==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-SEP-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HORMONE 19-MAR-12 4E7U . COMPND 2 MOLECULE: INSULIN A CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR P.HARRIS,C.G.FRANKAER,M.V.KNUDSEN . 99 4 6 2 4 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 5835.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 67 67.7 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 8.1 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 5.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 14.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 34 34.3 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 2 2 0 0 0 0 0 0 1 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 33 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 179.0 -0.7 19.9 -12.2 2 2 A I H >> + 0 0 1 47,-0.4 4,-2.9 1,-0.2 5,-0.6 0.822 360.0 55.3 -61.7 -34.4 0.9 17.1 -10.2 3 3 A V H >>S+ 0 0 38 49,-0.2 5,-2.7 46,-0.2 4,-1.8 0.954 111.8 43.5 -66.5 -44.5 -0.7 14.3 -12.3 4 4 A E H 4>S+ 0 0 103 3,-0.2 5,-0.8 1,-0.2 -2,-0.2 0.916 121.5 40.3 -65.6 -39.5 0.7 15.7 -15.5 5 5 A Q H <5S+ 0 0 80 -4,-2.3 -2,-0.2 3,-0.2 -1,-0.2 0.907 130.6 20.3 -77.4 -42.5 4.1 16.4 -14.0 6 6 A a H <5S+ 0 0 0 -4,-2.9 22,-2.7 -5,-0.2 5,-0.5 0.623 131.0 33.1-110.4 -19.2 4.7 13.3 -11.9 7 7 A b T < - 0 0 45 -2,-0.4 4,-2.3 13,-0.1 5,-0.2 -0.359 38.8-100.7 -70.7 168.4 12.5 14.6 -9.5 13 13 A L H > S+ 0 0 71 1,-0.2 4,-2.0 2,-0.2 -1,-0.1 0.907 126.4 54.4 -57.4 -42.0 12.4 14.8 -5.7 14 14 A Y H 4 S+ 0 0 160 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.893 108.1 48.9 -60.3 -40.7 12.7 18.6 -6.1 15 15 A Q H >4 S+ 0 0 67 1,-0.2 3,-1.2 2,-0.2 -1,-0.2 0.887 108.1 53.5 -68.3 -38.4 9.6 18.6 -8.4 16 16 A L H >< S+ 0 0 0 -4,-2.3 3,-2.1 1,-0.2 -1,-0.2 0.895 100.3 63.0 -60.6 -37.8 7.6 16.5 -5.9 17 17 A E G >< S+ 0 0 73 -4,-2.0 3,-1.5 1,-0.3 -1,-0.2 0.654 82.8 77.2 -67.2 -14.5 8.4 19.0 -3.2 18 18 A N G < S+ 0 0 84 -3,-1.2 -1,-0.3 -4,-0.4 -2,-0.2 0.650 92.5 55.6 -64.8 -12.9 6.5 21.7 -5.1 19 19 A Y G < S+ 0 0 27 -3,-2.1 28,-2.3 -4,-0.2 -1,-0.2 0.265 83.2 107.5-105.8 8.9 3.4 19.9 -3.7 20 20 A c B < A 46 0A 13 -3,-1.5 26,-0.3 26,-0.2 25,-0.1 -0.544 360.0 360.0 -78.3 152.5 4.4 20.2 -0.1 21 21 A N 0 0 100 24,-2.4 -1,-0.1 79,-0.2 24,-0.1 -0.303 360.0 360.0 -73.0 360.0 2.4 22.7 2.1 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 0 128 0, 0.0 -10,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 153.9 14.9 8.8 -4.8 24 2 B V - 0 0 73 1,-0.1 2,-0.5 -12,-0.1 -11,-0.0 -0.221 360.0-147.3 -57.8 153.0 13.2 6.7 -7.5 25 3 B N + 0 0 128 -13,-0.1 2,-0.3 2,-0.0 -13,-0.1 -0.836 55.6 97.3-124.8 90.3 13.0 8.2 -10.9 26 4 B Q S S- 0 0 96 -2,-0.5 -15,-0.6 -15,-0.3 2,-0.3 -0.963 79.8 -62.4-162.4 170.7 9.7 6.9 -12.3 27 5 B H - 0 0 109 -2,-0.3 2,-0.5 -17,-0.2 -20,-0.2 -0.520 45.0-164.5 -67.7 128.8 6.0 7.6 -13.0 28 6 B L + 0 0 13 -22,-2.7 2,-0.3 -19,-0.4 -19,-0.1 -0.977 17.7 168.7-120.0 118.7 4.2 8.0 -9.7 29 7 B b >> - 0 0 50 -2,-0.5 3,-1.6 -22,-0.1 4,-0.5 -0.910 40.6 -20.2-132.7 153.1 0.4 7.8 -10.0 30 8 B G H >> S- 0 0 14 -2,-0.3 4,-1.9 1,-0.3 3,-0.7 -0.195 127.0 -2.4 58.9-134.5 -2.7 7.5 -7.8 31 9 B S H 3> S+ 0 0 36 1,-0.3 4,-2.4 2,-0.2 -1,-0.3 0.788 133.3 59.8 -64.3 -27.6 -2.1 6.2 -4.3 32 10 B H H <> S+ 0 0 134 -3,-1.6 4,-1.9 2,-0.2 -1,-0.3 0.865 105.1 49.1 -68.0 -35.5 1.6 5.7 -5.0 33 11 B L H < S+ 0 0 2 -4,-2.6 3,-1.8 -5,-0.3 -1,-0.2 0.752 80.2 173.2 -81.2 -23.4 6.9 16.4 2.7 42 20 B G G >< - 0 0 32 -4,-1.0 3,-1.6 -5,-0.3 -1,-0.2 -0.224 68.2 -2.3 57.2-138.0 7.2 15.1 6.2 43 21 B E G 3 S+ 0 0 183 1,-0.3 -1,-0.3 58,-0.1 -2,-0.1 0.701 126.5 69.6 -61.5 -21.8 6.0 17.5 8.9 44 22 B R G < S- 0 0 111 -3,-1.8 -1,-0.3 1,-0.1 -2,-0.2 0.802 91.2-152.2 -63.2 -31.8 5.1 20.1 6.2 45 23 B G < - 0 0 1 -3,-1.6 -24,-2.4 -4,-0.2 2,-0.3 -0.184 9.3-121.1 72.9-178.8 2.3 18.0 4.8 46 24 B F E -AB 20 100A 2 54,-2.2 54,-2.6 -26,-0.3 2,-0.4 -0.900 2.1-121.5-149.4 173.1 1.1 18.3 1.2 47 25 B F E - B 0 99A 52 -28,-2.3 2,-0.6 -2,-0.3 52,-0.2 -0.999 13.9-164.0-127.5 130.0 -1.7 19.0 -1.1 48 26 B Y E + B 0 98A 10 50,-2.9 50,-2.1 -2,-0.4 -2,-0.0 -0.932 22.0 159.0-112.8 104.2 -3.0 16.5 -3.7 49 27 B T > + 0 0 31 -2,-0.6 3,-1.2 48,-0.2 -47,-0.4 -0.807 10.5 176.7-129.7 83.0 -5.1 18.3 -6.2 50 28 B P T 3 S+ 