==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-MAY-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HORMONE 07-MAY-10 2KXK . COMPND 2 MOLECULE: INSULIN A CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR W.BOCIAN,L.KOZERSKI . 54 2 3 1 2 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 4178.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 29 53.7 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 . 2 3.7 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 . 1 1.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 7 13.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 15 27.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 3.7 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 0 0 0 0 0 0 1 0 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 . 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 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 36 0, 0.0 3,-2.2 0, 0.0 4,-1.1 0.000 360.0 360.0 360.0-141.3 9.1 -4.7 3.7 2 2 A I H 3> + 0 0 10 48,-0.4 4,-0.8 1,-0.3 3,-0.2 0.730 360.0 57.1 -37.2 -47.6 10.1 -7.8 1.8 3 3 A V H 34 S+ 0 0 61 1,-0.2 4,-0.3 2,-0.2 -1,-0.3 0.706 110.7 42.3 -70.0 -21.0 10.5 -6.2 -1.7 4 4 A E H <>>S+ 0 0 102 -3,-2.2 4,-2.8 47,-0.2 5,-0.5 0.779 98.8 72.6 -91.2 -28.7 13.1 -3.6 -0.5 5 5 A Q H <5S+ 0 0 100 -4,-1.1 4,-0.3 1,-0.2 -2,-0.2 0.809 111.9 25.5 -64.6 -35.4 15.3 -5.9 1.8 6 6 A a T <5S+ 0 0 0 -4,-0.8 23,-2.1 23,-0.1 -1,-0.2 0.541 122.3 54.9-102.2 -12.6 16.9 -7.8 -1.1 7 7 A b T 45S+ 0 0 46 -4,-0.3 -2,-0.2 -5,-0.2 -3,-0.1 0.896 121.2 27.8 -83.3 -41.8 16.6 -5.1 -3.8 8 8 A T T <5S+ 0 0 103 -4,-2.8 2,-0.2 21,-0.1 -3,-0.2 0.656 136.0 13.3 -94.1 -19.1 18.4 -2.3 -1.7 9 9 A S S > - 0 0 10 -2,-0.3 4,-2.0 14,-0.1 3,-1.5 -0.751 48.7 -89.6-122.7 174.4 20.2 -15.3 1.9 13 13 A L H 3> S+ 0 0 111 1,-0.3 4,-2.2 -2,-0.2 -1,-0.0 0.873 127.3 59.2 -55.4 -36.7 17.7 -18.3 2.2 14 14 A Y H 34 S+ 0 0 183 1,-0.2 -1,-0.3 2,-0.2 4,-0.1 0.759 107.5 46.2 -64.6 -25.5 17.6 -17.6 6.0 15 15 A Q H X4 S+ 0 0 84 -3,-1.5 3,-1.2 2,-0.2 4,-0.3 0.822 108.0 55.4 -85.1 -33.7 16.3 -14.0 5.2 16 16 A L H >< S+ 0 0 3 -4,-2.0 3,-2.1 1,-0.2 4,-0.5 0.896 97.9 64.2 -63.8 -36.6 13.7 -15.4 2.6 17 17 A E T 3< S+ 0 0 86 -4,-2.2 3,-0.3 1,-0.3 -1,-0.2 0.649 86.9 72.7 -62.2 -12.0 12.3 -17.6 5.5 18 18 A N T < S+ 0 0 111 -3,-1.2 -1,-0.3 1,-0.2 -2,-0.2 0.760 98.7 46.7 -68.0 -24.6 11.3 -14.3 7.2 19 19 A Y