==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=9-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER GROWTH FACTOR 04-FEB-93 1PCP . COMPND 2 MOLECULE: PORCINE SPASMOLYTIC PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: SUS SCROFA; . AUTHOR M.D.CARR,C.J.BAUER,M.J.GRADWELL,J.FEENEY . 106 1 7 7 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 6822.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 44 41.5 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 . 6 5.7 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 . 12 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 11 10.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 7 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.9 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 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 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 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 E 0 0 139 0, 0.0 31,-0.1 0, 0.0 29,-0.1 0.000 360.0 360.0 360.0 175.4 -10.6 -11.9 11.6 2 2 A K - 0 0 101 29,-0.1 3,-0.1 31,-0.1 29,-0.1 -0.246 360.0-179.0 162.7 102.7 -8.3 -9.6 13.5 3 3 A P - 0 0 14 0, 0.0 2,-0.3 0, 0.0 53,-0.1 0.967 53.0 -70.8 -75.0 -84.1 -5.3 -7.7 12.2 4 4 A A - 0 0 19 1,-0.1 5,-0.1 101,-0.1 101,-0.1 -0.873 29.1-105.6-159.4-171.6 -3.7 -5.8 15.0 5 5 A A S >>>S+ 0 0 21 -2,-0.3 4,-2.3 2,-0.2 3,-1.1 0.738 116.1 55.6 -98.5 -32.5 -4.2 -2.8 17.4 6 6 A a T 345S+ 0 0 24 1,-0.3 -1,-0.1 3,-0.2 100,-0.0 0.703 101.7 61.1 -72.1 -20.0 -1.7 -0.6 15.7 7 7 A R T 345S+ 0 0 38 2,-0.1 -1,-0.3 42,-0.1 -2,-0.2 0.577 122.3 20.6 -81.0 -11.0 -3.6 -1.2 12.5 8 8 A b T X45S+ 0 0 1 -3,-1.1 3,-1.4 97,-0.3 4,-0.2 0.677 131.4 36.8-117.1 -70.2 -6.6 0.4 14.2 9 9 A S T 3<5S+ 0 0 30 -4,-2.3 2,-1.0 96,-1.1 -3,-0.2 0.941 125.0 42.9 -50.8 -55.4 -5.5 2.6 17.1 10 10 A R T 3 - 0 0 110 -2,-0.2 3,-1.6 -3,-0.0 2,-0.7 -0.954 41.7 -88.0-144.4 161.3 -21.5 0.5 9.4 22 22 A P T 3 S+ 0 0 136 0, 0.0 0, 0.0 0, 0.0 0, 0.0 -0.614 115.0 28.4 -75.0 112.2 -23.1 3.1 11.7 23 23 A G T 3 S+ 0 0 68 -2,-0.7 0, 0.0 1,-0.1 0, 0.0 0.382 85.6 148.7 117.7 3.7 -24.0 1.3 14.9 24 24 A I < - 0 0 25 -3,-1.6 -1,-0.1 1,-0.1 3,-0.0 0.048 36.8-153.4 -58.3 175.8 -21.3 -1.3 14.8 25 25 A T - 0 0 82 1,-0.0 -1,-0.1 11,-0.0 11,-0.0 0.693 36.8-106.2-119.0 -55.3 -19.7 -2.6 18.0 26 26 A S S >> S+ 0 0 45 80,-0.0 4,-3.0 9,-0.0 3,-1.8 -0.443 103.4 63.7 159.9 -74.9 -16.2 -3.7 17.3 27 27 A D H 3> S+ 0 0 93 1,-0.3 4,-1.7 2,-0.3 5,-0.3 0.907 107.2 49.8 -41.4 -56.1 -15.8 -7.5 17.2 28 28 A Q H 34 S+ 0 0 129 1,-0.3 -1,-0.3 2,-0.2 4,-0.3 0.771 114.4 46.5 -55.6 -26.7 -18.1 -7.6 14.2 29 29 A d H <4>S+ 0 0 0 -3,-1.8 5,-1.3 2,-0.2 -2,-0.3 0.789 114.0 46.5 -84.4 -31.9 -15.9 -4.9 12.8 30 30 A F H <5S+ 0 0 7 -4,-3.0 3,-0.3 1,-0.2 -2,-0.2 0.536 111.0 53.9 -85.4 -8.8 -12.8 -6.8 13.7 31 31 A T T <5S+ 0 0 62 -4,-1.7 -1,-0.2 -5,-0.4 -2,-0.2 0.516 97.2 64.2 -99.5 -10.6 -14.2 -10.0 12.3 32 32 A S T 5S- 0 0 66 -4,-0.3 -1,-0.2 2,-0.3 -2,-0.1 0.207 121.6-103.0 -95.9 13.0 -15.0 -8.3 8.9 33 33 A G T 5S+ 0 0 23 1,-0.3 2,-0.3 -3,-0.3 -3,-0.2 0.545 91.9 113.5 76.6 7.9 -11.3 -7.9 8.3 34 34 A c < - 0 0 10 -5,-1.3 -1,-0.3 -6,-0.2 -2,-0.3 -0.712 63.2-125.7-108.9 161.2 -11.8 -4.2 9.2 35 35 A b E -A 47 0A 0 12,-2.8 12,-1.5 -2,-0.3 2,-0.3 -0.562 16.6-155.3-101.4 167.8 -10.5 -2.3 12.2 36 36 A F E +A 46 0A 26 10,-0.2 10,-0.2 -2,-0.2 -27,-0.1 -0.958 29.7 143.7-150.1 126.9 -12.4 -0.2 14.7 37 37 A D + 0 0 13 8,-2.2 8,-0.2 -2,-0.3 9,-0.1 0.623 13.4 178.9-122.0 -70.4 -11.4 2.6 17.0 38 38 A S + 0 0 23 7,-0.4 5,-0.1 6,-0.3 7,-0.1 -0.023 46.4 122.0 84.5 -31.1 -14.1 5.3 17.4 39 39 A Q + 0 0 98 6,-0.1 -1,-0.1 1,-0.1 6,-0.1 0.767 65.4 69.5 -30.4 -37.3 -11.7 7.1 19.6 40 40 A V S S- 0 0 55 4,-0.1 2,-0.2 5,-0.1 -2,-0.1 -0.809 86.3-145.2 -93.4 108.3 -12.3 9.9 17.1 41 41 A P S S+ 0 0 105 0, 0.0 2,-0.5 0, 0.0 -2,-0.1 -0.525 79.4 15.2 -75.1 136.2 -15.8 11.2 17.4 42 42 A G S S+ 0 0 81 1,-0.4 3,-0.1 -2,-0.2 -2,-0.0 -0.382 109.6 86.7 100.1 -52.7 -17.5 12.2 14.2 43 43 A V S S- 0 0 45 -2,-0.5 2,-0.6 1,-0.2 -1,-0.4 -0.029 100.9 -65.2 -70.1-179.9 -15.0 10.5 11.9 44 