==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL PROTEIN 11-JUL-08 2K6N . COMPND 2 MOLECULE: SUPERVILLIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.W.BROWN,V.DIDEM,C.MCKNIGHT . 67 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 4926.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 34 50.7 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 . 0 0.0 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 . 5 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 6 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 20 29.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 3.0 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 1 1 0 1 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 . 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 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 10 A M 0 0 202 0, 0.0 5,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -31.9 89.3 -8.8 3.9 2 11 A L + 0 0 169 1,-0.1 0, 0.0 3,-0.1 0, 0.0 0.906 360.0 45.0 -81.0 -45.9 90.1 -10.1 7.3 3 12 A A S S+ 0 0 101 2,-0.0 2,-0.3 1,-0.0 -1,-0.1 0.881 118.2 47.9 -65.5 -39.3 91.0 -13.6 6.3 4 13 A K S S- 0 0 168 2,-0.0 2,-0.6 0, 0.0 -1,-0.0 -0.817 79.0-137.9-106.6 145.4 93.0 -12.4 3.4 5 14 A L - 0 0 154 -2,-0.3 2,-0.9 2,-0.0 -3,-0.1 -0.896 10.5-149.4-106.2 116.2 95.7 -9.6 3.4 6 15 A C - 0 0 126 -2,-0.6 2,-0.9 -5,-0.3 -2,-0.0 -0.734 10.6-156.2 -87.0 105.3 95.6 -7.2 0.5 7 16 A K + 0 0 151 -2,-0.9 2,-0.5 2,-0.0 25,-0.0 -0.724 18.8 174.4 -85.8 107.8 99.2 -6.0 -0.0 8 17 A T - 0 0 97 -2,-0.9 2,-0.3 25,-0.0 -2,-0.0 -0.963 19.8-144.8-119.4 125.8 99.1 -2.6 -1.8 9 18 A I - 0 0 44 -2,-0.5 24,-0.2 1,-0.0 23,-0.0 -0.646 16.1-126.4 -89.1 143.7 102.2 -0.6 -2.5 10 19 A Y - 0 0 61 22,-1.3 2,-0.2 -2,-0.3 24,-0.1 -0.661 41.0 -87.2 -89.2 142.3 102.1 3.2 -2.3 11 20 A P > - 0 0 75 0, 0.0 4,-1.2 0, 0.0 5,-0.4 -0.290 33.5-139.8 -52.9 111.1 103.4 5.2 -5.4 12 21 A L H >> S+ 0 0 44 1,-0.2 4,-3.4 -2,-0.2 3,-0.5 0.826 101.6 49.0 -39.4 -45.7 107.2 5.6 -4.9 13 22 A A H 3> S+ 0 0 62 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.979 105.2 54.9 -61.6 -58.0 107.0 9.2 -6.2 14 23 A D H 34 S+ 0 0 47 1,-0.2 4,-0.3 2,-0.2 -1,-0.2 0.672 125.2 27.1 -48.8 -21.5 104.1 10.2 -4.0 15 24 A L H << S+ 0 0 8 -4,-1.2 -1,-0.2 -3,-0.5 -2,-0.2 0.624 