==== 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 05-JUL-07 2QIU . COMPND 2 MOLECULE: INSULIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR R.SREEKANTH,V.PATTABHI,S.S.RAJAN . 104 4 6 2 4 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6771.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 61 58.7 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 . 6 5.8 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 3.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 13 12.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 33 31.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.9 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 0 1 0 0 1 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 . 1 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 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 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 0 A R 0 0 221 0, 0.0 5,-0.0 0, 0.0 52,-0.0 0.000 360.0 360.0 360.0 130.3 -12.0 19.0 13.5 2 1 A G > - 0 0 22 51,-0.1 4,-0.9 1,-0.1 51,-0.1 0.095 360.0-138.0 -58.2 160.4 -8.6 17.4 12.9 3 2 A I H > S+ 0 0 12 47,-0.3 4,-0.6 49,-0.3 5,-0.3 0.973 99.0 42.2 -82.2 -63.5 -7.8 14.4 10.7 4 3 A V H > S+ 0 0 28 1,-0.2 4,-0.9 2,-0.2 3,-0.3 0.768 110.1 65.4 -58.7 -25.7 -5.3 12.2 12.6 5 4 A E H 4 S+ 0 0 98 1,-0.2 5,-0.4 2,-0.2 4,-0.3 0.971 114.1 20.7 -61.4 -61.1 -7.4 12.8 15.7 6 5 A Q H < S+ 0 0 68 -4,-0.9 -1,-0.2 -3,-0.3 -2,-0.2 0.050 128.1 46.0-108.8 26.0 -10.7 11.1 14.8 7 6 A a H < S+ 0 0 13 -4,-0.6 5,-0.3 -3,-0.3 -1,-0.2 0.340 112.2 48.8-132.8 -7.9 -9.5 8.7 12.0 8 7 A b S < S+ 0 0 25 -4,-0.9 -2,-0.1 -5,-0.3 3,-0.1 0.295 126.3 24.6-118.4 4.9 -6.4 7.3 13.8 9 8 A T S S+ 0 0 124 1,-0.5 2,-0.2 -4,-0.3 -3,-0.2 0.438 132.7 38.5-124.1 -41.0 -8.0 6.5 17.1 10 9 A S S S- 0 0 70 -5,-0.4 2,-0.7 0, 0.0 -1,-0.5 -0.678 94.0-110.9 -96.9 161.5 -11.5 6.1 15.8 11 10 A I - 0 0 140 -2,-0.2 2,-0.4 -3,-0.1 -4,-0.1 -0.866 28.4-144.2 -97.8 114.8 -12.3 4.5 12.4 12 11 A a - 0 0 14 -2,-0.7 -5,-0.1 -5,-0.3 2,-0.0 -0.640 12.1-139.5 -80.2 126.3 -13.6 7.0 9.8 13 12 A S > - 0 0 45 -2,-0.4 4,-3.1 1,-0.1 3,-0.3 -0.249 34.6 -95.5 -72.0 169.2 -16.2 5.6 7.4 14 13 A L H > S+ 0 0 102 1,-0.2 4,-0.9 2,-0.2 -1,-0.1 0.726 130.7 50.1 -57.2 -22.1 -16.2 6.6 3.7 15 14 A Y H 4 S+ 0 0 178 2,-0.2 -1,-0.2 1,-0.1 4,-0.2 0.767 109.8 47.3 -90.2 -32.1 -18.7 9.3 4.8 16 15 A Q H >4 S+ 0 0 83 -3,-0.3 3,-1.0 2,-0.2 -2,-0.2 0.849 112.1 52.1 -71.9 -39.3 -16.5 10.6 7.6 17 16 A L H >< S+ 0 0 16 -4,-3.1 3,-2.3 1,-0.2 -2,-0.2 0.886 98.4 65.6 -59.9 -40.2 -13.6 10.6 5.2 18 17 A E G >< S+ 0 0 94 -4,-0.9 3,-1.2 1,-0.3 -1,-0.2 0.618 82.2 76.0 -66.2 -13.0 -15.5 12.6 2.7 19 18 A N G < S+ 0 0 131 -3,-1.0 -1,-0.3 1,-0.2 -2,-0.2 0.633 94.0 55.0 -64.5 -14.3 -15.6 15.6 5.1 20 19 A Y G < S+ 0 0 50 -3,-2.3 28,-0.5 -4,-0.1 2,-0.2 0.246 85.5 104.7-108.0 9.5 -12.0 16.1 4.0 21 20 A c < 0 0 22 -3,-1.2 26,-0.2 1,-0.2 25,-0.1 -0.641 360.0 360.0 -92.8 150.3 -12.5 16.3 0.3 22 21 A N 0 0 124 24,-2.2 24,-0.2 -2,-0.2 -1,-0.2 0.699 360.0 360.0 -82.2 360.0 -12.3 19.5 -1.8 23 !* 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 24 1 B F 0 0 233 0, 0.0 2,-0.3 0, 0.0 4,-0.0 0.000 360.0 360.0 360.0 -37.1 5.8 9.0 16.1 25 2 B V + 0 0 91 2,-0.1 0, 0.0 3,-0.1 0, 0.0 -0.983 360.0 37.7-162.3 133.9 5.0 5.8 14.3 26 3 B N S S+ 0 0 111 -2,-0.3 -1,-0.1 0, 0.0 0, 0.0 0.423 119.2 59.6 73.7 8.6 1.8 4.0 13.8 27 4 B Q S > S+ 0 0 90 3,-0.1 4,-1.3 2,-0.1 -2,-0.1 0.394 109.3 37.3-122.8 -32.6 0.5 7.5 13.5 28 5 B H H > S+ 0 0 89 2,-0.2 4,-0.9 3,-0.1 -3,-0.1 0.686 119.0 54.6 -68.1 -28.9 2.8 8.1 10.6 29 6 B L H > S+ 0 0 87 2,-0.2 4,-0.6 1,-0.2 3,-0.1 0.885 110.3 42.8 -69.4 -41.4 1.7 4.6 9.9 30 7 B b H >> S+ 0 0 29 1,-0.2 4,-1.1 2,-0.2 3,-0.6 0.836 107.2 61.5 -73.1 -35.2 -2.0 5.5 10.1 31 8 B G H 3X S+ 0 0 0 -4,-1.3 4,-1.8 1,-0.2 5,-0.2 0.788 98.2 56.5 -63.7 -31.8 -1.5 8.7 8.1 32 9 B S H 3X S+ 0 0 22 -4,-0.9 4,-0.5 1,-0.2 -1,-0.2 0.788 107.6 49.5 -68.6 -29.9 -0.2 6.7 5.0 33 10 B H H S+ 0 0 2 -4,-3.6 4,-2.8 2,-0.2 5,-0.5 0.831 105.9 53.5 -68.5 -35.3 -8.6 10.1 0.8 39 16 B Y H X5S+ 0 0 65 -4,-1.3 4,-1.4 -5,-0.2 -1,-0.2 0.922 115.7 41.5 -60.8 -45.1 -7.2 9.5 -2.7 40 17 B L H <5S+ 0 0 130 -4,-1.1 -2,-0.2 2,-0.1 -1,-0.2 0.929 121.1 40.9 -65.3 -49.3 -9.9 6.8 -3.1 41 18 B V H <5S+ 0 0 18 -4,-3.4 -3,-0.2 1,-0.1 -2,-0.2 0.917 123.3 35.3 -68.8 -44.6 -12.7 8.7 -1.4 42 19 B c H ><5S+ 0 0 0 -4,-2.8 3,-1.3 -5,-0.2 -3,-0.2 0.878 74.9 153.8 -84.8 -41.8 -12.1 12.2 -2.9 43 20 B G G >< - 0 0 25 3,-0.1 4,-2.1 1,-0.1 5,-0.3 -0.070 360.0 -80.1 97.2 153.4 -0.1 20.0 -13.1 57 2 C I H > S+ 0 0 6 50,-0.5 