -2,-0.1 2,-0.3 17,-0.1 17,-0.1 -0.970 35.1-153.6-119.8 120.7 -1.9 -5.1 -17.5 11 11 A a - 0 0 15 -2,-0.5 14,-0.5 15,-0.5 15,-0.3 -0.651 15.9-123.3 -88.4 144.8 1.0 -3.1 -16.2 12 12 A S >> - 0 0 52 -2,-0.3 4,-1.3 1,-0.1 3,-0.6 -0.421 32.6-105.8 -74.7 162.8 3.6 -4.4 -13.7 13 13 A L H 3> S+ 0 0 89 1,-0.2 4,-2.4 2,-0.2 3,-0.4 0.897 119.8 57.7 -55.1 -43.7 4.0 -2.4 -10.5 14 14 A Y H 3> S+ 0 0 154 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.827 99.6 57.9 -66.0 -26.4 7.3 -0.9 -11.7 15 15 A Q H <4 S+ 0 0 55 -3,-0.6 3,-0.3 2,-0.2 -1,-0.2 0.906 110.2 44.8 -65.4 -39.6 5.6 0.6 -14.7 16 16 A L H >< S+ 0 0 5 -4,-1.3 3,-2.3 -3,-0.4 -2,-0.2 0.929 106.8 58.4 -65.1 -46.3 3.2 2.5 -12.3 17 17 A E H >< S+ 0 0 80 -4,-2.4 3,-1.4 1,-0.3 -1,-0.2 0.680 88.0 75.8 -65.7 -16.3 6.0 3.5 -10.0 18 18 A N T 3< S+ 0 0 110 -4,-0.9 -1,-0.3 -3,-0.3 -2,-0.2 0.611 92.1 56.9 -64.7 -13.7 7.7 5.3 -12.9 19 19 A Y T < S+ 0 0 58 -3,-2.3 28,-2.0 -4,-0.1 -1,-0.2 0.370 79.7 108.3-102.8 3.7 5.1 8.0 -12.5 20 20 A c B < A 46 0A 13 -3,-1.4 26,-0.3 26,-0.2 25,-0.1 -0.528 360.0 360.0 -72.2 147.8 5.8 8.8 -8.8 21 21 A N 0 0 96 24,-2.5 -1,-0.1 79,-0.2 -2,-0.1 -0.309 360.0 360.0 -65.9 360.0 7.5 12.1 -8.3 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 96 0, 0.0 3,-0.4 0, 0.0 2,-0.2 0.000 360.0 360.0 360.0 11.4 -4.3 -3.7 -7.5 24 2 B V + 0 0 103 1,-0.2 -12,-0.1 -14,-0.0 3,-0.1 -0.614 360.0 19.5 -86.7 156.8 -1.4 -5.6 -9.0 25 3 B N S S+ 0 0 124 -14,-0.5 2,-0.3 -2,-0.2 -1,-0.2 0.907 105.5 100.8 48.2 50.9 -2.0 -7.8 -12.0 26 4 B Q S S- 0 0 93 -3,-0.4 -15,-0.5 -15,-0.3 2,-0.3 -0.992 80.2 -90.3-153.6 162.3 -5.2 -6.1 -13.1 27 5 B H - 0 0 97 -2,-0.3 2,-0.7 -17,-0.1 -20,-0.2 -0.577 35.7-161.9 -69.6 126.9 -6.7 -3.6 -15.5 28 6 B L + 0 0 7 -22,-2.9 2,-0.3 -19,-0.4 -20,-0.1 -0.884 18.8 172.6-116.4 96.9 -6.6 -0.1 -14.0 29 7 B b > - 0 0 48 -2,-0.7 3,-2.0 -22,-0.1 4,-0.2 -0.805 46.9 -30.0-108.3 147.2 -9.0 2.1 -15.9 30 8 B G T >> S+ 0 0 28 -2,-0.3 3,-1.2 1,-0.3 4,-1.0 -0.178 131.3 2.9 55.9-129.1 -10.1 5.6 -15.2 31 9 B S H 3> S+ 0 0 27 1,-0.3 4,-2.3 2,-0.2 -1,-0.3 0.744 124.6 69.3 -63.6 -22.1 -10.1 6.6 -11.5 32 10 B H H <> S+ 0 0 96 -3,-2.0 4,-1.9 1,-0.2 -1,-0.3 0.831 95.7 52.5 -69.4 -30.4 -8.7 3.2 -10.6 33 11 B L H <> S+ 0 0 1 -3,-1.2 4,-2.7 2,-0.2 -1,-0.2 0.919 110.1 49.0 -67.8 -41.0 -5.3 4.0 -12.1 34 12 B V H X S+ 0 0 1 -4,-1.0 4,-2.4 1,-0.2 -2,-0.2 0.900 109.9 51.3 -64.4 -39.6 -5.2 7.2 -10.1 35 13 B E H X S+ 0 0 88 -4,-2.3 4,-1.8 2,-0.2 -1,-0.2 0.900 111.1 48.9 -61.9 -40.5 -6.2 5.2 -6.9 36 14 B A H X S+ 0 0 2 -4,-1.9 4,-2.9 2,-0.2 5,-0.2 0.928 110.8 49.0 -65.4 -47.6 -3.3 2.8 -7.6 37 15 B L H X S+ 0 0 0 -4,-2.7 4,-2.9 1,-0.2 5,-0.3 0.909 108.8 53.6 -59.2 -42.1 -0.8 5.6 -8.2 38 16 B Y H X S+ 0 0 66 -4,-2.4 4,-1.3 1,-0.2 -1,-0.2 0.914 113.5 43.3 -59.5 -42.4 -1.8 7.3 -5.0 39 17 B L H < S+ 0 0 102 -4,-1.8 -2,-0.2 2,-0.2 -1,-0.2 0.920 117.6 44.3 -70.3 -48.1 -1.2 4.0 -3.0 40 18 B V H < S+ 0 0 25 -4,-2.9 -2,-0.2 1,-0.2 -3,-0.2 0.939 117.3 42.7 -60.9 -47.9 2.0 3.1 -4.8 41 19 B c H >< S+ 0 0 2 -4,-2.9 3,-1.9 -5,-0.2 4,-0.3 0.698 81.0 175.9 -84.5 -20.2 3.6 6.6 -4.7 42 20 B G G >< - 0 0 38 -4,-1.3 3,-1.3 -5,-0.3 -1,-0.2 -0.227 69.1 -4.8 56.7-131.6 2.7 7.5 -1.1 43 21 B E G 3 S+ 0 0 115 1,-0.3 60,-0.4 58,-0.1 -1,-0.3 0.584 124.3 72.5 -80.8 -8.4 4.1 10.9 -0.0 44 22 B R G < S- 0 0 112 -3,-1.9 -1,-0.3 1,-0.1 -2,-0.2 0.804 89.6-156.4 -63.6 -31.3 6.1 11.3 -3.2 45 23 B G < - 0 0 0 -3,-1.3 -24,-2.5 -4,-0.3 2,-0.3 -0.180 7.5-129.7 67.8-175.6 2.9 12.0 -5.0 46 24 B F E -AB 20 100A 1 54,-1.0 54,-3.2 -26,-0.3 2,-0.4 -0.920 1.7-114.1-160.3 172.0 2.7 11.5 -8.8 47 25 B F E - B 0 99A 71 -28,-2.0 2,-0.5 -2,-0.3 52,-0.2 -0.971 20.2-158.3-126.5 147.0 1.8 12.9 -12.2 48 26 B Y E + B 0 98A 9 50,-3.0 50,-1.5 -2,-0.4 25,-0.2 -0.985 13.0 174.0-132.8 122.4 -1.0 11.6 -14.4 49 27 B T - 0 0 37 -2,-0.5 -46,-0.4 48,-0.2 -47,-0.3 -0.796 13.1-178.6-141.3 91.3 -1.1 12.3 -18.1 50 28 B P 0 0 8 0, 0.0 -1,-0.1 0, 0.0 46,-0.1 0.727 360.0 360.0 -58.5 -27.7 -3.7 10.7 -20.3 51 29 B K 0 0 185 44,-0.4 -47,-0.1 45,-0.2 -48,-0.1 0.114 360.0 360.0 -32.6 360.0 -2.3 12.3 -23.4 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 26 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0-175.8 0.4 23.8 -1.9 54 2 C I H >> + 0 0 2 47,-0.3 4,-3.2 1,-0.2 5,-0.6 0.863 360.0 52.5 -56.3 -40.4 -2.6 21.8 -2.8 55 3 C V H >>S+ 0 0 37 46,-0.3 5,-2.6 2,-0.2 4,-1.5 0.917 111.6 46.3 -65.0 -45.1 -2.8 