0 0 24 0, 0.0 -47,-0.1 0, 0.0 -46,-0.1 0.620 77.5 59.6 -73.3 -13.8 -5.2 16.2 -9.3 51 29 B K T 3 0 0 169 44,-0.6 45,-0.1 -48,-0.1 44,-0.1 0.681 360.0 360.0 -80.2 -20.2 -7.6 18.5 -11.2 52 30 B A < 0 0 84 -3,-1.2 -49,-0.2 0, 0.0 -3,-0.0 -0.086 360.0 360.0 -64.2 360.0 -5.0 21.2 -10.9 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 75 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0-161.7 -8.2 16.8 13.1 55 2 C I H > + 0 0 17 1,-0.2 4,-2.6 2,-0.2 5,-0.1 0.851 360.0 51.6 -60.5 -37.8 -8.2 13.7 11.1 56 3 C V H > S+ 0 0 13 1,-0.2 4,-1.2 2,-0.2 5,-0.4 0.947 112.6 45.1 -67.6 -43.8 -5.4 11.9 13.0 57 4 C E H 4 S+ 0 0 137 1,-0.2 4,-0.3 2,-0.2 -1,-0.2 0.848 121.8 39.7 -65.9 -33.0 -7.2 12.5 16.4 58 5 C Q H < S+ 0 0 71 -4,-2.2 -2,-0.2 1,-0.1 -1,-0.2 0.811 124.7 30.8 -83.5 -31.7 -10.5 11.4 14.9 59 6 C d H < S+ 0 0 11 -4,-2.6 5,-0.4 -5,-0.2 -3,-0.2 0.311 102.9 66.1-123.5 7.4 -9.5 8.5 12.7 60 7 C e S < S+ 0 0 22 -4,-1.2 -3,-0.1 -5,-0.1 17,-0.1 0.804 114.0 26.9 -99.8 -35.8 -6.5 6.7 14.1 61 8 C A S S+ 0 0 95 -5,-0.4 2,-0.3 -4,-0.3 -2,-0.1 0.230 128.8 46.8-107.5 9.5 -7.9 5.2 17.4 62 9 C S S S- 0 0 73 2,-0.0 2,-0.6 0, 0.0 0, 0.0 -0.963 93.6-108.7-139.8 152.8 -11.4 5.1 16.0 63 10 C V - 0 0 130 -2,-0.3 2,-0.6 -3,-0.0 -3,-0.1 -0.773 28.3-157.6 -88.3 119.3 -12.5 3.8 12.6 64 11 C d - 0 0 16 -2,-0.6 -5,-0.1 -5,-0.4 -6,-0.0 -0.871 10.6-144.0 -94.3 123.1 -13.6 6.5 10.2 65 12 C S > - 0 0 48 -2,-0.6 4,-2.6 1,-0.1 3,-0.2 -0.221 34.1 -96.3 -69.9 171.3 -15.9 5.3 7.4 66 13 C L H > S+ 0 0 82 1,-0.2 4,-1.9 2,-0.2 -1,-0.1 0.871 127.7 56.1 -57.1 -34.2 -15.7 6.7 3.9 67 14 C Y H 4 S+ 0 0 171 2,-0.2 4,-0.4 1,-0.2 -1,-0.2 0.886 109.5 44.0 -68.5 -39.7 -18.5 9.1 4.9 68 15 C Q H >4 S+ 0 0 81 -3,-0.2 3,-0.9 1,-0.2 4,-0.2 0.860 112.3 53.3 -70.1 -36.9 -16.5 10.5 7.8 69 16 C L H >< S+ 0 0 13 -4,-2.6 3,-2.1 1,-0.2 -2,-0.2 0.839 93.7 71.0 -67.4 -30.8 -13.4 10.7 5.7 70 17 C E G >< S+ 0 0 77 -4,-1.9 3,-1.7 1,-0.3 -1,-0.2 0.767 83.5 71.8 -58.2 -27.0 -15.2 12.8 3.1 71 18 C N G < S+ 0 0 119 -3,-0.9 -1,-0.3 -4,-0.4 -2,-0.2 0.772 94.8 54.4 -56.1 -27.5 -15.3 15.7 5.6 72 19 C Y G < S+ 0 0 56 -3,-2.1 27,-0.5 -4,-0.2 -1,-0.3 