4,-1.5 47,-0.3 5,-0.5 0.862 128.6 41.2 -58.7 -43.5 0.8 17.3 -10.5 58 3 C V H >>S+ 0 0 26 46,-0.4 5,-3.9 3,-0.2 4,-1.4 0.846 118.0 46.1 -75.0 -35.4 -0.2 14.3 -12.7 59 4 C E H 45S+ 0 0 66 -4,-0.2 -2,-0.2 3,-0.2 -1,-0.2 0.732 118.0 44.4 -78.2 -22.6 1.3 15.7 -15.9 60 5 C Q H <5S+ 0 0 43 -4,-2.1 -2,-0.2 4,-0.1 -1,-0.2 0.738 135.7 11.6 -88.1 -27.7 4.5 16.6 -14.1 61 6 C d H <5S+ 0 0 0 -4,-1.5 22,-1.9 -5,-0.3 5,-0.3 0.693 134.2 35.1-123.7 -35.6 4.8 13.4 -12.2 62 7 C e T <5S+ 0 0 25 -4,-1.4 -3,-0.2 -5,-0.5 22,-0.1 0.855 128.3 33.6 -94.0 -44.4 2.4 10.7 -13.5 63 8 C T S > - 0 0 61 -2,-0.4 3,-1.4 13,-0.1 4,-0.9 -0.134 47.9 -79.5 -82.6-173.3 12.6 14.4 -8.9 68 13 C L H >> S+ 0 0 80 1,-0.3 4,-1.7 2,-0.2 3,-0.6 0.883 133.9 54.4 -53.5 -40.5 12.5 15.3 -5.2 69 14 C Y H 34 S+ 0 0 175 1,-0.2 -1,-0.3 2,-0.2 -2,-0.1 -0.172 104.8 51.3 -93.8 39.5 12.5 18.9 -6.3 70 15 C Q H <4 S+ 0 0 80 -3,-1.4 -1,-0.2 -2,-0.1 -2,-0.2 0.245 114.2 42.7-138.7 -10.0 9.5 18.6 -8.6 71 16 C L H X< S+ 0 0 0 -4,-0.9 3,-1.9 -3,-0.6 -2,-0.2 0.634 100.6 69.7 -99.5 -27.7 7.3 16.9 -6.0 72 17 C E G >< S+ 0 0 56 -4,-1.7 3,-0.7 1,-0.3 -3,-0.1 0.608 84.2 76.3 -63.6 -12.7 8.5 19.4 -3.2 73 18 C N G 3 S+ 0 0 87 1,-0.2 -1,-0.3 -5,-0.1 -2,-0.1 0.648 94.3 48.1 -70.2 -17.5 6.4 21.9 -5.2 74 19 C Y G < S+ 0 0 28 -3,-1.9 28,-1.8 2,-0.0 -1,-0.2 0.330 83.2 110.8-111.4 4.3 3.2 20.5 -3.8 75 20 C f B < B 101 0A 12 -3,-0.7 26,-0.3 26,-0.2 18,-0.0 -0.524 360.0 360.0 -74.5 148.6 4.1 20.3 -0.1 76 21 C N 0 0 95 24,-2.2 -1,-0.1 -27,-0.2 24,-0.1 -0.154 360.0 360.0 -63.9 360.0 2.2 22.8 2.1 77 !* 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 78 1 D F 0 0 159 0, 0.0 2,-0.1 0, 0.0 -11,-0.1 0.000 360.0 360.0 360.0 -89.5 15.5 8.4 -6.0 79 2 D V + 0 0 43 -13,-0.1 2,-2.8 2,-0.1 -13,-0.2 -0.624 360.0 179.6-144.8 80.1 12.5 7.5 -8.3 80 3 D N + 0 0 143 -2,-0.1 2,-0.3 -15,-0.1 -13,-0.1 -0.450 61.0 100.2 -71.6 65.3 13.4 8.3 -11.9 81 4 D Q S S- 0 0 110 -2,-2.8 -15,-0.5 -15,-0.3 2,-0.1 -0.993 83.0 -94.7-157.3 148.4 9.9 6.9 -12.5 82 5 D H - 0 0 97 -2,-0.3 2,-0.5 -17,-0.1 -20,-0.2 -0.442 32.3-160.2 -63.4 138.5 6.3 7.8 -13.1 83 6 D L + 0 0 18 -22,-1.9 2,-0.2 -19,-0.3 -20,-0.1 -0.921 20.1 169.9-128.2 104.6 4.1 8.0 -10.0 84 7 D e >> - 0 0 52 -2,-0.5 3,-2.1 -22,-0.1 4,-0.6 -0.657 44.6 -12.8-111.4 165.8 0.4 