==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SIGNALING PROTEIN 15-APR-09 2WFX . COMPND 2 MOLECULE: SONIC HEDGEHOG PROTEIN N-PRODUCT; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR B.BISHOP,A.R.ARICESCU,K.HARLOS,C.A.O'CALLAGHAN,E.Y.JONES, . 569 8 10 6 4 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26714.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 336 59.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 10 1.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 143 25.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 7 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 2 0.4 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 . 54 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 50 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 37 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 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 1 0 0 0 0 1 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 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 PARALLEL BRIDGES PER LADDER . 4 4 4 9 3 2 0 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 . 2 0 3 1 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 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 40 A L 0 0 131 0, 0.0 125,-0.1 0, 0.0 124,-0.1 0.000 360.0 360.0 360.0 108.5 -26.0 18.0 1.4 2 41 A T - 0 0 107 123,-0.1 3,-0.1 1,-0.1 0, 0.0 -0.782 360.0-121.7 -91.1 114.0 -22.9 18.6 3.5 3 42 A P - 0 0 70 0, 0.0 119,-0.3 0, 0.0 118,-0.1 -0.021 33.7 -93.8 -50.0 150.0 -21.6 22.2 3.1 4 43 A L - 0 0 4 117,-2.1 120,-0.1 116,-0.1 2,-0.1 -0.334 42.7-116.6 -65.4 149.7 -18.1 22.7 1.8 5 44 A A > - 0 0 23 1,-0.2 3,-1.9 -3,-0.1 132,-0.3 -0.407 43.7 -71.7 -84.5 163.5 -15.3 23.2 4.4 6 45 A Y T 3 S+ 0 0 33 1,-0.3 -1,-0.2 -2,-0.1 344,-0.1 -0.265 119.4 2.2 -54.2 134.7 -13.2 26.3 4.9 7 46 A K T 3 S+ 0 0 79 130,-1.2 2,-0.3 1,-0.2 -1,-0.3 0.756 102.0 137.4 55.7 26.8 -10.7 26.8 2.1 8 47 A Q < - 0 0 65 -3,-1.9 129,-2.7 129,-0.1 2,-0.3 -0.789 32.9-168.9-102.1 148.8 -12.1 23.7 0.3 9 48 A F E -A 136 0A 54 -2,-0.3 127,-0.2 127,-0.2 -4,-0.0 -0.988 16.6-115.9-139.1 147.8 -12.7 23.5 -3.4 10 49 A I E S+A 135 0A 49 125,-2.0 125,-2.0 -2,-0.3 2,-0.2 -0.996 100.1 35.3-134.1 127.7 -14.5 21.0 -5.7 11 50 A P S S- 0 0 47 0, 0.0 2,-2.5 0, 0.0 9,-0.0 0.562 97.8-124.5 -65.6 162.6 -13.2 19.5 -7.8 12 51 A N S S+ 0 0 125 -2,-0.2 