44 A P - 0 0 21 0, 0.0 -6,-0.3 0, 0.0 -1,-0.2 -0.605 43.6-173.8 -75.1 117.2 -15.2 6.9 10.8 45 45 A W S S+ 0 0 116 -2,-0.6 -8,-2.2 1,-0.2 2,-0.6 0.935 76.0 56.2 -74.0 -49.1 -14.8 4.6 13.8 46 46 A d E S+A 36 0A 6 -10,-0.2 -27,-1.8 -9,-0.1 -26,-0.6 -0.778 77.0 138.8 -89.5 118.8 -14.8 1.5 11.7 47 47 A F E -A 35 0A 12 -12,-1.5 -12,-2.8 -2,-0.6 -29,-0.1 -0.665 49.8 -73.6-140.2-165.6 -12.0 1.6 9.1 48 48 A K - 0 0 82 -14,-0.2 -14,-0.1 -2,-0.2 -31,-0.1 -0.553 46.5-105.9 -97.4 164.4 -9.4 -0.4 7.4 49 49 A P - 0 0 30 0, 0.0 -1,-0.2 0, 0.0 -41,-0.1 0.060 20.1-123.9 -75.0-170.2 -6.0 -1.5 8.8 50 50 A L + 0 0 11 11,-0.0 10,-0.8 -38,-0.0 2,-0.1 -0.436 41.7 166.7-138.2 59.4 -2.6 -0.2 8.0 51 51 A P + 0 0 70 0, 0.0 3,-0.1 0, 0.0 5,-0.1 -0.346 14.1 156.9 -75.0 157.3 -0.6 -3.2 6.8 52 52 A A + 0 0 10 1,-0.4 2,-0.2 3,-0.1 36,-0.1 0.031 60.9 30.5-172.8 39.6 2.8 -2.8 5.0 53 53 A Q S S- 0 0 62 5,-0.1 -1,-0.4 35,-0.1 33,-0.1 -0.830 77.3-107.4 168.1 155.4 4.6 -6.1 5.6 54 54 A E S S+ 0 0 194 -2,-0.2 2,-0.4 -3,-0.1 -1,-0.0 0.412 106.2 64.8 -77.9 2.2 4.2 -9.8 6.1 55 55 A S S > S- 0 0 50 0, 0.0 2,-3.4 0, 0.0 3,-1.5 -0.995 84.8-130.6-131.7 128.5 5.2 -9.2 9.7 56 56 A E T 3 S+ 0 0 122 -2,-0.4 -50,-0.1 1,-0.2 -2,-0.1 -0.263 92.9 84.4 -71.3 55.7 3.3 -7.1 12.2 57 57 A E T 3 S+ 0 0 91 -2,-3.4 42,-1.6 42,-0.0 43,-0.3 0.577 89.6 38.2-125.5 -31.7 6.5 -5.3 13.0 58 58 A e < + 0 0 0 -3,-1.5 41,-0.3 40,-0.2 -2,-0.1 0.935 70.0 156.0 -84.5 -78.9 6.6 -2.6 10.4 59 59 A V + 0 0 20 -4,-0.4 2,-0.2 1,-0.2 40,-0.0 0.807 23.5 120.8 49.5 116.9 3.0 -1.4 9.9 60 60 A M - 0 0 12 -10,-0.8 -1,-0.2 5,-0.0 2,-0.1 -0.701 53.4-112.5 163.1 145.4 2.9 2.1 8.5 61 61 A Q >> - 0 0 101 -2,-0.2 2,-2.6 -50,-0.2 3,-2.6 -0.350 58.1 -70.6 -87.7 171.1 1.6 4.2 5.6 62 62 A V T 34 S+ 0 0 80 1,-0.3 -1,-0.1 2,-0.2 -2,-0.0 -0.380 133.0 34.1 -63.3 79.0 3.7 5.9 2.9 63 63 A S T >4 S+ 0 0 106 -2,-2.6 3,-0.6 30,-0.1 -1,-0.3 0.074 100.7 71.8 161.5 -26.9 4.9 8.6 5.4 64 64 A A T <4 S+ 0 0 63 -3,-2.6 3,-0.2 1,-0.2 -2,-0.2 0.520 80.1 79.8 -86.9 -7.9 5.2 6.7 8.7 65 65 A R T >< S- 