==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HORMONE 07-AUG-09 3ILG . COMPND 2 MOLECULE: INSULIN A CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR N.RAGHAVENDRA,V.PATTABHI,S.S.RAJAN . 102 4 6 2 4 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6218.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 68 66.7 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 . 13 12.7 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 . 3 2.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 15 14.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 31 30.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 3.9 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 1 0 1 0 0 0 1 1 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 . 3 1 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 . 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 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 67 0, 0.0 4,-2.8 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0-173.0 -9.6 17.3 13.2 2 2 A I H > + 0 0 10 1,-0.2 4,-2.4 2,-0.2 5,-0.3 0.839 360.0 57.2 -50.2 -42.6 -10.3 14.3 10.8 3 3 A V H > S+ 0 0 16 46,-0.4 4,-1.0 2,-0.2 -1,-0.2 0.948 114.5 38.7 -59.1 -44.7 -6.7 13.1 10.8 4 4 A E H > S+ 0 0 50 -3,-0.3 4,-2.6 1,-0.2 5,-0.5 0.953 114.0 53.6 -71.2 -51.7 -6.7 12.8 14.5 5 5 A Q H X>S+ 0 0 64 -4,-2.8 4,-1.8 1,-0.2 5,-0.9 0.864 106.6 50.7 -50.1 -46.5 -10.3 11.4 14.8 6 6 A a H <5S+ 0 0 0 -4,-2.4 22,-2.0 3,-0.2 5,-0.2 0.838 117.6 41.0 -65.1 -33.7 -9.8 8.5 12.4 7 7 A b H <5S+ 0 0 45 -4,-1.0 -2,-0.2 -3,-0.5 -1,-0.2 0.881 124.8 30.9 -81.0 -43.5 -6.7 7.3 14.2 8 8 A T H <5S+ 0 0 114 -4,-2.6 -3,-0.2 -5,-0.1 -2,-0.2 0.850 139.2 5.5 -87.6 -38.9 -7.6 7.7 17.8 9 9 A S T <5S- 0 0 73 -4,-1.8 2,-0.3 -5,-0.5 -3,-0.2 0.675 99.8 -85.6-109.1 -96.5 -11.3 7.1 17.5 10 10 A I < - 0 0 82 -5,-0.9 2,-0.3 17,-0.1 17,-0.2 -0.817 33.7-163.2-177.6 152.3 -13.0 5.9 14.3 11 11 A a E -A 26 0A 1 15,-2.2 15,-2.4 -2,-0.3 2,-0.2 -0.948 15.1-122.7-145.9 163.8 -14.5 7.7 11.2 12 12 A S E > -A 25 0A 21 -2,-0.3 4,-1.9 13,-0.2 3,-0.2 -0.651 26.2-117.3-106.6 159.2 -16.8 7.0 8.3 13 13 A L H > S+ 0 0 41 11,-0.5 4,-1.2 -2,-0.2 -1,-0.1 0.853 118.3 60.3 -61.1 -28.6 -16.2 7.2 4.6 14 14 A Y H 4 S+ 0 0 138 2,-0.2 4,-0.4 1,-0.2 -1,-0.2 0.882 102.4 49.1 -67.5 -39.3 -18.9 9.8 4.7 15 15 A Q H >4 S+ 0 0 71 -3,-0.2 3,-1.2 1,-0.2 -1,-0.2 0.865 109.0 55.3 -61.5 -37.9 -16.9 12.1 7.1 16 16 A L H >< S+ 0 0 0 -4,-1.9 3,-2.3 1,-0.3 -1,-0.2 0.799 92.8 69.2 -65.8 -29.4 -13.9 11.7 4.8 17 17 A E G >< S+ 0 0 82 -4,-1.2 3,-1.3 1,-0.3 -1,-0.3 0.736 84.6 72.1 -66.2 -20.3 -15.9 12.9 1.8 18 18 A N G < S+ 0 0 126 -3,-1.2 -1,-0.3 -4,-0.4 -2,-0.2 0.719 93.0 55.3 -63.5 -20.4 -15.8 16.3 3.5 19 19 A Y G < S+ 0 0 81 -3,-2.3 28,-2.4 -4,-0.2 -1,-0.2 0.365 83.3 111.1 -98.6 3.7 -12.1 16.6 2.6 20 20 A c B < B 46 0B 18 -3,-1.3 26,-0.3 26,-0.2 25,-0.1 -0.378 360.0 360.0 -73.0 154.6 -12.6 16.1 -1.1 21 21 A N 0 0 90 24,-2.4 -1,-0.1 80,-0.2 -2,-0.1 -0.572 360.0 360.0 -81.0 360.0 -12.0 19.0 -3.4 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 0 185 0, 0.0 2,-0.2 0, 0.0 -11,-0.0 0.000 360.0 360.0 360.0 152.3 -20.1 1.3 4.1 24 2 B V - 0 0 106 1,-0.1 -11,-0.5 -12,-0.0 2,-0.1 -0.687 360.0 -90.6-110.8 166.8 -18.6 0.6 7.5 25 3 B N E -A 12 0A 101 -2,-0.2 2,-0.4 -13,-0.2 -13,-0.2 -0.360 44.1-136.7 -76.3 163.9 -16.7 2.7 10.0 26 4 B Q E -A 11 0A 44 -15,-2.4 -15,-2.2 -2,-0.1 2,-0.6 -0.944 21.1-156.9-139.7 130.7 -12.9 3.0 9.9 27 5 B H + 0 0 127 -2,-0.4 2,-0.5 -17,-0.2 -20,-0.2 -0.943 36.1 171.4-107.2 106.9 -9.9 3.0 12.2 28 6 B L + 0 0 20 -22,-2.0 2,-0.3 -2,-0.6 -20,-0.1 -0.927 11.6 170.8-134.0 112.0 -7.3 4.8 10.1 29 7 B b > - 0 0 45 -2,-0.5 3,-1.6 -22,-0.1 4,-0.3 -0.817 53.6 -25.9-115.9 151.2 -3.8 6.0 11.0 30 8 B G T >> S- 0 0 26 -2,-0.3 3,-1.2 1,-0.3 4,-1.0 -0.103 128.6 -0.1 54.5-135.4 -0.9 7.4 8.9 31 9 B S H 3> S+ 0 0 34 1,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.764 124.7 71.3 -57.1 -25.8 -0.7 6.5 5.3 32 10 B H H <> S+ 0 0 126 -3,-1.6 4,-1.9 1,-0.2 -1,-0.2 0.875 96.9 50.4 -62.2 -35.0 -3.8 4.4 5.7 33 11 B L H <> S+ 0 0 0 -3,-1.2 4,-2.4 -4,-0.3 -1,-0.2 0.910 108.7 50.7 -64.5 -44.4 -5.9 7.6 6.0 34 12 B V H X S+ 0 0 0 -4,-1.0 4,-2.4 1,-0.2 -2,-0.2 0.879 108.5 53.2 -65.1 -36.3 -4.4 9.0 2.9 35 13 B E H X S+ 0 0 49 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.934 110.0 47.8 -59.8 -45.5 -5.2 5.8 1.0 36 14 B A H X S+ 0 0 11 -4,-1.9 4,-2.6 1,-0.2 -2,-0.2 0.887 110.9 50.2 -64.6 -41.2 -8.8 6.1 2.2 37 15 B L H X S+ 0 0 2 -4,-2.4 4,-2.6 2,-0.2 5,-0.3 0.906 109.4 52.4 -58.6 -47.6 -9.1 9.7 1.1 38 16 B Y H X S+ 0 0 54 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.919 112.8 44.5 -55.5 -50.2 -7.7 8.8 -2.2 39 17 B L H < S+ 0 0 129 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.907 116.4 45.4 -61.6 -44.2 -10.4 6.1 -2.7 40 18 B V H < S+ 0 0 30 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.867 125.0 29.4 -70.3 -36.3 -13.2 8.2 -1.5 41 19 B c H >< S+ 0 0 6 -4,-2.6 3,-1.8 -5,-0.2 -2,-0.2 0.812 79.5 