2,-0.2 8,-0.0 -2,-0.1 -0.282 80.8 83.5 -77.0 54.7 -10.1 19.1 -5.7 13 52 A V S S- 0 0 62 -2,-2.5 4,-0.0 1,-0.1 2,-0.0 -0.835 90.8 -60.6-143.2 178.8 -7.8 20.6 -8.3 14 53 A A > - 0 0 63 -2,-0.2 3,-0.7 1,-0.1 7,-0.2 -0.347 47.0-121.3 -66.0 148.8 -6.6 23.9 -9.7 15 54 A E T 3 S+ 0 0 25 1,-0.3 6,-2.4 5,-0.1 7,-0.5 0.815 105.2 54.1 -62.3 -34.1 -9.3 26.2 -11.1 16 55 A K T 3 S+ 0 0 73 5,-0.2 2,-0.3 4,-0.2 -1,-0.3 -0.362 85.2 108.6-105.0 54.0 -7.9 26.4 -14.6 17 56 A T S X >S- 0 0 45 -3,-0.7 5,-1.4 -2,-0.5 3,-1.0 -0.806 82.0-104.1-121.9 165.8 -7.6 22.8 -15.5 18 57 A L T 3 5S+ 0 0 145 -2,-0.3 -1,-0.1 1,-0.3 -3,-0.0 0.854 124.1 48.5 -56.3 -37.3 -9.5 20.5 -17.9 19 58 A G T 3 5S+ 0 0 56 -5,-0.1 -1,-0.3 2,-0.0 -4,-0.1 0.686 120.8 37.4 -76.5 -19.1 -11.3 19.0 -15.0 20 59 A A T < 5S- 0 0 0 -3,-1.0 -4,-0.2 -6,-0.2 -5,-0.1 0.325 127.0 -43.3-103.3-129.1 -12.2 22.4 -13.6 21 60 A S T 5S- 0 0 0 -6,-2.4 128,-0.3 1,-0.2 -5,-0.2 0.579 88.2-121.7 -86.3 -11.3 -13.1 25.7 -15.2 22 61 A G < - 0 0 11 -5,-1.4 -1,-0.2 -7,-0.5 -5,-0.2 -0.098 41.4 -33.6 95.9 168.7 -10.5 25.3 -17.9 23 62 A R - 0 0 184 1,-0.1 2,-0.4 -3,-0.1 -6,-0.1 -0.068 67.9 -96.1 -60.8 159.6 -7.5 27.3 -19.2 24 63 A Y - 0 0 44 -8,-0.2 -1,-0.1 1,-0.2 3,-0.1 -0.656 32.4-171.4 -82.3 127.2 -7.3 31.1 -19.1 25 64 A E - 0 0 79 -2,-0.4 2,-0.3 1,-0.3 -1,-0.2 0.955 47.6 -80.6 -82.2 -58.4 -8.3 32.7 -22.5 26 65 A G - 0 0 23 73,-0.0 2,-0.7 2,-0.0 -1,-0.3 -0.940 50.3 -57.2 167.6 172.9 -7.4 36.3 -21.9 27 66 A K - 0 0 86 -2,-0.3 2,-1.3 -3,-0.1 77,-0.1 -0.658 43.5-151.6 -79.8 114.4 -8.3 39.7 -20.4 28 67 A I - 0 0 7 75,-1.3 -1,-0.1 -2,-0.7 -2,-0.0 -0.664 21.5-176.9 -90.3 85.1 -11.7 40.8 -21.9 29 68 A T - 0 0 43 -2,-1.3 3,-0.3 1,-0.1 6,-0.1 -0.150 39.0-105.0 -72.2 173.9 -11.6 44.6 -21.8 30 69 A R S S+ 0 0 122 1,-0.2 5,-0.1 62,-0.1 -1,-0.1 0.922 122.0 45.6 -68.3 -45.5 -14.5 46.8 -22.8 31 70 A N S S+ 0 0 137 4,-0.1 2,-0.3 3,-0.1 -1,-0.2 0.512 91.4 109.2 -77.1 -3.9 -12.9 47.8 -26.1 32 71 A S S > S- 0 0 38 -3,-0.3 3,-2.1 1,-0.1 4,-0.2 -0.569 74.6-133.2 -73.5 133.7 -12.0 44.2 -26.7 33 72 A E G > S+ 0 0 168 -2,-0.3 3,-1.2 1,-0.3 -1,-0.1 0.828 103.8 64.1 -57.2 -34.2 -14.1 42.6 -29.5 34 73 A R G > S+ 0 0 104 1,-0.2 3,-1.6 2,-0.1 -1,-0.3 0.504 77.2 93.1 -70.4 -1.9 -14.8 39.5 -27.3 35 74 A F G X + 0 0 28 -3,-2.1 3,-2.3 1,-0.3 -1,-0.2 0.828 68.8 69.8 -60.5 -33.7 -16.7 41.8 -24.9 36 75 A K G < S+ 0 0 165 -3,-1.2 -1,-0.3 1,-0.3 -2,-0.1 0.486 81.8 73.6 -71.0 -1.0 -20.1 41.2 -26.5 37 76 A E G < S+ 0 0 104 -3,-1.6 2,-0.7 1,-0.1 25,-0.4 0.524 84.5 81.0 -82.0 -7.3 -20.0 37.6 -25.2 38 77 A L < - 0 0 7 -3,-2.3 23,-0.2 23,-0.1 -1,-0.1 -0.865 64.0-178.3-105.8 103.9 -20.7 39.2 -21.8 39 78 A T B -F 60 0B 62 21,-1.3 21,-1.3 -2,-0.7 -2,-0.0 -0.804 31.2-104.5-103.3 143.7 -24.4 40.0 -21.4 40 79 A P - 0 0 53 0, 0.0 2,-0.5 0, 0.0 19,-0.2 -0.208 28.7-133.8 -60.3 153.0 -25.9 41.7 -18.3 41 80 A N + 0 0 4 1,-0.1 18,-0.0 2,-0.1 16,-0.0 -0.954 25.0 174.8-117.2 117.1 -27.8 39.5 -15.8 42 81 A Y + 0 0 166 -2,-0.5 -1,-0.1 16,-0.0 4,-0.0 -0.132 17.0 155.3-114.1 36.5 -31.2 40.9 -14.5 43 82 A N > - 0 0 29 1,-0.2 3,-1.4 2,-0.1 -2,-0.1 -0.541 35.8-150.7 -68.2 110.5 -32.4 38.0 -12.4 44 83 A P T 3 S+ 0 0 102 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 0.712 93.2 64.7 -54.3 -24.4 -34.8 39.5 -9.9 45 84 A D T 3 S+ 0 0 60 2,-0.0 39,-0.9 38,-0.0 2,-0.4 0.016 93.4 78.0 -91.8 27.9 -34.0 36.8 -7.4 46 85 A I E < -b 84 0A 12 -3,-1.4 2,-0.6 37,-0.1 39,-0.2 -0.999 67.3-145.4-139.7 135.4 -30.4 37.9 -7.2 47 86 A I E -b 85 0A 64 37,-2.9 39,-3.4 -2,-0.4 2,-0.6 -0.882 13.2-165.2-102.5 118.8 -28.8 40.8 -5.3 48 87 A F E -b 86 0A 22 -2,-0.6 39,-0.2 37,-0.2 10,-0.1 -0.908 12.1-157.3-105.4 123.1 -25.8 42.5 -7.0 49 88 A K - 0 0 47 37,-2.7 -1,-0.2 -2,-0.6 38,-0.1 0.932 17.3-178.6 -61.9 -46.3 -23.7 44.8 -4.7 50 89 A D > + 0 0 36 36,-0.4 3,-1.8 37,-0.2 5,-0.1 0.890 9.4 168.6 46.5 48.1 -22.4 46.7 -7.8 51 90 A E T 3 S+ 0 0 55 36,-0.4 -1,-0.2 1,-0.3 37,-0.1 0.627 73.8 60.5 -65.7 -11.2 -20.2 48.8 -5.5 52 91 A E T 3 S- 0 0 51 1,-0.0 -1,-0.3 0, 0.0 -2,-0.1 0.637 97.1-142.1 -87.2 -17.1 -18.6 50.1 -8.7 53 92 A N S < S+ 0 0 141 -3,-1.8 -2,-0.1 1,-0.1 -3,-0.0 0.382 80.8 100.8 69.4 -5.1 -21.9 51.5 -9.9 54 93 A T S S- 0 0 73 1,-0.0 -1,-0.1 0, 0.0 -3,-0.1 0.648 89.7-128.4 -82.2 -16.6 -20.8 50.3 -13.4 55 94 A G >> + 0 0 15 -5,-0.1 3,-1.3 1,-0.1 4,-0.6 0.743 64.6 139.1 72.6 23.8 -22.9 47.2 -13.1 56 95 A A T 34 + 0 0 2 1,-0.3 34,-1.6 2,-0.2 3,-0.1 0.641 58.4 72.4 -72.7 -14.2 -19.9 45.0 -14.0 57 96 A D T 34 S+ 0 0 0 32,-0.2 -1,-0.3 1,-0.2 31,-0.1 0.570 97.1 49.6 -76.8 -9.0 -21.1 42.5 -11.4 58 97 A R T <4 S+ 0 0 57 -3,-1.3 2,-0.3 32,-0.1 -1,-0.2 0.697 85.8 98.2-100.9 -26.3 -23.9 41.5 -13.7 59 98 A L < + 0 0 16 -4,-0.6 31,-0.6 -19,-0.2 2,-0.3 -0.490 51.0 139.5 -68.7 126.5 -21.9 41.0 -16.9 60 99 A M B -F 39 0B 1 -21,-1.3 -21,-1.3 -2,-0.3 46,-0.2 -0.986 52.2 -86.4-163.5 158.7 -21.1 37.3 -17.3 61 100 A T > - 0 0 19 44,-2.3 4,-2.3 -2,-0.3 3,-0.4 -0.287 45.2-106.2 -69.5 158.2 -20.8 34.5 -20.0 62 101 A Q H > S+ 0 0 123 -25,-0.4 4,-1.8 1,-0.2 5,-0.1 0.911 120.7 51.2 -51.3 -50.3 -23.9 32.5 -21.0 63 102 A R H > S+ 0 0 81 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.860 110.9 49.3 -57.2 -38.2 -22.7 29.4 -19.1 64 103 A C H > S+ 0 0 0 -3,-0.4 4,-2.6 1,-0.2 -1,-0.2 0.862 107.3 54.6 -69.7 -36.5 -22.2 31.5 -16.0 65 104 A K H X S+ 0 0 31 -4,-2.3 4,-1.7 2,-0.2 -2,-0.2 0.814 110.6 47.9 -64.7 -31.2 -25.7 33.0 -16.4 66 105 A D H X S+ 0 0 80 -4,-1.8 4,-1.7 -5,-0.2 -2,-0.2 0.948 114.0 43.3 -74.2 -52.7 -27.1 29.5 -16.4 67 106 A K H X S+ 0 0 37 -4,-2.3 4,-1.7 2,-0.2 -2,-0.2 0.906 116.0 49.7 -59.6 -43.5 -25.2 28.2 -13.4 68 107 A L H X S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.2 3,-0.4 0.951 111.0 46.6 -63.0 -52.7 -25.9 31.4 -11.4 69 108 A N H < S+ 0 0 47 -4,-1.7 4,-0.5 1,-0.3 -1,-0.2 0.794 113.0 51.9 -59.8 -29.2 -29.6 31.5 -12.2 70 109 A A H X S+ 0 0 40 -4,-1.7 4,-1.0 1,-0.2 -1,-0.3 0.795 110.8 47.6 -76.7 -30.2 -29.8 27.8 -11.2 71 110 A L H X S+ 0 0 0 -4,-1.7 4,-2.1 -3,-0.4 -2,-0.2 0.832 101.3 64.3 -77.1 -34.9 -28.0 28.5 -8.0 72 111 A A H X S+ 0 0 1 -4,-2.4 4,-1.3 1,-0.2 12,-0.2 0.722 102.0 51.7 -63.0 -21.8 -30.3 31.5 -7.1 73 112 A I H > S+ 0 0 109 -4,-0.5 4,-2.0 -3,-0.2 -1,-0.2 0.895 105.8 51.9 -81.2 -44.2 -33.2 29.0 -6.9 74 113 A S H X S+ 0 0 40 -4,-1.0 4,-2.6 2,-0.2 -2,-0.2 0.920 108.4 54.5 -54.5 -46.1 -31.4 26.6 -4.5 75 114 A V H X S+ 0 0 0 -4,-2.1 4,-2.6 1,-0.2 3,-0.2 0.953 109.4 43.1 -55.3 -59.3 -30.7 29.5 -2.2 76 115 A M H < S+ 0 0 71 -4,-1.3 -1,-0.2 1,-0.2 6,-0.2 0.845 116.9 50.3 -56.8 -34.6 -34.3 30.8 -1.9 77 116 A N H < S+ 0 0 134 -4,-2.0 -1,-0.2 1,-0.1 -2,-0.2 0.838 112.1 46.6 -73.4 -34.7 -35.4 27.2 -1.5 78 117 A Q H < S+ 0 0 79 -4,-2.6 -2,-0.2 1,-0.3 -3,-0.2 0.957 125.8 21.9 -73.2 -53.7 -32.8 26.4 1.2 79 118 A W S >< S- 0 0 42 -4,-2.6 3,-1.8 3,-0.3 -1,-0.3 -0.942 85.2-127.9-123.2 111.8 -33.4 29.5 3.4 80 119 A P T 3 S+ 0 0 116 0, 0.0 -3,-0.1 0, 0.0 3,-0.1 -0.213 94.1 12.1 -53.8 140.3 -36.7 31.4 3.1 81 120 A G T 3 S+ 0 0 82 1,-0.2 2,-0.5 -5,-0.2 -5,-0.1 0.591 103.9 113.8 67.3 10.7 -36.4 35.1 2.5 82 121 A V < - 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