0 0 4 -4,-0.8 3,-0.5 1,-0.3 -1,-0.2 0.315 74.0-173.7 -80.3 8.6 8.3 4.9 7.2 66 66 A K T < - 0 0 66 -3,-0.6 -1,-0.3 1,-0.2 30,-0.1 -0.051 45.2 -84.9 36.0 -98.7 10.2 8.1 8.0 67 67 A N T 3 + 0 0 100 -3,-0.2 29,-0.3 25,-0.1 -1,-0.2 -0.008 59.5 160.5 160.7 82.5 13.4 7.0 6.4 68 68 A f < + 0 0 39 27,-2.3 28,-0.2 -3,-0.5 -2,-0.0 0.951 69.5 21.9 -77.6 -84.4 15.9 4.9 8.3 69 69 A G S S- 0 0 16 26,-0.6 28,-0.1 15,-0.3 15,-0.0 0.369 96.5 -86.1 -64.0-155.2 18.2 3.2 5.7 70 70 A Y > - 0 0 131 4,-0.1 3,-1.3 26,-0.0 25,-0.1 -0.849 20.4-119.1-122.5 158.5 18.7 4.5 2.2 71 71 A P T 3 S+ 0 0 129 0, 0.0 20,-0.1 0, 0.0 21,-0.0 0.343 115.6 57.8 -74.9 7.8 16.9 4.1 -1.1 72 72 A G T 3 S+ 0 0 70 2,-0.1 2,-0.0 0, 0.0 -3,-0.0 0.513 86.4 95.6-111.0 -13.4 20.2 2.6 -2.3 73 73 A I < - 0 0 22 -3,-1.3 21,-0.1 1,-0.1 22,-0.1 -0.289 64.0-140.2 -75.4 164.1 20.4 -0.2 0.2 74 74 A S > - 0 0 66 1,-0.2 4,-1.1 -2,-0.0 -4,-0.1 -0.528 26.8 -76.0-116.0-176.5 19.2 -3.7 -0.5 75 75 A P T 4 S+ 0 0 53 0, 0.0 2,-4.8 0, 0.0 -1,-0.2 -0.146 107.9 19.7 -74.9 174.4 17.4 -6.4 1.5 76 76 A E T > S+ 0 0 163 1,-0.3 4,-0.8 9,-0.1 9,-0.0 -0.219 122.0 60.9 63.4 -58.7 18.9 -8.6 4.1 77 77 A D H > S+ 0 0 86 -2,-4.8 4,-1.2 2,-0.2 -1,-0.3 0.850 103.1 52.5 -63.7 -35.2 21.6 -6.1 4.5 78 78 A g H >X S+ 0 0 0 -4,-1.1 3,-1.0 1,-0.2 4,-0.9 0.999 113.2 38.5 -62.4 -70.7 19.0 -3.5 5.5 79 79 A A H 34 S+ 0 0 72 1,-0.3 -1,-0.2 2,-0.2 -2,-0.2 0.646 103.6 83.1 -55.2 -12.8 17.3 -5.5 8.3 80 80 A A H 3< S- 0 0 53 -4,-0.8 -1,-0.3 1,-0.2 -2,-0.2 0.976 124.9 -22.3 -54.9 -62.6 20.9 -6.5 8.9 81 81 A R H << S+ 0 0 202 -4,-1.2 -2,-0.2 -3,-1.0 -1,-0.2 -0.237 130.3 61.6-147.9 48.9 21.7 -3.4 11.0 82 82 A N S < S- 0 0 51 -4,-0.9 2,-0.2 1,-0.2 -3,-0.2 0.132 87.3 -82.2-134.3-108.6 19.1 -0.8 9.9 83 83 A f - 0 0 18 1,-0.3 14,-0.2 14,-0.1 -1,-0.2 -0.813 67.4 -25.7-155.0-168.2 15.4 -1.0 10.2 84 84 A e E -B 96 0B 14 12,-1.8 12,-0.9 -2,-0.2 -1,-0.3 -0.017 51.2-154.2 -47.1 157.1 12.3 -2.4 8.6 85 85 A F E +B 95 0B 34 10,-0.2 2,-0.7 -3,-0.1 10,-0.2 -0.664 26.6 157.3-143.4 82.8 12.6 -3.0 4.8 86 