S < S+ 0 0 22 -3,-2.1 29,-2.4 -4,-0.3 -2,-0.2 0.484 88.8 113.2-101.7 -6.4 8.5 -13.9 4.6 20 20 A c B S-A 47 0A 10 -4,-0.5 27,-0.3 -3,-0.3 23,-0.1 -0.147 80.6 -82.0 -51.8 156.6 7.2 -17.5 4.9 21 21 A N 0 0 102 25,-2.5 -1,-0.1 21,-0.3 25,-0.1 -0.259 360.0 360.0 -59.2 148.8 3.7 -18.2 6.3 22 22 A G 0 0 106 -3,-0.1 -1,-0.2 25,-0.0 -3,-0.0 -0.289 360.0 360.0 158.3 360.0 3.3 -18.3 10.2 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 0 155 0, 0.0 -12,-0.0 0, 0.0 -14,-0.0 0.000 360.0 360.0 360.0-177.7 26.6 -14.5 4.0 25 2 B V - 0 0 77 1,-0.1 -14,-0.1 -15,-0.0 0, 0.0 -0.140 360.0-137.6 -50.9 138.1 26.1 -14.3 0.1 26 3 B N + 0 0 144 -16,-0.1 2,-0.2 2,-0.0 -1,-0.1 0.056 55.3 137.2 -88.0 22.8 26.4 -10.8 -1.5 27 4 B Q - 0 0 77 -16,-0.3 -16,-1.5 1,-0.0 2,-0.3 -0.469 38.7-156.6 -78.7 144.5 23.4 -11.3 -3.9 28 5 B H - 0 0 104 -18,-0.2 2,-0.3 -2,-0.2 -21,-0.2 -0.908 10.3-175.8-111.8 146.2 20.7 -8.7 -4.7 29 6 B L + 0 0 39 -23,-2.1 2,-0.3 -20,-0.4 -20,-0.1 -0.995 3.7 175.7-141.2 138.2 17.2 -9.7 -6.0 30 7 B b > - 0 0 58 -2,-0.3 3,-1.3 -23,-0.1 4,-0.4 -0.957 49.8 -11.7-140.9 156.1 14.3 -7.4 -7.1 31 8 B G T >> S- 0 0 48 -2,-0.3 4,-1.8 1,-0.2 3,-0.7 -0.220 128.5 -4.7 57.3-136.4 10.7 -7.9 -8.6 32 9 B S H 3> S+ 0 0 88 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.752 131.2 63.0 -63.4 -23.8 9.9 -11.4 -9.9 33 10 B H H <> S+ 0 0 128 -3,-1.3 4,-1.8 2,-0.2 -1,-0.2 0.889 106.3 45.1 -67.3 -37.7 13.5 -12.7 -9.2 34 11 B L H <> S+ 0 0 2 -3,-0.7 4,-2.3 -4,-0.4 -2,-0.2 0.892 112.6 51.3 -71.8 -38.8 12.9 -12.0 -5.5 35 12 B V H X S+ 0 0 52 -4,-1.8 4,-2.6 2,-0.2 -2,-0.2 0.921 109.0 51.5 -61.6 -43.1 9.4 -13.7 -5.7 36 13 B E H X S+ 0 0 132 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.902 110.2 47.7 -65.3 -39.9 11.0 -16.7 -7.4 37 14 B A H X S+ 0 0 25 -4,-1.8 4,-2.2 2,-0.2 5,-0.2 0.944 114.3 46.7 -64.3 -45.0 13.7 -17.1 -4.6 38 15 B L H X>S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 5,-0.5 0.875 109.3 56.0 -62.9 -35.4 10.9 -16.7 -1.9 39 16 B Y H X5S+ 0 0 132 -4,-2.6 4,-1.8 3,-0.2 5,-0.3 0.896 110.9 43.9 -62.9 -38.8 8.8 -19.3 -4.0 40 17 B L H <5S+ 0 0 160 -4,-1.9 -2,-0.2 2,-0.2 -1,-0.2 0.872 120.2 40.3 -75.9 -35.8 11.7 -21.8 -3.7 41 18 B V H <5S+ 0 0 24 -4,-2.2 -2,-0.2 -5,-0.1 -1,-0.2 0.796 140.5 6.0 -78.9 -30.6 12.4 -21.1 0.0 42 19 B c H >X5S+ 0 0 2 -4,-2.5 3,-2.3 -5,-0.2 4,-2.1 0.518 91.6 103.3-135.4 -12.1 8.7 -20.9 1.1 43 20 B G T 3<