==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HORMONE 23-SEP-97 1ZNI . COMPND 2 MOLECULE: INSULIN; . SOURCE 2 ORGANISM_SCIENTIFIC: SUS SCROFA; . AUTHOR M.G.W.TURKENBURG,J.L.WHITTINGHAM,G.G.DODSON,E.J.DODSON, . 102 4 6 2 4 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6237.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 62 60.8 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 7.8 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 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 13 12.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 33 32.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 2.0 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 1 0 0 0 0 1 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 36 0, 0.0 4,-2.1 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0-153.6 -7.9 16.7 13.1 2 2 A I H > + 0 0 11 50,-0.4 4,-2.4 1,-0.2 5,-0.2 0.877 360.0 55.0 -61.9 -31.8 -8.3 13.7 10.9 3 3 A V H > S+ 0 0 11 47,-0.3 4,-1.4 49,-0.2 5,-0.3 0.925 110.8 44.4 -69.0 -37.7 -5.5 11.9 12.7 4 4 A E H 4 S+ 0 0 140 -3,-0.3 4,-0.3 1,-0.2 -1,-0.2 0.817 119.1 42.9 -68.5 -35.1 -7.3 12.4 16.1 5 5 A Q H < S+ 0 0 80 -4,-2.1 -2,-0.2 1,-0.1 -1,-0.2 0.764 123.5 30.7 -84.4 -35.5 -10.7 11.4 14.7 6 6 A a H < S+ 0 0 11 -4,-2.4 5,-0.3 -5,-0.2 -2,-0.2 0.508 103.2 64.8-118.2 12.1 -9.7 8.4 12.6 7 7 A b S < S+ 0 0 29 -4,-1.4 -3,-0.1 -5,-0.2 18,-0.1 0.859 109.2 37.1-100.9 -30.3 -6.7 6.5 14.1 8 8 A T S S+ 0 0 99 -5,-0.3 2,-0.3 -4,-0.3 -2,-0.1 0.722 129.9 24.3 -92.3 -15.7 -8.3 5.3 17.4 9 9 A S S S- 0 0 73 -4,-0.2 2,-0.3 -5,-0.1 -1,-0.0 -0.903 95.3 -96.7-143.0 158.4 -11.7 4.7 16.0 10 10 A I - 0 0 157 -2,-0.3 2,-0.5 -3,-0.0 -3,-0.1 -0.634 27.8-149.5 -84.7 146.2 -12.7 3.9 12.4 11 11 A a - 0 0 16 -5,-0.3 2,-0.1 -2,-0.3 -5,-0.1 -0.926 15.3-137.0-107.8 129.5 -14.0 6.6 10.2 12 12 A S > - 0 0 55 -2,-0.5 4,-2.5 1,-0.1 3,-0.4 -0.327 31.4-100.2 -74.8 175.6 -16.5 5.5 7.5 13 13 A L H > S+ 0 0 82 1,-0.2 4,-1.9 2,-0.2 -1,-0.1 0.893 126.0 56.7 -64.3 -32.0 -16.3 6.8 3.9 14 14 A Y H 4 S+ 0 0 172 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.870 108.9 45.5 -71.1 -33.5 -19.0 9.3 