20.2 0.7 56 4 C E H 4>S+ 0 0 81 3,-0.2 5,-1.8 1,-0.2 -2,-0.2 0.953 119.9 40.4 -57.5 -49.2 -2.8 23.6 2.4 57 5 C Q H <5S+ 0 0 60 -4,-2.7 -2,-0.2 3,-0.2 -3,-0.2 0.858 131.4 18.9 -74.5 -39.0 -5.4 25.0 -0.0 58 6 C d H <5S+ 0 0 0 -4,-3.2 22,-2.8 -5,-0.2 5,-0.3 0.687 129.5 37.5-109.9 -23.6 -7.8 22.1 -0.4 59 7 C e T < - 0 0 51 -2,-0.3 4,-1.8 1,-0.1 5,-0.1 -0.490 36.1-106.8 -92.2 166.7 -12.7 26.4 -5.2 65 13 C L H > S+ 0 0 116 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.866 122.4 61.8 -61.3 -36.0 -12.6 24.5 -8.4 66 14 C Y H > S+ 0 0 194 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.939 104.1 46.5 -51.1 -51.8 -10.4 27.3 -9.7 67 15 C Q H >4 S+ 0 0 62 1,-0.2 3,-0.5 2,-0.2 4,-0.3 0.885 112.6 50.1 -62.1 -39.9 -7.8 26.5 -7.0 68 16 C L H >< S+ 0 0 6 -4,-1.8 3,-2.2 1,-0.2 -2,-0.2 0.923 104.2 58.3 -62.8 -45.6 -7.9 22.8 -7.9 69 17 C E H >< S+ 0 0 84 -4,-2.9 3,-1.8 1,-0.3 -1,-0.2 0.690 86.5 78.3 -60.5 -22.1 -7.5 23.4 -11.6 70 18 C N T << S+ 0 0 116 -4,-0.9 -1,-0.3 -3,-0.5 -2,-0.2 0.741 93.6 51.2 -57.1 -23.7 -4.2 25.1 -10.9 71 19 C Y T < S+ 0 0 31 -3,-2.2 28,-2.4 -4,-0.3 -1,-0.3 0.409 84.9 105.5-100.7 2.7 -2.7 21.7 -10.5 72 20 C f B < C 98 0A 15 -3,-1.8 26,-0.3 26,-0.2 25,-0.1 -0.422 360.0 360.0 -67.9 157.7 -4.0 20.3 -13.8 73 21 C N 0 0 101 24,-2.1 -1,-0.1 -25,-0.2 -2,-0.1 -0.394 360.0 360.0 -67.1 360.0 -1.4 19.9 -16.5 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 0 271 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 110.8 -17.4 13.0 7.3 76 2 D V > - 0 0 86 1,-0.1 3,-1.0 2,-0.0 2,-0.1 0.860 360.0-176.1 -91.9 -38.3 -15.4 15.1 4.8 77 3 D N T 3 S- 0 0 140 1,-0.2 -1,-0.1 3,-0.0 0, 0.0 -0.365 70.5 -34.7 54.4-157.0 -17.3 18.4 4.8 78 4 D Q T 3 S+ 0 0 136 -2,-0.1 -15,-0.4 2,-0.1 2,-0.3 0.237 112.3 113.1 -62.0 6.0 -15.9 20.7 2.2 79 5 D H < - 0 0 65 -3,-1.0 2,-0.6 -17,-0.1 -20,-0.2 -0.696 53.0-156.4 -90.7 138.7 -12.3 19.3 2.8 80 6 D L + 0 0 32 -22,-2.8 2,-0.4 -19,-0.4 -22,-0.1 -0.931 26.9 166.4-113.2 108.1 -10.5 17.4 0.1 81 7 D e > - 0 0 57 -2,-0.6 3,-1.9 -22,-0.1 4,-0.3 -0.924 43.9 -32.7-128.8 147.3 -7.8 15.2 1.7 82 8 D G T >> S+ 0 0 23 -2,-0.4 4,-1.4 1,-0.3 3,-1.2 -0.188 128.7 6.1 55.2-130.7 -5.6 12.3 0.7 83 9 D S H 3> S+ 0 0 70 1,-0.3 