==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HORMONE/GROWTH FACTOR 15-MAY-01 1J73 . COMPND 2 MOLECULE: INSULIN A; . SOURCE 2 SYNTHETIC: YES; . AUTHOR Z.WAN,M.ZHAO,S.NAKAGAWA,W.JIA,M.A.WEISS . 102 4 6 2 4 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6494.0 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 . 4 3.9 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 . 3 2.9 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 39 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0-159.6 -0.7 20.0 -12.0 2 2 A I H >> + 0 0 0 47,-0.4 4,-3.1 2,-0.2 5,-0.6 0.850 360.0 52.4 -57.5 -42.1 0.8 17.1 -10.1 3 3 A V H >>S+ 0 0 40 46,-0.3 4,-2.3 2,-0.2 5,-1.7 0.967 114.8 42.7 -62.2 -51.3 -0.7 14.3 -12.3 4 4 A E H 4>S+ 0 0 100 3,-0.2 5,-0.7 1,-0.2 -2,-0.2 0.941 122.2 39.5 -58.8 -47.7 0.6 15.8 -15.5 5 5 A Q H <5S+ 0 0 103 -4,-2.8 -2,-0.2 3,-0.2 -1,-0.2 0.855 130.0 24.3 -73.1 -37.7 4.0 16.7 -14.0 6 6 A a H <5S+ 0 0 0 -4,-3.1 22,-1.6 -5,-0.2 5,-0.4 0.673 130.1 33.6-105.5 -26.2 4.7 13.5 -11.9 7 7 A b T < - 0 0 59 -2,-0.5 4,-2.1 1,-0.1 5,-0.2 -0.316 38.3-102.6 -70.8 164.1 12.6 14.9 -9.1 13 13 A L H > S+ 0 0 63 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.918 123.3 54.3 -57.0 -44.7 12.3 15.1 -5.3 14 14 A Y H 4 S+ 0 0 195 1,-0.2 4,-0.3 2,-0.2 -1,-0.2 0.819 110.9 46.1 -54.2 -41.6 12.6 19.0 -5.6 15 15 A Q H >4 S+ 0 0 96 2,-0.2 3,-0.7 1,-0.2 -1,-0.2 0.845 111.4 50.0 -72.0 -36.4 9.7 19.1 -8.0 16 16 A L H >< S+ 0 0 1 -4,-2.1 3,-1.5 1,-0.2 -2,-0.2 0.839 103.6 61.7 -74.1 -29.7 7.6 16.7 -5.9 17 17 A E G >< S+ 0 0 76 -4,-2.3 3,-1.3 1,-0.3 -1,-0.2 0.640 85.2 76.0 -70.1 -11.6 8.4 19.0 -2.9 18 18 A N G < S+ 0 0 113 -3,-0.7 -1,-0.3 -4,-0.3 -2,-0.2 0.721 93.6 54.4 -66.2 -17.7 6.5 21.8 -4.8 19 19 A Y G < S+ 0 0 34 -3,-1.5 28,-2.1 -4,-0.2 -1,-0.2 0.248 87.1 97.6-102.4 10.2 3.3 20.0 -3.8 20 20 A c B < A 46 0A 11 -3,-1.3 26,-0.3 26,-0.2 25,-0.1 -0.562 360.0 360.0 -84.3 161.4 4.2 20.0 -0.1 21 21 A N 0 0 90 24,-1.8 25,-0.2 -2,-0.2 24,-0.1 0.348 360.0 360.0-120.9 360.0 2.6 22.8 1.9 