==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HORMONE 06-MAY-12 4F1C . COMPND 2 MOLECULE: INSULIN A CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.P.FAVERO-RETTO,L.C.PALMIERI,L.M.T.R.LIMA . 102 4 6 2 4 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 5852.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 71 69.6 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 . 4 3.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 15.7 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 . 5 4.9 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 32 0, 0.0 4,-3.2 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0-159.3 -0.5 19.6 -17.7 2 2 A I H >> + 0 0 2 47,-0.3 4,-3.2 1,-0.2 5,-0.5 0.861 360.0 52.4 -54.9 -39.3 0.8 17.0 -15.3 3 3 A V H >>S+ 0 0 29 2,-0.2 5,-2.8 1,-0.2 4,-1.7 0.912 114.6 42.2 -68.2 -40.2 -0.4 14.1 -17.5 4 4 A E H 4>S+ 0 0 84 -3,-0.3 5,-2.6 3,-0.2 -2,-0.2 0.938 119.2 44.5 -67.0 -45.6 1.3 15.5 -20.5 5 5 A Q H <5S+ 0 0 89 -4,-3.2 -2,-0.2 3,-0.2 -3,-0.2 0.897 130.7 19.7 -66.5 -39.5 4.4 16.4 -18.6 6 6 A a H <5S+ 0 0 0 -4,-3.2 22,-3.3 -5,-0.2 5,-0.5 0.658 132.6 28.2-112.6 -27.0 4.7 13.2 -16.6 7 7 A b T < -A 25 0A 18 -2,-0.3 4,-2.3 13,-0.2 13,-0.2 -0.397 33.9-107.9 -87.2 169.5 11.6 14.2 -12.9 13 13 A L H > S+ 0 0 58 11,-0.7 4,-1.0 1,-0.2 -1,-0.1 0.855 122.5 58.8 -64.1 -35.4 10.6 14.1 -9.3 14 14 A Y H >4 S+ 0 0 143 2,-0.2 3,-0.7 1,-0.2 4,-0.3 0.910 105.4 47.5 -58.7 -47.4 11.6 17.7 -9.2 15 15 A Q H >4 S+ 0 0 55 1,-0.2 3,-2.6 2,-0.2 4,-0.3 0.909 104.5 60.4 -62.2 -41.1 9.0 18.5 -11.9 16 16 A L H >< S+ 0 0 0 -4,-2.3 3,-1.6 1,-0.3 -1,-0.2 0.791 92.1 68.0 -57.2 -25.6 6.5 16.5 -10.0 17 17 A E G X< S+ 0 0 74 -4,-1.0 3,-1.5 -3,-0.7 -1,-0.3 0.653 80.0 79.1 -67.5 -13.9 7.0 19.0 -7.2 18 18 A N G < S+ 0 0 110 -3,-2.6 -1,-0.3 -4,-0.3 -2,-0.2 0.753 92.1 52.0 -58.9 -25.5 5.4 21.6 -9.4 19 19 A Y G < S+ 0 0 33 -3,-1.6 28,-2.2 -4,-0.3 -1,-0.2 0.267 84.9 109.4-100.8 8.6 2.1 20.0 -8.4 20 20 A c B < B 46 0B 18 -3,-1.5 26,-0.3 26,-0.2 25,-0.1 -0.516 360.0 360.0 -74.7 155.7 2.6 20.2 -4.7 21 21 A N 0 0 110 24,-2.0 24,-0.1 80,-0.2 -1,-0.1 -0.242 360.0 360.0 -89.0 360.0 0.6 22.6 -2.7 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 0 190 0, 0.0 2,-0.2 0, 0.0 -11,-0.0 0.000 360.0 