==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-MAY-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 18-APR-13 4K8R . COMPND 2 MOLECULE: PROPROTEIN CONVERTASE SUBTILISIN/KEXIN TYPE 9; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR F.SCHIELE,H.NAR . 1461 12 17 12 5 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 59660.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 977 66.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 61 4.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 461 31.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 10 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 10 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 183 12.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 108 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 113 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 1.0 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 3 2 2 0 0 0 1 1 1 0 0 0 0 2 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 1 3 6 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 PARALLEL BRIDGES PER LADDER . 14 12 10 8 14 16 7 2 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 5 4 8 5 3 2 0 0 1 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 61 A T 0 0 111 0, 0.0 75,-0.2 0, 0.0 74,-0.1 0.000 360.0 360.0 360.0 146.4 71.4 -47.5 2.4 2 62 A A - 0 0 14 73,-1.4 2,-0.3 75,-0.1 80,-0.2 -0.013 360.0-103.2 -75.7-178.9 68.5 -49.5 0.7 3 63 A T E -a 82 0A 23 78,-0.8 80,-2.4 2,-0.0 2,-0.4 -0.797 19.4-134.8-113.7 153.9 67.6 -49.8 -3.0 4 64 A F E -a 83 0A 60 875,-0.3 2,-0.4 -2,-0.3 80,-0.2 -0.887 18.4-164.6-107.2 139.7 64.9 -48.1 -5.1 5 65 A H E +a 84 0A 42 78,-2.5 80,-3.0 -2,-0.4 2,-0.3 -0.984 9.1 177.0-132.3 126.0 62.7 -50.1 -7.6 6 66 A R - 0 0 112 -2,-0.4 2,-0.2 78,-0.2 81,-0.1 -0.830 42.5 -91.9-117.6 158.8 60.5 -48.8 -10.4 7 67 A C - 0 0 1 -2,-0.3 6,-0.1 79,-0.3 219,-0.1 -0.524 29.8-137.9 -69.1 137.5 58.5 -50.7 -13.0 8 68 A A S S+ 0 0 71 217,-0.3 2,-0.9 -2,-0.2 -1,-0.1 0.821 90.7 77.8 -65.3 -35.5 60.6 -51.2 -16.2 9 69 A K S > S- 0 0 72 1,-0.2 3,-1.3 216,-0.1 4,-0.3 -0.719 75.0-157.6 -78.9 103.2 57.6 -50.4 -18.4 10 70 A D G > S+ 0 0 94 -2,-0.9 3,-1.3 1,-0.2 -1,-0.2 0.840 86.6 54.9 -56.7 -38.0 57.6 -46.6 -18.1 11 71 A P G 3 S+ 0 0 84 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 0.591 105.4 56.6 -74.1 -7.3 53.8 -46.1 -19.1 12 72 A W G < S+ 0 0 17 -3,-1.3 76,-2.7 -5,-0.1 -2,-0.2 0.411 83.0 111.8 -98.1 -3.5 52.9 -48.5 -16.3 13 73 A R E < -B 87 0A 67 -3,-1.3 74,-0.2 -4,-0.3 73,-0.1 -0.346 47.9-165.8 -71.0 152.5 54.7 -46.5 -13.5 14 74 A L E > - 0 0 57 72,-2.0 3,-0.8 3,-0.2 72,-0.4 -0.669 17.5-168.2-138.2 71.7 52.6 -44.8 -10.8 15 75 A P E 3 + 0 0 81 0, 0.0 3,-0.1 0, 0.0 52,-0.1 -0.130 63.5 51.1 -65.0 162.8 55.0 -42.4 -9.1 16 76 A G E 3 S+ 0 0 22 1,-0.1 50,-2.4 49,-0.0 2,-0.4 0.289 96.3 81.6 93.2 -10.9 54.1 -40.6 -5.9 17 77 A T E < - C 0 65A 23 -3,-0.8 69,-3.5 48,-0.2 2,-0.4 -1.000 60.2-176.9-129.0 125.0 53.1 -43.9 -4.2 18 78 A Y E -BC 85 64A 9 46,-2.6 46,-2.2 -2,-0.4 2,-0.8 -0.972 26.2-141.0-130.7 