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 0 140 0, 0.0 -10,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 162.6 15.0 9.4 -4.8 24 2 B V - 0 0 85 1,-0.1 2,-0.4 -12,-0.1 -13,-0.1 -0.078 360.0-147.5 -50.4 144.9 13.2 7.0 -7.2 25 3 B N + 0 0 111 -15,-0.1 2,-0.3 2,-0.1 -1,-0.1 -0.672 55.8 87.3-130.9 81.2 13.1 8.1 -10.9 26 4 B Q S S- 0 0 135 -2,-0.4 -15,-0.5 -15,-0.2 2,-0.1 -0.976 82.8 -69.7-163.6 164.0 10.0 7.0 -12.4 27 5 B H - 0 0 98 -2,-0.3 2,-0.5 -17,-0.1 -20,-0.2 -0.396 42.1-162.6 -63.3 135.4 6.3 7.8 -13.0 28 6 B L + 0 0 26 -22,-1.6 2,-0.3 -19,-0.3 -19,-0.1 -0.997 15.8 178.8-128.3 117.0 4.3 7.8 -9.8 29 7 B b > - 0 0 51 -2,-0.5 3,-1.7 -22,-0.1 4,-0.2 -0.892 40.9 -19.2-125.5 157.5 0.6 7.6 -10.4 30 8 B G T >> S- 0 0 22 -2,-0.3 4,-1.3 1,-0.3 3,-1.1 -0.217 130.1 -1.8 55.5-130.2 -2.6 7.4 -8.3 31 9 B S H 3> S+ 0 0 33 1,-0.2 4,-2.3 2,-0.2 -1,-0.3 0.740 130.4 64.3 -62.2 -23.5 -2.1 6.2 -4.7 32 10 B H H <> S+ 0 0 132 -3,-1.7 4,-1.4 1,-0.2 -1,-0.2 0.805 103.0 48.7 -70.6 -26.1 1.7 5.8 -5.4 33 11 B L H <> S+ 0 0 0 -3,-1.1 4,-2.4 -4,-0.2 -2,-0.2 0.889 111.2 49.6 -74.3 -41.6 1.9 9.6 -6.0 34 12 B V H X S+ 0 0 0 -4,-1.3 4,-2.6 2,-0.2 -2,-0.2 0.909 112.8 46.8 -63.2 -45.3 -0.0 10.3 -2.7 35 13 B E H X S+ 0 0 57 -4,-2.3 4,-2.0 2,-0.2 5,-0.2 0.872 110.8 51.5 -65.9 -38.2 2.2 8.0 -0.7 36 14 B A H X S+ 0 0 12 -4,-1.4 4,-2.6 2,-0.2 -2,-0.2 0.941 113.4 46.6 -63.2 -45.1 5.4 9.6 -2.3 37 15 B L H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 5,-0.3 0.914 108.1 56.9 -55.3 -48.0 4.0 13.0 -1.3 38 16 B Y H X S+ 0 0 22 -4,-2.6 4,-1.2 1,-0.2 -2,-0.2 0.910 115.1 35.9 -54.3 -47.7 3.2 11.7 2.2 39 17 B L H < S+ 0 0 94 -4,-2.0 -2,-0.2 2,-0.2 -1,-0.2 0.946 115.7 52.1 -79.4 -42.4 6.7 10.7 2.9 40 18 B V H < S+ 0 0 22 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.878 112.8 44.8 -55.0 -45.2 8.6 13.5 1.1 41 19 B c H >< S- 0 0 3 -4,-2.4 3,-1.1 -5,-0.2 -1,-0.2 0.786 84.1-176.3 -77.5 -30.1 6.7 16.3 2.8 42 20 B G G >< - 0 0 45 -4,-1.2 3,-2.2 -5,-0.3 -1,-0.2 -0.339 67.6 -9.7 64.7-149.6 6.8 15.0 