4.9 15 15 A Q H >4 S+ 0 0 80 -3,-0.4 3,-1.1 1,-0.2 4,-0.3 0.870 110.4 53.8 -70.6 -39.3 -16.9 10.7 7.7 16 16 A L H >< S+ 0 0 14 -4,-2.5 3,-2.0 1,-0.2 -2,-0.2 0.843 94.4 68.8 -76.7 -17.9 -13.8 10.8 5.5 17 17 A E G >< S+ 0 0 75 -4,-1.9 3,-1.9 1,-0.3 -1,-0.2 0.772 83.0 75.3 -65.2 -16.7 -15.6 12.9 2.8 18 18 A N G < S+ 0 0 125 -3,-1.1 -1,-0.3 -4,-0.4 -2,-0.2 0.738 94.8 51.3 -61.9 -24.4 -15.6 15.7 5.4 19 19 A Y G < S+ 0 0 63 -3,-2.0 28,-0.6 -4,-0.3 -1,-0.3 0.430 86.2 103.9 -99.3 -1.0 -11.8 16.2 4.6 20 20 A c B < A 46 0A 14 -3,-1.9 26,-0.2 26,-0.1 25,-0.1 -0.523 360.0 360.0 -72.0 158.2 -12.0 16.4 0.8 21 21 A N 0 0 95 24,-2.4 25,-0.1 -2,-0.2 24,-0.1 0.716 360.0 360.0 -70.8 360.0 -11.7 19.7 -1.0 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 0 220 0, 0.0 2,-0.5 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 160.1 0.7 4.9 21.9 24 2 B V - 0 0 72 1,-0.0 2,-1.4 4,-0.0 3,-0.1 -0.765 360.0-133.4 -90.6 126.0 -1.1 5.4 18.6 25 3 B N > - 0 0 66 -2,-0.5 4,-2.6 1,-0.2 5,-0.1 -0.750 24.3-175.8 -85.6 97.3 1.5 5.5 15.8 26 4 B Q H > S+ 0 0 105 -2,-1.4 4,-2.4 1,-0.2 -1,-0.2 0.779 78.2 57.4 -63.1 -33.7 0.3 8.6 14.0 27 5 B H H > S+ 0 0 123 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.898 111.2 42.0 -66.5 -40.6 2.9 8.2 11.2 28 6 B L H > S+ 0 0 114 1,-0.2 4,-1.3 2,-0.2 -2,-0.2 0.958 116.2 49.1 -71.7 -37.4 1.7 4.7 10.3 29 7 B b H X S+ 0 0 23 -4,-2.6 4,-2.5 1,-0.2 3,-0.3 0.909 107.6 55.5 -63.5 -36.5 -2.0 5.7 10.6 30 8 B G H X S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.3 5,-0.2 0.880 100.7 58.6 -66.9 -36.0 -1.4 8.8 8.4 31 9 B S H X S+ 0 0 36 -4,-1.8 4,-1.1 1,-0.2 -1,-0.3 0.899 111.2 41.9 -59.1 -43.6 0.0 6.6 5.6 32 10 B H H X S+ 0 0 125 -4,-1.3 4,-2.5 -3,-0.3 -2,-0.2 0.911 111.1 55.1 -70.0 -36.6 -3.2 4.7 5.6 33 11 B L H X S+ 0 0 7 -4,-2.5 4,-3.2 1,-0.2 5,-0.2 0.903 104.9 53.0 -68.2 -34.0 -5.5 7.8 5.9 34 12 B V H X S+ 0 0 0 -4,-2.6 4,-1.8 2,-0.2 -1,-0.2 0.858 109.1 49.3 -70.1 -34.7 -3.9 9.5 2.9 35 13 B E H X S+ 0 0 79 -4,-1.1 4,-1.9 -5,-0.2 -2,-0.2 0.927 111.9 49.6 -70.1 -27.9 -4.6 6.3 0.7 36 14 B A H X S+ 0 0 15 -4,-2.5 4,-2.7 1,-0.2 5,-0.2 0.937 109.9 50.1 -73.3 -37.8 -8.2 6.3 