0.420 87.0 104.7 -94.0 -0.7 -11.6 16.1 5.0 73 20 C f B < C 98 0A 19 -3,-1.7 25,-0.3 -4,-0.2 24,-0.1 -0.375 360.0 360.0 -74.4 159.4 -11.7 16.4 1.2 74 21 C N 0 0 105 23,-2.7 -1,-0.1 -2,-0.1 22,-0.0 -0.449 360.0 360.0 -72.4 360.0 -11.3 19.6 -0.7 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 2 D V 0 0 117 0, 0.0 2,-1.0 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 135.8 -1.6 4.5 17.8 77 3 D N > - 0 0 90 1,-0.2 4,-2.6 -17,-0.1 5,-0.2 -0.699 360.0-161.3 -68.1 103.7 1.5 5.2 15.8 78 4 D Q H > S+ 0 0 83 -2,-1.0 4,-2.5 1,-0.2 -1,-0.2 0.830 83.8 54.6 -63.6 -36.0 0.3 8.4 14.2 79 5 D H H > S+ 0 0 107 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.920 111.9 43.2 -68.5 -41.4 2.8 8.3 11.4 80 6 D L H > S+ 0 0 106 1,-0.2 4,-1.2 2,-0.2 3,-0.4 0.919 113.8 52.2 -65.6 -42.8 1.9 4.7 10.3 81 7 D e H >X S+ 0 0 17 -4,-2.6 4,-2.4 1,-0.2 3,-0.5 0.920 103.4 59.2 -55.7 -45.3 -1.8 5.6 10.7 82 8 D G H 3X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.3 5,-0.2 0.834 97.5 58.8 -58.4 -33.8 -1.3 8.6 8.4 83 9 D S H 3X S+ 0 0 38 -4,-1.1 4,-1.6 -3,-0.4 -1,-0.3 0.924 109.8 44.1 -60.5 -43.0 -0.1 6.5 5.6 84 10 D H H < S+ 0 0 3 -4,-2.8 3,-1.8 -5,-0.2 4,-0.3 0.787 79.5 168.7 -82.0 -27.1 -11.9 12.4 -2.4 94 20 D G G >< S- 0 0 33 -4,-1.4 3,-1.5 -5,-0.4 -1,-0.2 -0.215 71.2 -1.8 51.9-134.1 -11.1 11.4 -6.1 95 21 D E G 3 S+ 0 0 161 1,-0.3 -44,-0.6 -45,-0.1 -1,-0.3 0.684 126.6 69.1 -64.8 -21.2 -10.8 14.5 -8.4 96 22 D R G < S- 0 0 120 -3,-1.8 -1,-0.3 1,-0.1 -2,-0.2 0.820 88.1-165.8 -63.2 -33.0 -11.6 16.9 -5.5 97 23 D G < - 0 0 0 -3,-1.5 -23,-2.7 -4,-0.3 2,-0.3 -0.139 3.4-126.7 68.6-171.2 -8.3 16.1 -3.9 98 24 D F E -BC 48 73A 1 -50,-2.1 -50,-2.9 -25,-0.3 2,-0.3 -0.980 4.3-120.3-165.4 159.3 -7.3 17.0 -0.3 99 25 D F E -B 47 0A 110 -27,-0.5 2,-0.4 -2,-0.3 -52,-0.2 -0.858 27.7-170.9-103.0 145.6 -4.8 18.7 1.9 100 26 D Y E +B 46 0A 6 -54,-2.6 -54,-2.2 -2,-0.3 -79,-0.2 -0.976 10.9 173.3-137.4 128.4 -3.0 16.7 4.6 101 27 D T 0 0 83 -2,-0.4 -58,-0.1 -56,-0.2 -56,-0.1 -0.979 360.0 360.0-131.4 125.3 -0.7 17.9 7.4 102 28 D P 0 0 73 0, 0.0 -59,-0.1 0, 0.0 -58,-0.1 0.281 360.0 360.0 -57.2 360.0 0.6 15.5 10.1