104.0 75.0-116.1 -24.9 106.2 9.1 -1.0 16 25 A L H < S- 0 0 54 -4,-3.4 -2,-0.2 -5,-0.4 -3,-0.2 0.634 135.9 -23.4 -65.0 -11.4 109.7 9.5 -2.3 17 26 A A S < S+ 0 0 97 -4,-1.1 -1,-0.2 1,-0.2 -2,-0.2 0.201 116.8 93.2 167.7 44.2 109.2 13.2 -1.7 18 27 A R S S- 0 0 112 -4,-0.3 2,-1.8 -5,-0.0 -1,-0.2 -0.993 92.3 -75.2-151.1 145.0 105.4 14.1 -1.8 19 28 A P - 0 0 114 0, 0.0 -4,-0.1 0, 0.0 -5,-0.1 -0.043 67.9-169.5 -40.4 73.4 102.6 14.4 0.8 20 29 A L - 0 0 58 -2,-1.8 -5,-0.1 -5,-0.1 -6,-0.0 -0.232 18.5-103.4 -71.0 159.8 102.4 10.6 1.1 21 30 A P - 0 0 61 0, 0.0 -1,-0.1 0, 0.0 -11,-0.0 0.410 30.5-105.7 -62.3-155.1 99.7 8.7 2.9 22 31 A E S S+ 0 0 160 3,-0.1 -2,-0.1 1,-0.0 0, 0.0 0.749 110.0 68.4-109.7 -41.3 99.9 7.1 6.3 23 32 A G S S+ 0 0 37 2,-0.1 2,-0.8 1,-0.1 -13,-0.0 0.835 87.8 86.2 -48.4 -28.5 100.1 3.4 5.5 24 33 A V S S- 0 0 1 -15,-0.0 5,-0.1 8,-0.0 -1,-0.1 -0.634 78.7-150.4 -76.0 108.8 103.5 4.5 4.2 25 34 A D - 0 0 49 -2,-0.8 3,-0.3 3,-0.4 6,-0.2 -0.691 7.5-155.9 -85.7 132.3 105.8 4.5 7.2 26 35 A P S S+ 0 0 87 0, 0.0 3,-0.3 0, 0.0 -1,-0.1 0.860 89.3 65.6 -74.2 -37.5 108.6 7.0 7.1 27 36 A L S S+ 0 0 97 1,-0.3 2,-0.3 2,-0.1 40,-0.0 0.778 122.6 13.1 -57.0 -24.9 111.0 5.1 9.5 28 37 A K + 0 0 79 -3,-0.3 3,-0.4 1,-0.1 -3,-0.4 -0.822 56.1 173.9-158.5 112.6 111.1 2.5 6.7 29 38 A L S > S+ 0 0 6 -3,-0.3 3,-1.9 -2,-0.3 4,-0.1 0.702 74.6 77.4 -88.4 -24.9 110.0 2.8 3.1 30 39 A E T 3 S+ 0 0 11 1,-0.3 3,-0.2 2,-0.2 -1,-0.2 0.522 86.9 64.4 -64.8 -4.6 111.3 -0.6 1.9 31 40 A I T 3 S+ 0 0 36 -3,-0.4 -1,-0.3 -6,-0.2 -2,-0.1 0.395 104.2 42.5 -99.8 2.2 108.3 -2.2 3.7 32 41 A Y S < S+ 0 0 10 -3,-1.9 -22,-1.3 -7,-0.1 2,-0.4 0.140 95.4 87.6-132.3 19.9 105.7 -0.7 1.4 33 42 A L - 0 0 0 -3,-0.2 13,-0.2 -24,-0.2 2,-0.1 -0.982 64.2-138.1-127.8 131.7 107.2 -0.9 -2.1 34 43 A T >> - 0 0 51 -2,-0.4 4,-4.3 -24,-0.1 3,-1.0 -0.453 43.7 -86.9 -82.8 156.8 106.9 -3.8 -4.5 35 44 A D H 3> S+ 0 0 81 1,-0.3 4,-3.0 2,-0.2 5,-0.1 0.734 133.0 51.6 -29.1 -40.4 109.8 -5.1 -6.6 36 45 A E H 3> S+ 0 0 150 2,-0.2 4,-2.1 3,-0.2 -1,-0.3 0.974 119.7 33.0 -66.0 -52.9 108.8 -2.5 -9.2 37 46 A D H <> S+ 0 0 6 -3,-1.0 4,-2.0 2,-0.2 5,-0.3 0.890 121.1 52.3 -67.4 -39.5 108.8 0.3 -6.6 38 47 A F H X>S+ 0 0 0 -4,-4.3 4,-3.0 2,-0.2 5,-1.9 0.877 109.3 50.2 -62.3 -40.6 111.7 -1.5 -4.8 39 48 