==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXYGEN STORAGE/TRANSPORT 14-JAN-05 1YJH . COMPND 2 MOLECULE: SALIVARY NITROPHORIN; . SOURCE 2 ORGANISM_SCIENTIFIC: CIMEX LECTULARIUS; . AUTHOR A.WEICHSEL,H.BADGANDI,W.R.MONTFORT . 280 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12720.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 170 60.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 15 5.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 67 23.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.7 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 . 2 0.7 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 . 17 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 25 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 29 10.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.4 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 1 0 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 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 0 0 0 PARALLEL BRIDGES PER LADDER . 4 0 0 0 0 2 3 1 1 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 2 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 3 A P 0 0 141 0, 0.0 91,-0.0 0, 0.0 279,-0.0 0.000 360.0 360.0 360.0 124.1 -21.9 17.7 12.7 2 4 A P - 0 0 53 0, 0.0 278,-0.1 0, 0.0 3,-0.1 0.025 360.0-131.9 -65.0 158.7 -20.4 14.3 13.8 3 5 A A S S+ 0 0 73 1,-0.1 277,-2.4 277,-0.1 2,-0.3 0.880 88.4 16.3 -69.3 -44.6 -20.1 12.9 17.3 4 6 A Q E -A 279 0A 89 275,-0.2 2,-0.3 276,-0.1 275,-0.2 -0.874 59.1-164.5-132.4 161.0 -16.4 11.9 16.8 5 7 A L E -A 278 0A 4 273,-2.2 273,-3.1 -2,-0.3 2,-0.3 -0.972 18.6-128.9-141.0 157.0 -13.3 12.6 14.6 6 8 A S E -A 277 0A 23 -2,-0.3 31,-2.2 271,-0.2 30,-0.7 -0.840 19.4-170.3-109.9 143.1 -9.9 10.8 14.1 7 9 A V E -Ab 276 37A 0 269,-2.4 269,-2.7 -2,-0.3 2,-0.4 -0.999 5.1-165.0-134.8 129.3 -6.5 12.5 14.3 8 10 A H E -Ab 275 38A 8 29,-2.3 31,-2.7 -2,-0.4 2,-0.4 -0.984 9.8-175.2-110.2 137.9 -3.2 11.0 13.3 9 11 A T E -Ab 274 39A 2 265,-2.6 265,-2.7 -2,-0.4 2,-0.3 -0.972 4.2-179.8-127.3 141.0 0.0 12.7 14.4 10 12 A V E +Ab 273 40A 2 29,-2.2 31,-3.1 -2,-0.4 2,-0.4 -0.996 1.1 178.8-135.9 137.2 3.6 11.8 13.5 11 13 A S E -Ab 272 41A 3 261,-1.8 261,-2.4 -2,-0.3 2,-0.3 -0.965 1.3-178.2-130.7 159.3 6.8 13.4 14.6 12 14 A W E - b 0 42A 10 29,-1.5 31,-1.8 -2,-0.4 2,-1.6 -0.920 31.6-141.3-157.1 125.9 10.4 12.7 13.9 13 15 A N E + b 0 43A 16 -2,-0.3 256,-0.4 29,-0.2 31,-0.2 -0.721 40.7 165.8 -79.5 92.2 13.6 14.1 14.9 14 16 A S E > - 0 0 7 -2,-1.6 3,-2.1 29,-1.6 2,-0.3 0.623 17.8-167.1 -98.6 -12.5 14.9 13.5 11.4 15 17 A G E 3 S- b 0 44A 14 28,-2.0 30,-1.8 1,-0.3 -1,-0.2 -0.466 70.1 -15.7 70.7-126.2 18.0 15.7 11.5 16 18 A H T 3 S+ 0 0 151 -2,-0.3 -1,-0.3 28,-0.2 2,-0.1 0.452 105.5 124.4 -90.4 -1.7 19.5 16.3 8.1 17 19 A E < - 0 0 78 -3,-2.1 -3,-0.1 1,-0.1 28,-0.1 -0.347 59.6-125.8 -68.9 135.4 17.4 13.4 6.5 18 20 A R - 0 0 184 1,-0.1 -1,-0.1 -2,-0.1 -2,-0.0 -0.327 41.8 -82.8 -65.0 153.4 15.2 14.0 3.5 19 21 A A - 0 0 26 35,-0.1 -1,-0.1 1,-0.1 4,-0.1 -0.323 55.4-117.0 -52.8 139.5 11.5 13.0 3.7 20 22 A P - 0 0 15 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.099 10.7-122.1 -76.5-173.5 11.1 9.2 2.9 21 23 A T S S+ 0 0 126 1,-0.2 2,-1.0 2,-0.0 3,-0.1 0.873 96.6 64.5 -99.4 -52.6 9.3 7.6 -0.1 22 24 A N > + 0 0 80 1,-0.2 4,-0.6 2,-0.1 -1,-0.2 -0.697 57.6 160.9 -77.1 97.0 6.8 5.3 1.6 23 25 A L H > + 0 0 7 -2,-1.0 4,-2.2 2,-0.2 6,-0.2 0.584 58.3 76.9-101.8 -15.2 4.6 8.0 3.4 24 26 A E H 4>S+ 0 0 77 2,-0.2 5,-3.1 1,-0.2 6,-0.9 0.927 98.6 42.6 -62.8 -47.8 1.6 5.7 3.9 25 27 A E H >45S+ 0 0 42 3,-0.2 3,-1.2 4,-0.2 -1,-0.2 0.918 111.1 57.2 -60.4 -46.0 3.2 3.9 6.7 26 28 A L H 3<5S+ 0 0 6 -4,-0.6 -2,-0.2 1,-0.3 -1,-0.2 0.885 113.1 39.8 -52.6 -42.3 4.6 7.2 8.2 27 29 A L T 3<5S- 0 0 1 -4,-2.2 -1,-0.3 246,-0.1 -2,-0.2 0.474 114.5-113.8 -94.2 3.2 1.0 8.7 8.4 28 30 A G T < 5S+ 0 0 0 -3,-1.2 5,-0.2 -4,-0.5 -3,-0.2 0.836 82.3 120.4 70.5 37.1 -0.6 5.5 9.5 29 31 A L > < + 0 0 2 -5,-3.1 3,-2.2 -6,-0.2 -4,-0.2 0.538 38.9 99.3-104.3 -9.8 -2.7 5.0 6.3 30 32 A N T 3 S+ 0 0 90 -6,-0.9 -1,-0.1 1,-0.3 -5,-0.1 0.387 81.8 50.0 -66.0 -0.7 -1.2 1.6 5.3 31 33 A S T 3 S- 0 0 88 -3,-0.2 -1,-0.3 -7,-0.2 -2,-0.1 0.010 124.5 -98.1-121.9 24.2 -4.2 -0.5 6.7 32 34 A G S < S+ 0 0 61 -3,-2.2 -2,-0.2 1,-0.2 -3,-0.1 0.501 71.9 149.0 72.5 10.1 -6.8 1.7 4.9 33 35 A E - 0 0 82 -5,-0.2 -1,-0.2 -4,-0.1 -2,-0.1 -0.411 33.4-156.1 -64.9 150.4 -7.8 4.0 7.8 34 36 A T - 0 0 86 -2,-0.1 -28,-0.2 55,-0.0 -5,-0.1 -0.761 12.4-160.7-129.5 83.9 -8.8 7.6 6.7 35 37 A P - 0 0 1 0, 0.0 -28,-0.2 0, 0.0 3,-0.1 -0.317 19.0-133.3 -64.4 149.8 -8.2 9.9 9.7 36 38 A D S S+ 0 0 25 -30,-0.7 53,-2.3 1,-0.2 2,-0.4 0.838 90.0 25.7 -72.0 -35.0 -10.0 13.3 9.7 37 39 A V E -bC 7 88A 0 -31,-2.2 -29,-2.3 51,-0.2 2,-0.4 -0.984 65.1-170.2-131.8 141.2 -7.0 15.2 10.6 38 40 A I E -bC 8 87A 0 49,-2.3 49,-3.1 -2,-0.4 2,-0.4 -0.994 1.9-172.0-128.0 130.0 -3.2 14.5 10.1 39 41 A A E -bC 9 86A 0 -31,-2.7 -29,-2.2 -2,-0.4 2,-0.4 -0.974 2.1-168.4-120.3 137.0 -0.4 16.5 11.6 40 42 A V E -bC 10 85A 16 45,-2.6 45,-2.2 -2,-0.4 2,-0.4 -0.981 7.6-178.7-123.7 122.3 3.3 15.9 10.7 41 43 A A E -bC 11 84A 1 -31,-3.1 -29,-1.5 -2,-0.4 2,-0.3 -0.948 0.8-179.8-124.1 137.4 6.2 17.5 12.8 42 44 A V E -bC 12 83A 35 41,-2.3 41,-1.8 -2,-0.4 2,-0.4 -0.958 13.1-161.1-131.5 153.8 9.9 17.3 12.2 43 45 A Q E +bC 13 82A 21 -31,-1.8 -28,-2.0 -2,-0.3 -29,-1.6 -0.986 41.5 99.1-131.0 143.1 13.0 18.6 13.9 44 46 A G E -b 15 0A 1 37,-2.1 2,-0.4 -2,-0.4 -28,-0.2 -0.889 64.0 -52.5 174.2-146.8 16.3 18.8 12.1 45 47 A F S S- 0 0 95 -30,-1.8 36,-0.2 -2,-0.3 35,-0.1 -0.983 94.6 -1.1-139.2 126.3 18.6 21.2 10.4 46 48 A G > + 0 0 25 34,-1.7 4,-2.1 -2,-0.4 5,-0.5 0.637 65.5 142.0 