360.0 360.0-143.6 17.2 11.1 -9.5 24 2 B V - 0 0 92 -13,-0.1 -11,-0.7 2,-0.0 2,-0.4 -0.792 360.0-126.4-127.7 169.3 15.5 10.0 -12.7 25 3 B N E +A 12 0A 86 -2,-0.2 2,-0.2 -13,-0.2 -13,-0.2 -0.997 39.1 158.5-111.3 122.4 12.8 10.8 -15.3 26 4 B Q E -A 11 0A 114 -15,-1.3 -15,-1.7 -2,-0.4 2,-0.6 -0.794 48.9 -89.7-125.3 170.9 10.2 8.1 -16.0 27 5 B H - 0 0 118 -2,-0.2 2,-0.5 -17,-0.2 -20,-0.3 -0.810 43.2-173.2 -77.1 127.9 6.6 7.9 -17.4 28 6 B L + 0 0 10 -22,-3.3 2,-0.3 -2,-0.6 -20,-0.1 -0.986 11.4 170.4-128.7 115.8 4.3 8.2 -14.5 29 7 B b >> - 0 0 48 -2,-0.5 3,-1.6 -22,-0.1 4,-0.5 -0.931 41.9 -24.9-132.5 148.2 0.6 7.6 -15.3 30 8 B G H >> S- 0 0 17 -2,-0.3 4,-1.8 1,-0.3 3,-0.8 -0.143 128.3 -0.2 57.0-132.6 -2.6 7.2 -13.6 31 9 B S H 3> S+ 0 0 31 1,-0.3 4,-2.1 2,-0.2 -1,-0.3 0.819 133.3 59.5 -64.4 -26.0 -2.5 5.9 -10.1 32 10 B H H <> S+ 0 0 126 -3,-1.6 4,-1.7 2,-0.2 -1,-0.3 0.836 103.6 52.2 -69.3 -33.1 1.3 5.7 -10.4 33 11 B L H S+ 0 0 0 -4,-2.6 4,-3.4 1,-0.2 5,-0.6 0.922 110.0 50.7 -55.6 -44.9 2.9 13.1 -6.2 38 16 B Y H X5S+ 0 0 61 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.930 112.5 46.7 -59.4 -45.8 2.1 11.7 -2.8 39 17 B L H <5S+ 0 0 139 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.925 119.4 39.3 -58.9 -47.0 5.8 10.6 -2.4 40 18 B V H <5S+ 0 0 24 -4,-2.9 -2,-0.2 1,-0.1 -1,-0.2 0.883 128.5 28.5 -76.9 -41.9 7.1 13.9 -3.6 41 19 B c H ><5S+ 0 0 4 -4,-3.4 3,-2.1 -5,-0.2 4,-0.2 0.820 77.3 152.8 -92.7 -41.0 4.7 16.3 -1.9 42 20 B G G >< + 0 0 27 -2,-0.6 3,-1.6 49,-0.2 -47,-0.3 -0.685 11.2 174.9-135.5 78.3 -5.7 17.9 -12.2 50 28 B P T 3 S+ 0 0 24 0, 0.0 -47,-0.1 0, 0.0 -46,-0.1 0.746 81.1 62.2 -62.1 -24.5 -5.5 15.9 -15.4 51 29 B K T 3 0 0 171 45,-0.4 46,-0.1 1,-0.3 47,-0.0 0.675 360.0 360.0 -72.3 -25.3 -7.8 18.3 -17.4 52 30 B T < 0 0 105 -3,-1.6 -1,-0.3 0, 0.0 -4,-0.0 -0.642 360.0 360.0 133.9 360.0 -4.9 20.6 -16.6 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 61 0, 0.0 4,-3.3 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0-169.4 -9.4 16.6 7.9 55 2 C I H > + 0 0 6 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.851 360.0 55.3 -64.7 -38.5 -10.2 13.8 5.4 56 3 C V H > S+ 0 0 15 46,-0.4 4,-0.9 2,-0.2 -1,-0.2 0.940 116.8 37.4 -58.4 -47.0 -6.7 12.6 5.2 57 4 C E H >>S+ 0 0 47 1,-0.2 4,-3.5 