163.2 -95.2 -29.0 -12.4 11.3 -3.4 42 20 B G G >< S+ 0 0 25 -4,-2.3 3,-2.7 -5,-0.3 -1,-0.1 -0.127 72.8 5.8 31.3-118.2 -10.6 10.0 -6.6 43 21 B E G 3 S+ 0 0 172 1,-0.3 61,-0.4 60,-0.1 -1,-0.3 0.724 123.1 68.7 -64.8 -22.1 -10.5 12.4 -9.4 44 22 B R G < S- 0 0 92 -3,-1.8 -1,-0.3 1,-0.1 -2,-0.2 0.755 96.2-148.2 -56.1 -27.2 -11.9 15.2 -7.2 45 23 B G < - 0 0 0 -3,-2.7 -24,-2.4 -7,-0.2 2,-0.3 -0.070 9.6-132.1 65.6 179.9 -8.7 15.2 -5.2 46 24 B F E -BC 20 101B 0 55,-1.5 55,-2.9 -26,-0.3 2,-0.4 -0.959 6.8-114.6-155.6 166.4 -8.6 16.0 -1.5 47 25 B F E - C 0 100B 83 -28,-2.4 2,-0.6 -2,-0.3 53,-0.2 -0.945 19.1-153.5-109.8 137.2 -6.8 18.0 1.2 48 26 B Y E + C 0 99B 10 51,-3.4 51,-1.7 -2,-0.4 26,-0.2 -0.934 21.9 171.4-108.9 109.2 -4.8 16.2 3.9 49 27 B T - 0 0 73 -2,-0.6 -46,-0.4 49,-0.2 -47,-0.1 -0.735 6.5-177.4-130.5 84.1 -4.7 18.5 7.0 50 28 B P - 0 0 19 0, 0.0 2,-0.2 0, 0.0 -48,-0.1 -0.348 35.3-100.0 -70.5 150.5 -3.3 17.0 10.2 51 29 B K 0 0 144 -50,-0.1 47,-0.1 -2,-0.1 0, 0.0 -0.503 360.0 360.0 -64.9 145.3 -3.1 19.0 13.5 52 30 B T 0 0 161 -2,-0.2 45,-0.0 45,-0.1 -1,-0.0 -0.800 360.0 360.0-110.0 360.0 0.2 20.5 14.4 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,-2.7 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0-164.6 -0.6 19.6 -12.6 55 2 C I H >> + 0 0 2 47,-0.3 4,-3.3 1,-0.2 5,-0.5 0.824 360.0 55.0 -51.4 -39.4 0.8 17.0 -10.2 56 3 C V H >>S+ 0 0 32 49,-0.3 5,-2.7 2,-0.2 4,-1.8 0.936 112.6 42.4 -60.6 -46.3 -0.4 14.1 -12.5 57 4 C E H 4>S+ 0 0 93 -3,-0.3 5,-2.9 3,-0.2 -2,-0.2 0.953 119.5 44.3 -66.9 -46.8 1.3 15.5 -15.5 58 5 C Q H <5S+ 0 0 92 -4,-2.7 -2,-0.2 3,-0.2 -1,-0.2 0.888 130.9 18.1 -57.8 -48.3 4.5 16.4 -13.5 59 6 C d H <5S+ 0 0 0 -4,-3.3 22,-2.7 -5,-0.2 5,-0.4 0.686 133.0 30.1-109.1 -22.2 4.8 13.1 -11.4 60 7 C e T < - 0 0 25 -2,-0.3 4,-1.9 13,-0.1 5,-0.1 -0.474 33.0-111.5 -86.5 163.0 11.8 14.3 -7.8 66 13 C L H > S+ 0 0 97 1,-0.2 4,-1.2 2,-0.2 -1,-0.1 0.831 122.0 58.3 -61.9 -31.5 10.8 14.1 -4.1 67 14 C Y H 4 S+ 0 0 187 2,-0.2 4,-0.3 1,-0.2 3,-0.3 0.878 103.2 50.4 -62.0 -42.8 11.8 17.8 -4.0 68 15 C Q H >4 S+ 0 0 64 1,-0.2 3,-2.0 2,-0.2 -2,-0.2 0.900 104.8 58.9 -60.1 -40.8 9.2 18.5 -6.7 69 16 C L H >< S+ 0 0 0 -4,-1.9 3,-2.0 1,-0.3 -1,-0.2 0.811 91.5 68.5 -58.3 -29.8 6.7 16.7 -4.6 70 17 C E G >< S+ 0 0 86 -4,-1.2 3,-1.6 1,-0.3 -1,-0.3 0.697 81.4 77.5 -62.5 -18.7 7.3 19.2 -1.8 71 18 C N G < S+ 0 0 107 -3,-2.0 -1,-0.3 -4,-0.3 -2,-0.2 0.705 93.4 51.4 -57.7 -26.5 5.7 21.8 -4.0 72 19 C Y G < S+ 0 0 31 -3,-2.0 28,-1.7 -4,-0.2 -1,-0.3 0.262 83.3 112.3-103.2 10.6 2.3 20.2 -3.0 73 20 C f B < D 99 0B 12 -3,-1.6 26,-0.3 26,-0.2 25,-0.1 -0.564 360.0 360.0 -76.4 148.0 2.9 20.4 0.8 74 21 C N 0 0 90 24,-2.1 -1,-0.1 -26,-0.2 24,-0.1 -0.194 360.0 360.0 -72.9 360.0 0.6 22.8 2.8 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 0 260 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 110.5 19.7 7.8 -11.4 77 2 D V - 0 0 135 1,-0.1 0, 0.0 -14,-0.0 0, 0.0 -0.465 360.0-103.6 -70.5 152.3 16.6 8.8 -13.6 78 3 D N - 0 0 77 -2,-0.1 2,-0.3 1,-0.1 -1,-0.1 0.077 30.5-109.0 -79.2-176.4 13.4 9.4 -11.6 79 4 D Q B -E 64 0C 143 -15,-0.6 -15,-1.1 2,-0.0 2,-0.4 -0.840 18.5-114.3-120.4 153.9 10.3 7.4 -11.1 80 5 D H - 0 0 118 -2,-0.3 2,-0.5 -17,-0.2 -20,-0.2 -0.719 29.0-167.8 -82.2 129.4 6.6 7.5 -12.2 81 6 D L + 0 0 34 -22,-2.7 2,-0.3 -2,-0.4 -20,-0.1 -0.970 14.5 170.1-122.7 112.6 4.2 8.1 -9.3 82 7 D e >> - 0 0 50 -2,-0.5 3,-1.9 -22,-0.1 4,-0.5 -0.908 43.8 -29.4-126.2 150.0 0.5 7.5 -10.0 83 8 D G H >> S+ 0 0 19 -2,-0.3 4,-1.9 1,-0.3 3,-0.7 -0.113 128.1 1.9 56.6-132.9 -2.8 7.2 -8.1 84 9 D S H 3> S+ 0 0 31 1,-0.2 4,-2.3 2,-0.2 -1,-0.3 0.797 131.8 59.7 -60.9 -24.7 -2.4 6.0 -4.6 85 10 D H H <> S+ 0 0 127 -3,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.870 104.0 50.2 -70.5 -35.8 1.3 5.7 -5.0 86 11 D L H < S+ 0 0 5 -4,-3.0 3,-2.0 -5,-0.3 4,-0.3 0.826 76.8 154.2 -94.4 -39.7 4.9 16.4 3.6 95 20 D G G >< S+ 0 0 21 -4,-2.3 3,-1.5 -5,-0.4 -1,-0.1 -0.123 75.8 8.6 45.9-121.7 3.8 14.5 6.8 96 21 D E G 3 S+ 0 0 138 1,-0.3 -1,-0.3 -47,-0.1 3,-0.1 0.661 123.2 65.9 -65.3 -21.5 2.5 16.9 9.5 97 22 D R G < S- 0 0 117 -3,-2.0 -1,-0.3 1,-0.1 -2,-0.2 0.817 100.1-149.8 -63.4 -31.0 2.6 19.9 7.1 98 23 D G < - 0 0 0 -3,-1.5 -24,-2.1 -4,-0.3 2,-0.3 -0.162 10.8-137.3 81.8-178.5 -0.1 18.1 5.2 99 24 D F E -CD 48 73B 0 -51,-1.7 -51,-3.4 -26,-0.3 2,-0.4 -0.944 6.1-117.2-160.0 173.4 -0.7 18.4 1.5 100 25 D F E -C 47 0B 52 -28,-1.7 2,-0.6 -2,-0.3 -53,-0.2 -0.994 12.2-160.6-124.4 137.5 -3.2 18.8 -1.3 101 26 D Y E +C 46 0B 10 -55,-2.9 -55,-1.5 -2,-0.4 -80,-0.2 -0.949 22.6 163.7-113.6 103.1 -3.8 16.2 -4.0 102 27 D T > + 0 0 16 -2,-0.6 3,-1.3 -57,-0.2 -47,-0.3 -0.680 8.4 168.3-127.2 76.0 -5.6 18.0 -6.9 103 28 D P T 3 S+ 0 0 23 0, 0.0 -46,-0.1 0, 0.0 -47,-0.1 0.737 76.1 63.8 -63.8 -22.0 -5.4 15.9 -10.1 104 29 D K T 3 0 0 161 -61,-0.4 -60,-0.1 -60,-0.1 -59,-0.1 0.765 360.0 360.0 -71.4 -24.7 -7.9 18.2 -11.9 105 30 D T < 0 0 120 -3,-1.3 -49,-0.3 0, 0.0 -3,-0.1 -0.336 360.0 360.0 -68.8 360.0 -5.4 21.0 -11.6