86 A S > + 0 0 5 8,-1.6 3,-0.7 7,-0.2 6,-0.0 -0.840 4.6 163.3-112.0 93.2 9.3 -2.9 3.0 87 87 A D T 3 + 0 0 79 -2,-0.7 -1,-0.1 1,-0.2 5,-0.1 0.515 45.6 112.5 -83.4 -6.6 10.0 -2.1 -0.7 88 88 A T T 3 S+ 0 0 88 1,-0.2 -1,-0.2 -36,-0.1 -35,-0.1 0.769 80.4 48.8 -34.4 -34.0 6.5 -3.3 -1.5 89 89 A I S < S- 0 0 57 -3,-0.7 3,-0.4 -37,-0.1 -1,-0.2 -0.931 86.9-149.4-117.9 107.0 6.0 0.3 -2.3 90 90 A P S S+ 0 0 90 0, 0.0 -3,-0.0 0, 0.0 -2,-0.0 -0.466 78.0 42.8 -75.0 144.5 8.6 1.9 -4.6 91 91 A E S S+ 0 0 169 1,-0.4 -4,-0.0 -2,-0.2 0, 0.0 0.700 101.5 86.0 92.8 25.1 9.4 5.5 -4.2 92 92 A V S S- 0 0 18 -3,-0.4 2,-1.1 -5,-0.1 -1,-0.4 -0.925 93.0 -76.6-147.8 169.0 9.4 5.5 -0.4 93 93 A P + 0 0 35 0, 0.0 -7,-0.2 0, 0.0 -30,-0.1 -0.604 42.1 176.2 -75.1 100.6 11.7 4.7 2.5 94 94 A W S S+ 0 0 68 -2,-1.1 -8,-1.6 1,-0.2 2,-1.4 0.926 72.9 63.6 -68.9 -46.2 11.9 0.9 2.6 95 95 A g E S+B 85 0B 3 -10,-0.2 -27,-2.3 -25,-0.1 -26,-0.6 -0.674 78.0 152.4 -83.5 92.0 14.4 1.0 5.4 96 96 A F E -B 84 0B 0 -2,-1.4 -12,-1.8 -12,-0.9 -30,-0.1 -0.839 48.6 -89.6-122.2 159.5 12.3 2.6 8.2 97 97 A F - 0 0 107 -2,-0.3 2,-0.1 -14,-0.2 -14,-0.1 -0.280 48.8-101.8 -65.5 151.1 12.2 2.5 11.9 98 98 A P - 0 0 56 0, 0.0 -40,-0.2 0, 0.0 -1,-0.1 -0.423 32.2-106.4 -75.0 149.4 10.2 -0.2 13.7 99 99 A M - 0 0 55 -42,-1.6 -41,-0.1 -41,-0.3 -2,-0.1 0.805 46.4-171.9 -41.0 -36.7 6.8 0.7 15.2 100 100 A S + 0 0 89 -43,-0.3 -1,-0.1 1,-0.1 -43,-0.0 0.893 53.0 83.8 35.7 69.3 8.6 0.4 18.5 101 101 A V + 0 0 73 3,-0.0 -1,-0.1 0, 0.0 -2,-0.0 -0.022 43.5 177.5-151.1 -98.6 5.4 0.7 20.5 102 102 A E + 0 0 148 -3,-0.0 -2,-0.1 3,-0.0 -3,-0.0 0.417 56.0 111.4 90.0 0.7 3.0 -2.1 21.3 103 103 A D + 0 0 149 2,-0.0 2,-0.1 -97,-0.0 -1,-0.0 0.033 50.5 118.2 -92.8 25.2 0.9 0.4 23.3 104 104 A a + 0 0 26 -94,-0.0 2,-0.3 1,-0.0 -98,-0.2 -0.230 38.3 173.1 -83.1 177.0 -1.8 0.1 20.7 105 105 A H 0 0 99 -100,-0.6 -96,-1.1 -101,-0.1 -97,-0.3 -0.873 360.0 360.0-163.1-167.9 -5.3 -1.2 21.3 106 106 A Y 0 0 114 -2,-0.3 -69,-0.1 -98,-0.1 -101,-0.1 -0.409 360.0 360.0-113.4 360.0 -8.7 -1.7 19.7