2.0 37 15 B L H X S+ 0 0 2 -4,-3.2 4,-2.8 1,-0.2 5,-0.4 0.859 105.7 58.4 -63.1 -38.1 -8.6 10.1 1.2 38 16 B Y H X S+ 0 0 67 -4,-1.8 4,-1.5 -5,-0.2 -1,-0.2 0.980 111.6 40.4 -56.4 -41.8 -7.2 9.4 -2.3 39 17 B L H < S+ 0 0 136 -4,-1.9 -2,-0.2 2,-0.2 -1,-0.2 0.909 119.8 42.7 -74.7 -38.8 -10.0 6.9 -2.9 40 18 B V H < S+ 0 0 28 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.887 118.6 40.7 -77.1 -37.4 -12.8 8.8 -1.3 41 19 B c H >< S+ 0 0 2 -4,-2.8 3,-1.9 -5,-0.2 4,-0.4 0.724 80.5 168.2 -85.3 -24.0 -12.1 12.3 -2.6 42 20 B G G >< S- 0 0 31 -4,-1.5 3,-1.8 -5,-0.4 -1,-0.1 -0.088 70.6 -0.4 57.3-128.4 -11.1 11.3 -6.2 43 21 B E G 3 S+ 0 0 109 1,-0.3 61,-0.5 60,-0.1 -1,-0.3 0.677 124.9 70.8 -74.2 -14.4 -10.9 14.2 -8.5 44 22 B R G < S- 0 0 100 -3,-1.9 -1,-0.3 1,-0.1 -2,-0.2 0.814 88.8-161.5 -67.1 -29.0 -11.8 16.7 -5.8 45 23 B G < - 0 0 0 -3,-1.8 -24,-2.4 -4,-0.4 2,-0.3 -0.161 2.2-124.1 73.3-179.4 -8.5 16.2 -4.1 46 24 B F E -AB 20 101A 1 55,-2.1 55,-3.3 -26,-0.2 2,-0.4 -0.989 4.4-125.4-163.3 156.5 -7.5 17.0 -0.6 47 25 B F E - B 0 100A 102 -28,-0.6 2,-0.5 -2,-0.3 53,-0.2 -0.932 23.5-159.5-106.6 134.5 -5.1 18.8 1.7 48 26 B Y E + B 0 99A 8 51,-2.8 51,-1.9 -2,-0.4 26,-0.2 -0.980 17.1 167.7-121.1 117.9 -3.3 16.8 4.4 49 27 B T - 0 0 68 -2,-0.5 -47,-0.2 49,-0.2 49,-0.1 -0.959 19.5-161.8-130.0 109.2 -1.9 18.6 7.4 50 28 B P + 0 0 38 0, 0.0 -47,-0.3 0, 0.0 -1,-0.2 0.973 67.6 93.8 -52.2 -60.6 -0.8 16.4 10.2 51 29 B K 0 0 185 45,-0.5 -2,-0.0 -48,-0.1 45,-0.0 -0.104 360.0 360.0 -42.9 102.8 -0.8 19.1 12.9 52 30 B A 0 0 113 -51,-0.1 -50,-0.4 -2,-0.0 -49,-0.2 0.146 360.0 360.0 24.4 360.0 -4.3 18.7 14.3 53 !* 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 54 1 C G > 0 0 32 0, 0.0 4,-2.0 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0-160.0 -0.5 20.2 -12.0 55 2 C I H > + 0 0 1 47,-0.4 4,-3.4 1,-0.2 5,-0.5 0.816 360.0 55.5 -64.4 -38.3 0.9 17.2 -10.2 56 3 C V H >>S+ 0 0 26 49,-0.2 5,-2.7 46,-0.2 4,-2.5 0.960 111.6 42.5 -65.8 -47.3 -0.6 14.5 -12.4 57 4 C E H 4>S+ 0 0 96 3,-0.2 5,-1.0 1,-0.2 -1,-0.2 0.921 119.6 44.0 -67.4 -35.3 0.9 15.9 -15.6 58 5 C Q H <5S+ 0 0 77 -4,-2.0 -2,-0.2 3,-0.2 -1,-0.2 0.935 