2,-0.2 5,-0.5 0.906 115.6 53.5 -74.5 -42.7 -6.6 12.2 9.0 58 5 C Q H X5S+ 0 0 60 -4,-3.3 4,-2.1 1,-0.2 -2,-0.2 0.896 107.0 50.5 -58.3 -45.1 -10.2 11.0 9.3 59 6 C d H <5S+ 0 0 0 -4,-2.8 22,-2.1 -5,-0.2 5,-0.2 0.800 119.2 38.3 -64.2 -31.2 -9.8 8.2 6.8 60 7 C e H <5S+ 0 0 41 -4,-0.9 -2,-0.2 -3,-0.3 -1,-0.2 0.905 123.8 35.3 -89.4 -46.2 -6.8 6.9 8.5 61 8 C T H <5S+ 0 0 118 -4,-3.5 -3,-0.2 -5,-0.1 -2,-0.2 0.821 138.5 0.5 -79.5 -32.8 -7.7 7.4 12.3 62 9 C S S < - 0 0 20 -2,-0.3 4,-2.2 13,-0.2 3,-0.3 -0.680 25.1-117.2-105.2 159.6 -16.8 6.9 2.8 66 13 C L H > S+ 0 0 34 11,-0.4 4,-2.1 -2,-0.2 5,-0.1 0.793 117.2 60.2 -60.3 -28.6 -16.2 7.2 -0.9 67 14 C Y H 4 S+ 0 0 134 2,-0.2 4,-0.5 1,-0.2 -1,-0.2 0.882 105.5 45.9 -70.4 -37.1 -18.9 9.9 -0.8 68 15 C Q H >4 S+ 0 0 74 -3,-0.3 3,-1.1 1,-0.2 4,-0.2 0.886 111.6 52.7 -69.0 -40.8 -16.8 12.0 1.6 69 16 C L H >< S+ 0 0 0 -4,-2.2 3,-2.8 1,-0.3 4,-0.2 0.906 98.0 66.4 -60.1 -38.3 -13.8 11.3 -0.6 70 17 C E G >< S+ 0 0 80 -4,-2.1 3,-1.6 1,-0.3 -1,-0.3 0.752 85.9 70.5 -57.7 -25.4 -15.7 12.6 -3.6 71 18 C N G < S+ 0 0 115 -3,-1.1 -1,-0.3 -4,-0.5 -2,-0.2 0.658 92.8 59.6 -65.8 -15.7 -15.8 16.1 -2.0 72 19 C Y G < S+ 0 0 57 -3,-2.8 28,-2.1 -4,-0.2 -1,-0.3 0.448 80.0 106.7 -96.7 -0.6 -12.1 16.3 -2.8 73 20 C f B < D 99 0B 13 -3,-1.6 26,-0.3 26,-0.2 25,-0.1 -0.413 360.0 360.0 -66.6 154.5 -12.5 15.8 -6.5 74 21 C N 0 0 113 24,-2.0 -1,-0.1 -26,-0.2 -2,-0.1 -0.407 360.0 360.0 -78.7 360.0 -11.9 18.9 -8.6 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 0 186 0, 0.0 2,-0.3 0, 0.0 -11,-0.0 0.000 360.0 360.0 360.0 156.0 -20.1 1.2 -1.1 77 2 D V - 0 0 111 1,-0.1 -11,-0.4 -13,-0.0 2,-0.1 -0.764 360.0 -96.2-106.0 155.1 -18.4 0.4 2.1 78 3 D N - 0 0 100 -2,-0.3 2,-0.3 -13,-0.1 -13,-0.2 -0.339 43.1-134.7 -68.8 156.6 -16.6 2.7 4.5 79 4 D Q B -E 64 0C 41 -15,-3.6 -15,-2.1 -2,-0.1 2,-0.5 -0.837 18.3-158.9-122.0 143.7 -12.9 2.9 4.1 80 5 D H + 0 0 122 -2,-0.3 2,-0.5 -17,-0.2 -20,-0.2 -0.963 33.2 170.7-121.3 108.3 -9.9 2.9 6.4 81 6 D L + 0 0 20 -22,-2.1 2,-0.3 -2,-0.5 -20,-0.1 -0.964 11.5 176.4-134.5 118.3 -7.2 4.5 4.4 82 7 D e > - 0 0 44 -2,-0.5 3,-2.0 -22,-0.1 4,-0.2 -0.851 52.6 -24.9-118.6 154.3 -3.8 5.7 5.4 83 8 D G T >> S- 0 0 30 -2,-0.3 3,-1.5 1,-0.3 4,-0.9 -0.141 129.3 -0.0 50.3-130.3 -1.0 