4,-2.2 2,-0.2 -1,-0.3 0.798 130.4 58.9 -55.4 -30.8 -7.2 9.9 -1.9 84 10 D H H <> S+ 0 0 83 -3,-1.9 4,-2.2 2,-0.2 -1,-0.3 0.836 101.8 54.7 -69.7 -29.4 -10.2 12.3 -2.2 85 11 D L H <> S+ 0 0 1 -3,-1.2 4,-2.2 -4,-0.3 -1,-0.2 0.919 109.4 46.8 -68.0 -41.3 -7.9 15.1 -3.3 86 12 D V H X S+ 0 0 2 -4,-1.4 4,-2.6 2,-0.2 -2,-0.2 0.902 110.6 51.9 -68.5 -40.3 -6.5 13.0 -6.1 87 13 D E H X S+ 0 0 53 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.899 108.3 52.9 -62.1 -41.3 -10.0 11.9 -7.2 88 14 D A H X S+ 0 0 12 -4,-2.2 4,-3.1 2,-0.2 5,-0.3 0.947 110.5 46.4 -57.4 -51.4 -11.0 15.5 -7.3 89 15 D L H X S+ 0 0 0 -4,-2.2 4,-2.8 1,-0.2 5,-0.3 0.909 109.8 54.4 -58.4 -43.5 -8.1 16.4 -9.6 90 16 D Y H X S+ 0 0 58 -4,-2.6 4,-1.0 1,-0.2 -1,-0.2 0.918 115.2 39.6 -58.1 -43.5 -8.8 13.4 -11.8 91 17 D L H < S+ 0 0 110 -4,-2.2 3,-0.2 2,-0.2 -2,-0.2 0.949 119.8 43.5 -70.8 -49.7 -12.4 14.5 -12.3 92 18 D V H < S+ 0 0 36 -4,-3.1 -2,-0.2 1,-0.2 -3,-0.2 0.861 115.5 46.8 -66.8 -37.7 -11.7 18.3 -12.6 93 19 D f H >< S+ 0 0 3 -4,-2.8 3,-1.6 -5,-0.3 4,-0.4 0.681 80.3 172.5 -85.9 -20.0 -8.6 18.0 -14.9 94 20 D G G >< - 0 0 37 -4,-1.0 3,-1.2 -5,-0.3 -1,-0.2 -0.152 67.5 -1.4 52.0-131.6 -10.0 15.5 -17.4 95 21 D E G 3 S+ 0 0 165 1,-0.3 -44,-0.4 -45,-0.1 -1,-0.3 0.711 127.7 65.9 -68.4 -22.6 -7.9 14.8 -20.4 96 22 D R G < S- 0 0 104 -3,-1.6 -1,-0.3 1,-0.1 -2,-0.2 0.825 90.9-158.0 -63.5 -33.4 -5.2 17.3 -19.3 97 23 D G < - 0 0 0 -3,-1.2 -24,-2.1 -4,-0.4 2,-0.3 -0.286 10.0-109.8 73.2-169.5 -4.3 15.1 -16.3 98 24 D F E -BC 48 72A 0 -50,-1.5 -50,-3.0 -26,-0.3 2,-0.5 -0.942 2.1-122.8-154.4 170.6 -2.6 16.6 -13.2 99 25 D F E -B 47 0A 90 -28,-2.4 2,-0.6 -2,-0.3 -52,-0.2 -0.980 26.8-165.3-127.1 114.9 0.5 16.9 -11.1 100 26 D Y E +B 46 0A 11 -54,-3.2 -54,-1.0 -2,-0.5 -79,-0.2 -0.895 17.8 161.5-110.2 115.4 0.1 15.9 -7.5 101 27 D T - 0 0 29 -2,-0.6 -47,-0.3 -56,-0.2 -46,-0.3 -0.880 15.7-172.3-133.5 102.0 2.7 16.8 -4.9 102 28 D P S S+ 0 0 10 0, 0.0 2,-1.4 0, 0.0 -47,-0.2 0.780 76.0 72.7 -66.9 -25.9 1.5 16.7 -1.3 103 29 D K 0 0 143 -60,-0.4 -60,-0.0 1,-0.2 0, 0.0 -0.598 360.0 360.0 -93.8 78.6 4.8 18.2 0.0 104 30 D T 0 0 91 -2,-1.4 -1,-0.2 -3,-0.0 -48,-0.1 -0.158 360.0 360.0-136.6 360.0 4.3 21.8 -1.2