80.7 22.2 18.3 23.6 7.5 47 49 A F T 4 S+ 0 0 45 33,-0.9 33,-0.2 32,-0.2 8,-0.1 0.859 73.2 48.8 -55.7 -40.7 14.6 23.2 6.4 48 50 A Q T 4 S+ 0 0 105 31,-0.5 -1,-0.1 1,-0.2 32,-0.1 0.981 115.9 38.3 -72.9 -57.3 14.1 26.9 5.7 49 51 A T T 4 S- 0 0 77 1,-0.0 -1,-0.2 4,-0.0 -2,-0.2 0.932 91.1-157.8 -51.1 -51.0 17.1 27.7 3.6 50 52 A D >< + 0 0 38 -4,-2.1 3,-1.3 30,-0.1 -3,-0.1 0.929 22.7 170.2 62.3 53.8 16.7 24.3 1.9 51 53 A K T 3 S+ 0 0 171 -5,-0.5 -4,-0.1 1,-0.3 -5,-0.1 0.748 77.2 54.0 -61.7 -31.0 20.4 23.9 0.8 52 54 A P T 3 S- 0 0 99 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.525 107.6-130.8 -75.1 -5.3 19.8 20.2 -0.2 53 55 A Q < + 0 0 158 -3,-1.3 4,-0.2 1,-0.1 -2,-0.1 0.944 63.2 137.1 52.5 54.7 16.8 21.5 -2.4 54 56 A Q > + 0 0 37 2,-0.1 4,-1.7 1,-0.1 3,-0.4 0.628 41.3 88.1-107.1 -18.4 14.5 18.8 -0.9 55 57 A G H > S+ 0 0 29 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.886 83.9 56.8 -38.4 -55.8 11.4 21.1 -0.4 56 58 A P H > S+ 0 0 88 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.880 106.5 49.6 -53.4 -44.7 10.1 20.4 -3.9 57 59 A A H > S+ 0 0 35 -3,-0.4 4,-3.4 -4,-0.2 5,-0.3 0.887 108.0 52.6 -59.4 -44.5 10.1 16.6 -3.3 58 60 A C H X S+ 0 0 36 -4,-1.7 4,-3.8 2,-0.2 5,-0.4 0.951 113.4 43.6 -54.2 -54.5 8.2 16.8 0.0 59 61 A V H X S+ 0 0 78 -4,-1.9 4,-3.4 2,-0.2 5,-0.4 0.971 116.0 47.7 -56.9 -58.2 5.4 18.9 -1.5 60 62 A K H X S+ 0 0 146 -4,-2.4 4,-2.8 -5,-0.2 -2,-0.2 0.936 119.2 38.9 -51.2 -55.3 5.2 16.8 -4.6 61 63 A N H X S+ 0 0 61 -4,-3.4 4,-1.5 2,-0.2 -1,-0.2 0.866 120.2 43.3 -67.4 -43.4 5.1 13.5 -2.7 62 64 A F H X S+ 0 0 21 -4,-3.8 4,-2.3 -5,-0.3 5,-0.3 0.939 116.8 46.9 -66.3 -46.8 2.9 14.6 0.2 63 65 A Q H X S+ 0 0 51 -4,-3.4 4,-2.0 -5,-0.4 5,-0.4 0.941 110.7 54.0 -63.9 -44.5 0.5 16.5 -2.1 64 66 A S H X S+ 0 0 81 -4,-2.8 4,-0.6 -5,-0.4 -1,-0.2 0.869 115.4 37.8 -50.7 -44.5 0.3 13.5 -4.5 65 67 A L H < S+ 0 0 35 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.881 121.7 41.2 -79.5 -36.0 -0.6 11.0 -1.8 66 68 A L H ><>S+ 0 0 1 -4,-2.3 5,-2.1 2,-0.2 3,-0.9 0.857 105.5 57.0 -89.7 -38.8 -3.0 13.1 0.3 67 69 A T H ><5S+ 0 0 89 -4,-2.0 3,-2.0 -5,-0.3 -1,-0.1 0.931 104.1 54.8 -55.5 -53.1 -5.1 15.1 -2.2 68 70 A S T 3<5S+ 0 0 101 -4,-0.6 -1,-0.3 -5,-0.4 -2,-0.2 0.630 106.4 56.4 -54.7 -13.8 -6.3 11.9 -3.9 69 71 A K T < 5S- 0 0 61 -3,-0.9 -1,-0.3 2,-0.1 -2,-0.2 0.531 124.5-101.1 -97.7 -2.6 -7.4 10.9 -0.4 70 72 A G T < 5S+ 0 0 34 -3,-2.0 20,-3.0 -4,-0.3 21,-0.4 0.491 74.3 140.4 97.7 6.6 -9.6 14.0 0.2 71 73 A Y E < -D 89 0A 6 -5,-2.1 2,-0.4 18,-0.3 -1,-0.3 -0.610 36.9-157.6 -85.9 142.1 -7.2 16.0 2.4 72 74 A T E -D 88 0A 33 16,-3.4 16,-2.8 -2,-0.3 2,-0.8 -0.953 24.4-123.8-106.7 133.4 -6.6 19.7 2.2 73 75 A K E -D 87 0A 83 -2,-0.4 14,-0.3 14,-0.2 3,-0.1 -0.713 24.5-172.5 -74.0 107.7 -3.2 21.1 3.6 74 76 A L E - 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