7.7 -10.7 85 8 D G H 3> S- 0 0 17 1,-0.3 4,-0.8 -2,-0.2 3,-0.2 -0.197 130.4 -4.5 54.6-118.5 -2.8 7.2 -8.6 86 9 D S H 3> S+ 0 0 31 1,-0.2 4,-0.8 2,-0.2 -1,-0.3 0.573 129.5 64.8 -86.2 -12.7 -2.1 6.1 -5.1 87 10 D H H <> S+ 0 0 131 -3,-2.1 4,-1.1 2,-0.2 -2,-0.2 0.723 100.1 52.9 -80.5 -23.7 1.7 5.8 -5.6 88 11 D L H X S+ 0 0 0 -4,-0.6 4,-2.3 -3,-0.2 -2,-0.2 0.872 108.5 48.1 -74.9 -41.3 1.9 9.6 -6.2 89 12 D V H X S+ 0 0 0 -4,-0.8 4,-1.6 1,-0.2 -2,-0.2 0.718 111.5 51.1 -74.2 -22.7 0.1 10.5 -3.0 90 13 D E H X S+ 0 0 58 -4,-0.8 4,-1.9 2,-0.2 -1,-0.2 0.793 108.9 50.9 -79.7 -33.6 2.3 8.1 -1.0 91 14 D A H X S+ 0 0 16 -4,-1.1 4,-2.9 2,-0.2 5,-0.2 0.932 112.6 46.2 -65.2 -48.5 5.4 9.8 -2.6 92 15 D L H X S+ 0 0 0 -4,-2.3 4,-3.0 1,-0.2 5,-0.4 0.914 110.2 54.8 -56.1 -47.4 4.0 13.2 -1.5 93 16 D Y H X S+ 0 0 14 -4,-1.6 4,-1.3 2,-0.2 -1,-0.2 0.889 115.4 37.4 -57.0 -45.3 3.2 11.8 1.9 94 17 D L H < S+ 0 0 126 -4,-1.9 -2,-0.2 2,-0.2 -1,-0.2 0.962 119.5 46.5 -70.3 -54.4 6.8 10.6 2.5 95 18 D V H < S+ 0 0 28 -4,-2.9 -2,-0.2 1,-0.2 -3,-0.2 0.903 116.5 42.8 -57.0 -47.7 8.6 13.5 0.8 96 19 D f H >< S+ 0 0 7 -4,-3.0 3,-1.2 -5,-0.2 2,-0.2 0.863 84.1 171.0 -72.5 -38.6 6.6 16.3 2.4 97 20 D G T 3< + 0 0 35 -4,-1.3 3,-0.2 -5,-0.4 -1,-0.2 -0.453 65.5 3.0 72.0-129.3 6.6 14.9 5.9 98 21 D E T 3 S+ 0 0 191 -2,-0.2 -1,-0.3 1,-0.2 -2,-0.1 0.764 126.6 66.1 -63.2 -29.4 5.2 17.1 8.8 99 22 D R S < S- 0 0 124 -3,-1.2 -1,-0.2 1,-0.1 2,-0.2 0.953 91.4-149.0 -55.9 -57.3 4.4 19.8 6.3 100 23 D G - 0 0 1 -3,-0.2 -24,-2.2 -8,-0.2 2,-0.3 -0.509 8.1-122.2 101.9-178.7 1.6 18.0 4.3 101 24 D F E -AB 49 75A 1 -52,-0.8 -52,-2.4 -26,-0.3 2,-0.4 -0.916 4.4-119.0-152.8 172.0 0.6 18.3 0.7 102 25 D F E -A 48 0A 61 -28,-1.8 2,-0.5 -2,-0.3 -54,-0.2 -0.990 20.3-165.2-125.7 125.5 -2.1 19.1 -1.9 103 26 D Y E +A 47 0A 6 -56,-2.3 -56,-2.0 -2,-0.4 -2,-0.0 -0.940 13.0 169.1-109.8 122.0 -3.3 16.5 -4.4 104 27 D T > + 0 0 58 -2,-0.5 3,-0.5 -58,-0.2 -46,-0.4 -0.877 8.6 179.7-132.1 100.3 -5.4 17.7 -7.4 105 28 D P T 3 + 0 0 35 0, 0.0 -61,-0.1 0, 0.0 -60,-0.1 0.233 59.0 98.9 -86.5 14.5 -5.8 15.0 -10.1 106 29 D K T 3 0 0 137 1,-0.3 -62,-0.1 -62,-0.2 -61,-0.0 0.941 360.0 360.0 -64.6 -51.6 -7.9 17.4 -12.2 107 30 D T < 0 0 123 -3,-0.5 -50,-0.5 0, 0.0 -1,-0.3 -0.979 360.0 360.0-162.1 360.0 -5.1 18.4 -14.6