7.1 3.6 84 9 D S H 3> S+ 0 0 30 1,-0.3 4,-2.3 2,-0.2 -1,-0.3 0.735 123.5 71.6 -63.6 -22.4 -0.8 6.4 -0.1 85 10 D H H <> S+ 0 0 123 -3,-2.0 4,-2.0 1,-0.2 -1,-0.3 0.838 94.4 54.7 -65.2 -30.4 -4.0 4.3 0.1 86 11 D L H <> S+ 0 0 1 -3,-1.5 4,-3.0 2,-0.2 -1,-0.2 0.923 107.6 49.0 -64.7 -43.4 -6.0 7.5 0.6 87 12 D V H X S+ 0 0 0 -4,-0.9 4,-2.3 1,-0.2 -2,-0.2 0.907 109.7 51.8 -65.1 -40.3 -4.5 8.9 -2.6 88 13 D E H X S+ 0 0 45 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.930 110.5 48.9 -57.1 -46.7 -5.3 5.7 -4.5 89 14 D A H X S+ 0 0 11 -4,-2.0 4,-2.8 1,-0.2 5,-0.2 0.939 110.8 49.5 -62.5 -45.6 -8.8 5.9 -3.3 90 15 D L H X S+ 0 0 1 -4,-3.0 4,-2.6 1,-0.2 5,-0.4 0.909 108.9 53.9 -58.9 -41.4 -9.1 9.5 -4.3 91 16 D Y H X S+ 0 0 55 -4,-2.3 4,-2.2 -5,-0.2 -1,-0.2 0.938 112.4 43.2 -55.1 -49.0 -7.7 8.6 -7.7 92 17 D L H < S+ 0 0 135 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.929 116.9 46.6 -65.0 -46.5 -10.4 5.9 -8.2 93 18 D V H < S+ 0 0 30 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.857 120.4 35.6 -65.7 -39.1 -13.2 8.1 -6.9 94 19 D f H >< S+ 0 0 4 -4,-2.6 3,-1.9 -5,-0.2 4,-0.2 0.762 79.0 171.2 -94.0 -28.8 -12.4 11.3 -8.8 95 20 D G G >< S- 0 0 32 -4,-2.2 3,-1.4 -5,-0.4 -1,-0.2 -0.281 72.0 -2.0 55.7-128.6 -11.1 9.9 -12.1 96 21 D E G 3 S+ 0 0 149 1,-0.3 -45,-0.4 -47,-0.1 -1,-0.3 0.624 126.6 69.0 -74.9 -13.9 -10.6 12.5 -14.8 97 22 D R G < S- 0 0 101 -3,-1.9 -1,-0.3 1,-0.1 -2,-0.2 0.798 92.3-157.9 -67.9 -31.2 -11.8 15.2 -12.5 98 23 D G < - 0 0 0 -3,-1.4 -24,-2.0 -7,-0.2 2,-0.3 -0.186 4.7-127.6 71.7-170.7 -8.7 14.7 -10.4 99 24 D F E -CD 48 73B 0 -51,-1.6 -51,-2.9 -26,-0.3 2,-0.4 -0.972 5.3-109.6-163.9 167.0 -8.5 15.8 -6.8 100 25 D F E -C 47 0B 65 -28,-2.1 2,-0.7 -2,-0.3 -53,-0.2 -0.957 19.1-155.2-117.5 135.8 -6.7 17.7 -4.2 101 26 D Y E +C 46 0B 10 -55,-3.2 -55,-2.0 -2,-0.4 -80,-0.2 -0.922 21.8 168.0-109.0 111.1 -4.8 15.9 -1.4 102 27 D T - 0 0 56 -2,-0.7 -46,-0.4 -57,-0.2 -47,-0.2 -0.773 9.3-174.9-133.5 89.2 -4.5 18.2 1.6 103 28 D P - 0 0 24 0, 0.0 2,-0.2 0, 0.0 -48,-0.0 -0.335 37.1 -91.0 -70.4 158.6 -3.3 16.6 4.8 104 29 D K 0 0 138 -50,-0.1 -59,-0.1 -2,-0.1 0, 0.0 -0.514 360.0 360.0 -61.5 139.2 -3.2 18.5 8.0 105 30 D T 0 0 138 -2,-0.2 0, 0.0 -3,-0.1 0, 0.0 0.177 360.0 360.0 48.7 360.0 0.1 20.3 8.9