6.4 43 21 B E G 3 S+ 0 0 152 1,-0.3 -1,-0.2 59,-0.1 -2,-0.1 0.507 125.1 76.1 -64.9 -3.7 4.9 17.1 9.1 44 22 B R G < S- 0 0 95 -3,-1.1 -1,-0.3 1,-0.2 -2,-0.2 0.797 88.3-156.1 -70.9 -32.6 4.4 19.8 6.6 45 23 B G < - 0 0 2 -3,-2.2 -24,-1.8 -7,-0.2 2,-0.3 -0.293 6.5-128.9 77.5-171.4 1.7 17.8 4.8 46 24 B F E -AB 20 101A 0 55,-1.4 55,-2.1 -26,-0.3 2,-0.4 -0.894 4.9-108.9-159.7-178.2 0.8 18.3 1.2 47 25 B F E - B 0 100A 55 -28,-2.1 2,-0.6 -2,-0.3 53,-0.2 -0.999 16.7-162.1-134.0 133.9 -1.9 19.0 -1.3 48 26 B Y E + B 0 99A 11 51,-3.0 51,-2.2 -2,-0.4 -2,-0.0 -0.968 18.7 164.3-115.7 108.5 -3.2 16.5 -3.8 49 27 B T + 0 0 50 -2,-0.6 -47,-0.4 49,-0.2 -46,-0.3 -0.781 4.9 168.2-131.4 88.9 -5.1 18.1 -6.7 50 28 B P + 0 0 27 0, 0.0 2,-0.6 0, 0.0 46,-0.1 0.498 44.2 105.3 -77.1 -8.7 -5.5 15.8 -9.6 51 29 B K 0 0 135 45,-0.3 -48,-0.0 1,-0.2 -2,-0.0 -0.706 360.0 360.0 -93.3 126.2 -8.1 17.8 -11.6 52 30 B T 0 0 150 -2,-0.6 -1,-0.2 -51,-0.1 0, 0.0 0.043 360.0 360.0-148.9 360.0 -6.8 19.6 -14.5 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 27 0, 0.0 4,-2.1 0, 0.0 3,-1.0 0.000 360.0 360.0 360.0-150.3 -7.7 17.1 12.7 55 2 C I H 3> + 0 0 7 1,-0.3 4,-2.7 47,-0.2 5,-0.3 0.811 360.0 60.1 -60.0 -34.4 -8.0 13.8 10.9 56 3 C V H 3> S+ 0 0 18 1,-0.2 4,-0.9 2,-0.2 5,-0.3 0.853 110.9 40.2 -66.6 -29.4 -5.1 12.2 12.7 57 4 C E H <4 S+ 0 0 99 -3,-1.0 4,-0.4 2,-0.2 -2,-0.2 0.859 122.1 40.0 -94.9 -30.3 -6.8 12.6 16.1 58 5 C Q H < S+ 0 0 123 -4,-2.1 4,-0.3 1,-0.1 -2,-0.2 0.802 126.6 32.5 -84.9 -24.7 -10.3 11.7 15.1 59 6 C d H < S+ 0 0 11 -4,-2.7 5,-0.4 -5,-0.2 -3,-0.2 0.516 118.0 47.1-114.0 -4.0 -9.4 8.8 12.7 60 7 C e S < S+ 0 0 29 -4,-0.9 18,-0.2 -5,-0.3 -3,-0.2 0.643 113.5 49.1-103.1 -21.5 -6.3 7.2 14.2 61 8 C X S S+ 0 0 119 -4,-0.4 2,-0.3 -5,-0.3 -2,-0.1 0.797 130.6 9.7 -85.1 -24.2 -7.8 7.0 17.7 62 9 C S S S- 0 0 83 -4,-0.3 2,-0.3 -5,-0.1 -1,-0.2 -0.901 96.0 -85.2-145.9 164.9 -11.0 5.5 16.4 63 10 C I - 0 0 161 -2,-0.3 2,-0.5 -3,-0.1 -3,-0.1 -0.605 36.8-153.6 -81.2 137.5 -12.1 4.0 12.9 64 11 C d - 0 0 24 -5,-0.4 -5,-0.1 -2,-0.3 -1,-0.0 -0.960 7.7-143.2-107.7 123.7 -13.4 6.5 10.4 65 12 C S > - 0 0 52 -2,-0.5 4,-2.3 1,-0.1 3,-0.5 -0.229 35.8 -95.8 -71.6 169.6 -15.9 5.3 7.7 66 13 C L H > S+ 0 0 89 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.835 127.0 55.8 -50.2 -39.8 -15.7 6.7 4.1 67 14 C Y H 4 S+ 0 0 167 2,-0.2 4,-0.4 1,-0.2 -1,-0.2 0.854 108.0 45.2 -66.4 -40.2 -18.4 9.2 5.1 68 15 C Q H >4 S+ 0 0 93 -3,-0.5 3,-0.5 1,-0.2 4,-0.3 0.845 113.4 51.9 -71.5 -34.7 -16.4 10.6 7.9 69 16 C L H >< S+ 0 0 16 -4,-2.3 3,-1.8 1,-0.2 -2,-0.2 0.860 98.3 65.4 -69.0 -37.4 -13.3 10.7 5.6 70 17 C E G >< S+ 0 0 73 -4,-2.4 3,-1.3 1,-0.3 -1,-0.2 0.689 86.4 72.1 -59.2 -20.4 -15.2 12.6 2.9 71 18 C N G < S+ 0 0 127 -3,-0.5 -1,-0.3 -4,-0.4 -2,-0.2 0.809 94.9 53.6 -63.9 -29.0 -15.5 15.6 5.3 72 19 C Y G < S+ 0 0 79 -3,-1.8 28,-0.6 -4,-0.3 -1,-0.2 0.234 89.1 99.5 -95.5 13.9 -11.8 16.2 4.8 73 20 C f B < C 99 0A 17 -3,-1.3 26,-0.2 26,-0.1 25,-0.1 -0.246 360.0 360.0 -84.0 178.9 -11.9 16.4 0.9 74 21 C N 0 0 112 24,-1.8 25,-0.1 20,-0.1 24,-0.1 0.804 360.0 360.0 -86.2 360.0 -12.0 19.6 -1.1 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 0 187 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-125.0 2.5 4.4 21.5 77 2 D V - 0 0 109 0, 0.0 2,-0.3 0, 0.0 -16,-0.1 -0.311 360.0-105.3 -94.5-161.8 0.0 3.5 18.8 78 3 D N > + 0 0 66 -2,-0.2 4,-2.6 -18,-0.2 5,-0.1 -0.626 41.6 168.2-145.2 101.9 1.2 4.8 15.4 79 4 D Q H > S+ 0 0 69 -2,-0.3 4,-2.0 2,-0.2 -1,-0.1 0.643 82.4 61.3 -74.2 -20.5 -0.2 7.8 13.8 80 5 D H H > S+ 0 0 106 2,-0.2 4,-1.3 3,-0.1 -1,-0.2 0.932 111.1 39.6 -69.7 -47.0 2.6 8.0 11.2 81 6 D L H > S+ 0 0 107 1,-0.2 4,-1.2 2,-0.2 3,-0.2 0.909 117.0 51.4 -69.1 -36.6 1.7 4.5 9.9 82 7 D e H X S+ 0 0 31 -4,-2.6 4,-3.1 1,-0.2 -1,-0.2 0.880 102.8 60.3 -64.5 -39.0 -2.0 5.5 10.3 83 8 D G H X S+ 0 0 0 -4,-2.0 4,-2.9 1,-0.2 5,-0.2 0.869 101.4 51.8 -59.3 -38.4 -1.4 8.7 8.3 84 9 D S H X S+ 0 0 22 -4,-1.3 4,-1.7 -3,-0.2 -1,-0.2 0.896 113.2 45.4 -64.5 -40.0 -0.2 6.7 5.1 85 10 D H H X S+ 0 0 124 -4,-1.2 4,-3.1 2,-0.2 -2,-0.2 