131.2 17.1 -76.8 -43.7 4.3 16.6 -14.0 59 6 C d H <5S+ 0 0 0 -4,-3.4 22,-2.4 -5,-0.2 5,-0.5 0.581 131.8 33.7-112.4 -12.8 4.8 13.4 -12.0 60 7 C e T <5S+ 0 0 31 -4,-2.5 -3,-0.2 -5,-0.5 -4,-0.1 0.797 126.1 35.6-104.8 -49.3 2.4 10.7 -13.3 61 8 C T T - 0 0 51 -2,-0.4 4,-2.0 1,-0.1 3,-0.3 -0.395 38.6 -98.4 -82.6 171.1 12.5 14.6 -9.6 66 13 C L H > S+ 0 0 73 1,-0.3 4,-1.7 2,-0.2 -1,-0.1 0.873 124.5 53.7 -55.6 -40.1 12.5 15.0 -5.8 67 14 C Y H 4 S+ 0 0 159 1,-0.2 4,-0.4 2,-0.2 -1,-0.3 0.859 106.0 52.0 -71.2 -32.6 12.6 18.7 -6.0 68 15 C Q H >4 S+ 0 0 70 -3,-0.3 3,-1.1 1,-0.2 4,-0.3 0.850 108.0 51.9 -70.7 -31.8 9.6 18.9 -8.3 69 16 C L H >< S+ 0 0 0 -4,-2.0 3,-2.0 1,-0.2 -1,-0.2 0.882 100.0 63.2 -68.4 -30.7 7.5 16.8 -5.9 70 17 C E G >< S+ 0 0 68 -4,-1.7 3,-1.3 1,-0.3 -1,-0.2 0.710 84.5 76.2 -68.1 -10.0 8.4 19.1 -3.1 71 18 C N G < S+ 0 0 84 -3,-1.1 -1,-0.3 -4,-0.4 -2,-0.2 0.708 92.3 55.6 -69.6 -14.2 6.5 21.9 -4.9 72 19 C Y G < S+ 0 0 28 -3,-2.0 28,-2.3 -4,-0.3 -1,-0.3 0.396 84.4 105.3-101.9 11.5 3.3 20.2 -3.7 73 20 C f B < C 99 0A 8 -3,-1.3 26,-0.3 26,-0.2 25,-0.1 -0.594 360.0 360.0 -82.0 149.6 4.3 20.3 -0.0 74 21 C N 0 0 95 24,-1.8 -1,-0.1 23,-0.2 23,-0.1 -0.324 360.0 360.0 -79.0 360.0 2.5 22.9 2.2 75 !* 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 76 1 D F 0 0 126 0, 0.0 -10,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 153.4 14.9 8.9 -5.0 77 2 D V - 0 0 70 1,-0.1 2,-0.6 -12,-0.1 -11,-0.0 -0.337 360.0-147.4 -63.5 153.6 13.1 6.7 -7.5 78 3 D N + 0 0 128 -13,-0.1 2,-0.3 2,-0.1 -1,-0.1 -0.881 55.7 107.1-124.7 84.8 12.9 7.9 -11.1 79 4 D Q S S- 0 0 92 -2,-0.6 -15,-0.5 -15,-0.3 2,-0.3 -0.987 77.9 -80.2-156.4 164.4 9.6 6.6 -12.2 80 5 D H - 0 0 100 -2,-0.3 2,-0.5 -17,-0.1 -20,-0.2 -0.619 44.2-159.1 -72.9 130.5 6.0 7.6 -13.1 81 6 D L + 0 0 11 -22,-2.4 2,-0.3 -19,-0.3 -19,-0.1 -0.970 21.3 164.0-119.1 118.1 4.2 8.0 -9.8 82 7 D e > - 0 0 46 -2,-0.5 3,-1.6 -22,-0.1 4,-0.3 -0.906 40.5 -11.3-135.4 156.8 0.4 7.8 -10.1 83 8 D G T >> S- 0 0 18 -2,-0.3 4,-1.8 1,-0.3 3,-0.8 -0.161 126.7 -6.7 62.0-135.8 -2.7 7.3 -8.1 84 9 D S H 3> S+ 0 0 35 1,-0.3 4,-2.3 2,-0.2 -1,-0.3 0.782 132.5 63.1 -67.6 -31.0 -2.2 6.2 -4.5 85 10 D H H <> S+ 0 0 130 -3,-1.6 4,-1.9 2,-0.2 -1,-0.3 0.866 102.5 50.2 -66.5 -29.0 1.6 5.7 -5.1 86 11 D L H <> S+ 0 0 0 -3,-0.8 4,-2.5 -4,-0.3 -2,-0.2 0.885 110.5 49.6 -71.2 -43.1 1.9 9.5 -5.8 87 12 D V H X S+ 0 0 0 -4,-1.8 4,-2.4 1,-0.2 -2,-0.2 0.930 110.2 49.5 -60.7 -38.5 0.1 10.3 -2.6 88 13 D E H X S+ 0 0 40 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.897 108.7 53.7 -69.9 -35.1 2.2 8.0 -0.6 89 14 D A H X S+ 0 0 10 -4,-1.9 4,-3.0 2,-0.2 5,-0.2 0.936 111.0 46.4 -64.2 -39.4 5.4 9.6 -2.2 90 15 D L H X S+ 0 0 0 -4,-2.5 4,-2.9 1,-0.2 5,-0.4 0.924 107.8 55.8 -69.5 -29.8 4.1 13.1 -1.1 91 16 D Y H X S+ 0 0 23 -4,-2.4 4,-1.1 1,-0.2 -1,-0.2 0.946 113.7 42.1 -65.8 -40.8 3.3 11.9 2.4 92 17 D L H < S+ 0 0 122 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.932 118.9 41.7 -71.0 -47.0 7.0 10.7 2.7 93 18 D V H < S+ 0 0 26 -4,-3.0 -2,-0.2 1,-0.2 -3,-0.2 0.878 115.9 48.0 -73.1 -34.0 8.7 13.7 1.1 94 19 D f H >< S+ 0 0 5 -4,-2.9 3,-1.7 -5,-0.2 4,-0.3 0.644 80.6 170.6 -83.3 -26.0 6.6 16.4 2.7 95 20 D G G >< - 0 0 43 -4,-1.1 3,-1.8 -5,-0.4 -1,-0.2 -0.087 68.6 -2.1 63.6-140.0 6.8 15.1 6.3 96 21 D E G 3 S+ 0 0 187 1,-0.3 -45,-0.5 -47,-0.1 -1,-0.3 0.774 125.9 70.5 -63.6 -22.8 5.4 17.4 9.0 97 22 D R G < S- 0 0 121 -3,-1.7 -1,-0.3 1,-0.2 -23,-0.2 0.753 90.2-152.2 -60.6 -40.3 4.6 20.1 6.3 98 23 D G < - 0 0 1 -3,-1.8 -24,-1.8 -4,-0.3 2,-0.3 -0.171 9.5-126.7 82.5-179.7 1.8 18.0 4.9 99 24 D F E -BC 48 73A 1 -51,-1.9 -51,-2.8 -26,-0.3 2,-0.4 -0.962 2.9-116.1-155.4 169.9 0.8 18.5 1.2 100 25 D F E -B 47 0A 54 -28,-2.3 2,-0.6 -2,-0.3 -53,-0.2 -0.981 14.5-162.4-126.8 139.0 -2.0 19.2 -1.2 101 26 D Y E +B 46 0A 11 -55,-3.3 -55,-2.1 -2,-0.4 -2,-0.0 -0.924 21.8 159.1-116.8 106.0 -3.2 16.8 -3.8 102 27 D T > + 0 0 31 -2,-0.6 3,-1.1 -57,-0.2 -47,-0.4 -0.861 10.9 178.5-131.9 86.3 -5.3 18.6 -6.4 103 28 D P T 3 S+ 0 0 24 0, 0.0 -47,-0.2 0, 0.0 -46,-0.1 0.648 78.3 57.5 -71.0 -14.5 -5.4 16.4 -9.6 104 29 D K T 3 0 0 142 -61,-0.5 -60,-0.1 -48,-0.1 -61,-0.0 0.502 360.0 360.0 -88.2 -15.2 -7.6 18.7 -11.6 105 30 D A < 0 0 95 -3,-1.1 -49,-0.2 0, 0.0 -3,-0.0 -0.262 360.0 360.0 -72.0 360.0 -5.1 21.7 -11.2