A E H <5S+ 0 0 118 -4,-3.0 -2,-0.2 -5,-0.5 -1,-0.2 0.900 119.0 35.5 -66.6 -43.2 113.6 -1.7 -8.1 40 49 A F H <5S+ 0 0 150 -4,-2.1 -2,-0.2 -5,-0.1 -1,-0.2 0.630 128.1 38.7 -85.7 -15.5 113.2 2.1 -8.8 41 50 A A H <5S- 0 0 0 -4,-2.0 -3,-0.2 -5,-0.2 25,-0.2 0.824 142.4 -0.1-100.3 -44.6 113.4 3.0 -5.1 42 51 A L T <5S- 0 0 1 -4,-3.0 -3,-0.2 -5,-0.3 -4,-0.1 0.446 84.7-126.7-123.8 -8.8 116.1 0.7 -3.8 43 52 A D S >> - 0 0 41 -2,-0.1 4,-2.9 -3,-0.1 3,-1.1 -0.946 20.4-119.9-134.6 157.5 113.4 -6.5 -3.7 46 55 A R H 3>5S+ 0 0 68 -2,-0.3 4,-0.6 1,-0.3 -1,-0.1 0.810 122.0 46.4 -61.8 -28.4 111.2 -7.0 -0.6 47 56 A D H 345S+ 0 0 134 2,-0.2 -1,-0.3 3,-0.1 4,-0.1 0.518 115.4 46.8 -90.4 -7.8 112.4 -10.7 -0.7 48 57 A E H X>5S+ 0 0 98 -3,-1.1 4,-2.3 2,-0.1 3,-1.6 0.878 116.8 38.5 -95.3 -56.9 116.0 -9.6 -1.3 49 58 A Y H 3<5S+ 0 0 4 -4,-2.9 -3,-0.2 1,-0.3 -2,-0.2 0.825 103.0 76.0 -61.2 -32.2 116.4 -7.0 1.4 50 59 A N T 3< - 0 0 56 0, 0.0 4,-0.8 0, 0.0 -1,-0.1 -0.011 36.5-130.4 -52.7 162.3 121.7 -6.9 6.1 54 63 A A H > S+ 0 0 69 3,-0.2 4,-0.7 2,-0.1 -2,-0.1 0.727 107.3 37.5 -88.9 -24.6 119.7 -4.2 7.9 55 64 A W H > S+ 0 0 149 2,-0.2 4,-4.1 3,-0.2 5,-0.1 0.866 118.1 47.7 -91.1 -45.6 122.3 -1.5 7.6 56 65 A K H > S+ 0 0 117 2,-0.3 4,-1.3 1,-0.2 -2,-0.1 0.924 113.6 48.9 -62.0 -43.1 123.5 -2.5 4.1 57 66 A Q H >X S+ 0 0 30 -4,-0.8 4,-1.4 1,-0.2 3,-0.6 0.935 115.3 44.7 -61.0 -42.8 119.9 -2.6 2.9 58 67 A V H 3X S+ 0 0 22 -4,-0.7 4,-2.1 1,-0.2 5,-0.4 0.910 99.4 71.6 -65.5 -41.8 119.4 0.7 4.6 59 68 A N H 3X S+ 0 0 73 -4,-4.1 4,-1.1 1,-0.3 -1,-0.2 0.838 103.2 43.2 -40.4 -41.8 122.7 1.9 3.0 60 69 A L H S+ 0 0 0 -4,-1.4 4,-2.8 1,-0.3 5,-2.8 0.912 108.1 44.9 -46.6 -49.3 117.7 3.5 1.0 62 71 A K H <5S+ 0 0 144 -4,-2.1 -1,-0.3 3,-0.2 -2,-0.2 0.869 107.4 59.8 -63.6 -36.7 119.7 6.6 2.0 63 72 A A H <5S+ 0 0 74 -4,-1.1 -1,-0.2 -5,-0.4 -2,-0.2 0.881 116.9 31.6 -58.9 -39.1 121.4 6.5 -1.4 64 73 A K H <5S- 0 0 91 -4,-2.2 -2,-0.2 -3,-0.2 -1,-0.2 0.732 116.7-113.8 -90.0 -25.7 118.1 6.8 -3.1 65 74 A G T <5S+ 0 0 40 -4,-2.8 -3,-0.2 -5,-0.4 -4,-0.1 0.670 77.9 120.9 100.4 21.7 116.6 9.0 -0.3 66 75 A L < 0 0 8 -5,-2.8 -4,-0.1 -25,-0.2 -5,-0.1 0.957 360.0 360.0 -78.2 -82.0 113.9 6.6 0.9 67 76 A F 0 0 99 -9,-0.2 -5,-0.1 -40,-0.0 -1,-0.1 0.867 360.0 360.0 -38.4 360.0 114.6 5.9 4.6