0.905 112.2 53.5 -64.3 -45.2 -3.4 4.7 5.3 86 11 D L H X S+ 0 0 11 -4,-3.1 4,-2.5 1,-0.2 -2,-0.2 0.947 111.1 43.3 -56.4 -51.7 -5.4 7.9 5.9 87 12 D V H X S+ 0 0 0 -4,-2.9 4,-1.6 1,-0.2 -1,-0.2 0.843 113.9 52.5 -71.6 -25.8 -4.0 9.6 2.8 88 13 D E H X S+ 0 0 86 -4,-1.7 4,-1.7 -5,-0.2 -1,-0.2 0.955 110.4 47.6 -69.2 -46.8 -4.5 6.4 0.8 89 14 D A H X S+ 0 0 27 -4,-3.1 4,-2.6 1,-0.2 -2,-0.2 0.894 111.0 51.8 -54.1 -45.3 -8.2 6.3 2.0 90 15 D L H X S+ 0 0 1 -4,-2.5 4,-2.4 2,-0.2 5,-0.4 0.820 102.9 59.0 -65.1 -31.5 -8.6 10.0 1.1 91 16 D Y H X S+ 0 0 71 -4,-1.6 4,-1.2 -5,-0.2 -1,-0.2 0.935 112.4 39.9 -63.6 -44.2 -7.2 9.4 -2.4 92 17 D L H < S+ 0 0 124 -4,-1.7 -2,-0.2 2,-0.1 -1,-0.2 0.953 120.7 43.2 -68.6 -43.7 -10.0 6.8 -3.0 93 18 D V H < S+ 0 0 26 -4,-2.6 -3,-0.2 1,-0.2 -2,-0.2 0.943 118.6 39.6 -70.8 -50.1 -12.8 8.9 -1.3 94 19 D f H >< S+ 0 0 3 -4,-2.4 3,-2.0 1,-0.2 4,-0.2 0.818 79.3 169.9 -71.8 -28.2 -12.1 12.4 -2.6 95 20 D G G >< S- 0 0 34 -4,-1.2 3,-1.3 -5,-0.4 -1,-0.2 -0.282 73.4 -2.9 53.6-129.2 -11.2 11.3 -6.2 96 21 D E G 3 S+ 0 0 121 1,-0.3 -45,-0.3 -46,-0.1 -1,-0.3 0.546 122.9 74.0 -74.0 -8.1 -11.0 14.5 -8.3 97 22 D R G < S- 0 0 113 -3,-2.0 -1,-0.3 1,-0.1 -2,-0.2 0.813 89.0-162.2 -72.4 -26.1 -12.0 16.9 -5.5 98 23 D G < - 0 0 0 -3,-1.3 -24,-1.8 -4,-0.2 2,-0.3 -0.103 1.7-129.4 73.1-178.2 -8.6 16.3 -4.2 99 24 D F E -BC 48 73A 0 -51,-2.2 -51,-3.0 -26,-0.2 2,-0.4 -0.965 6.9-125.4-162.3 174.8 -7.5 17.0 -0.6 100 25 D F E -B 47 0A 97 -28,-0.6 2,-0.6 -2,-0.3 -53,-0.2 -0.963 17.5-155.1-126.3 134.2 -5.1 18.6 1.8 101 26 D Y E +B 46 0A 10 -55,-2.1 -55,-1.4 -2,-0.4 -2,-0.0 -0.977 22.5 164.6-118.8 113.3 -3.4 16.6 4.5 102 27 D T - 0 0 63 -2,-0.6 2,-1.4 -57,-0.2 -47,-0.2 -0.908 22.1-172.9-129.2 98.7 -2.4 18.8 7.4 103 28 D P + 0 0 31 0, 0.0 2,-0.3 0, 0.0 -58,-0.1 -0.553 68.0 92.1 -74.3 61.6 -1.5 17.1 10.7 104 29 D K 0 0 126 -2,-1.4 -2,-0.0 -60,-0.0 -60,-0.0 -0.888 360.0 360.0-164.6 127.0 -1.4 20.6 12.2 105 30 D T 0 0 167 -2,-0.3 0, 0.0 -51,-0.1 0, 0.0 -0.865 360.0 360.0-162.2 360.0 -4.2 22.4 13.8