140.5 55.8 -46.2 -2.7 19 79 A V E -BC 84 63A 1 65,-3.4 65,-2.2 -2,-0.4 2,-0.8 -0.915 21.2-155.7 -99.3 104.3 55.8 -49.6 -1.0 20 80 A V E -BC 83 62A 1 42,-2.0 42,-2.2 -2,-0.8 2,-0.5 -0.793 10.7-161.9 -85.4 109.3 58.4 -49.3 1.8 21 81 A V E -BC 82 61A 8 61,-2.7 60,-2.8 -2,-0.8 61,-1.6 -0.858 5.6-152.7 -96.8 124.7 59.6 -52.9 2.4 22 82 A L E -B 80 0A 1 38,-3.9 58,-0.3 -2,-0.5 57,-0.1 -0.501 30.9 -77.8 -94.5 166.9 61.3 -53.5 5.7 23 83 A K > - 0 0 112 56,-3.2 3,-1.5 -2,-0.2 2,-0.3 -0.285 57.3 -93.4 -62.3 142.8 63.9 -56.1 6.7 24 84 A E T 3 S+ 0 0 162 1,-0.2 -1,-0.1 -3,-0.1 35,-0.0 -0.506 115.2 37.0 -62.4 121.0 62.6 -59.6 7.3 25 85 A E T 3 S+ 0 0 150 1,-0.3 2,-0.6 -2,-0.3 -1,-0.2 0.317 78.8 140.3 110.5 7.3 62.0 -59.9 11.2 26 86 A T < - 0 0 19 -3,-1.5 -1,-0.3 53,-0.1 -4,-0.1 -0.692 46.8-135.7 -82.8 115.4 60.7 -56.3 11.7 27 87 A H >> - 0 0 123 -2,-0.6 4,-2.3 1,-0.1 3,-0.6 -0.302 23.7-106.3 -70.3 153.3 57.8 -56.3 14.2 28 88 A L H 3> S+ 0 0 84 1,-0.2 4,-3.7 2,-0.2 5,-0.1 0.843 121.6 57.8 -46.4 -42.1 54.6 -54.2 13.5 29 89 A S H 3> S+ 0 0 72 2,-0.2 4,-3.1 1,-0.2 -1,-0.2 0.918 108.5 43.7 -53.9 -51.1 55.7 -51.8 16.2 30 90 A Q H <> S+ 0 0 42 -3,-0.6 4,-2.7 2,-0.2 -2,-0.2 0.881 115.8 48.9 -64.4 -41.2 59.1 -51.1 14.3 31 91 A S H X S+ 0 0 2 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.973 113.6 47.1 -60.3 -54.4 57.1 -50.9 10.9 32 92 A E H X S+ 0 0 67 -4,-3.7 4,-1.7 1,-0.2 -2,-0.2 0.902 114.2 46.5 -51.3 -55.6 54.6 -48.5 12.6 33 93 A R H X S+ 0 0 143 -4,-3.1 4,-2.2 1,-0.2 3,-0.2 0.911 111.1 51.7 -56.3 -49.9 57.3 -46.2 14.2 34 94 A T H X S+ 0 0 3 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.902 108.7 50.8 -55.6 -44.7 59.4 -46.1 10.9 35 95 A A H X S+ 0 0 1 -4,-2.2 4,-1.4 1,-0.2 -1,-0.2 0.851 113.4 46.0 -60.6 -36.5 56.3 -45.0 8.9 36 96 A R H X S+ 0 0 148 -4,-1.7 4,-1.8 -3,-0.2 -1,-0.2 0.802 109.5 55.1 -76.4 -30.4 55.7 -42.2 11.6 37 97 A R H X S+ 0 0 121 -4,-2.2 4,-3.0 2,-0.2 -2,-0.2 0.936 107.1 49.7 -67.8 -44.5 59.5 -41.3 11.5 38 98 A L H X S+ 0 0 0 -4,-2.5 4,-2.8 2,-0.2 5,-0.2 0.891 108.4 53.6 -58.1 -44.8 59.3 -40.7 7.7 39 99 A Q H X S+ 0 0 57 -4,-1.4 4,-2.6 1,-0.2 -1,-0.2 0.920 114.9 40.4 -57.2 -45.9 56.2 -38.5 8.1 40 100 A A H X S+ 0 0 38 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.842 113.5 53.0 -70.6 -40.4 58.1 -36.3 10.7 41 101 A Q H X S+ 0 0 32 -4,-3.0 4,-0.6 2,-0.2 -2,-0.2 0.933 117.3 39.2 -61.4 -43.4 61.4 -36.3 8.7 42 102 A A H ><>S+ 0 0 0 -4,-2.8 5,-2.0 2,-0.2 3,-0.8 0.883 110.2 60.2 -70.2 -45.0 59.4 -35.1 5.7 43 103 A A H ><5S+ 0 0 58 -4,-2.6 3,-2.1 1,-0.3 -2,-0.2 0.897 102.9 51.7 -48.6 -51.5 57.2 -32.8 7.7 44 104 A R H 3<5S+ 0 0 164 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.748 105.8 55.9 -58.4 -30.7 60.3 -30.8 8.9 45 105 A R T <<5S- 0 0 143 -3,-0.8 -1,-0.3 -4,-0.6 -2,-0.2 0.453 126.2-103.2 -85.1 0.6 61.3 -30.4 5.3 46 106 A G T < 5S+ 0 0 71 -3,-2.1 2,-0.3 1,-0.3 -3,-0.2 0.669 78.7 133.2 84.1 25.1 57.9 -28.8 4.5 47 107 A Y < - 0 0 80 -5,-2.0 2,-0.4 -8,-0.1 -1,-0.3 -0.836 49.9-138.7-110.8 144.6 56.4 -31.9 2.9 48 108 A L - 0 0 138 -2,-0.3 2,-0.4 -6,-0.0 19,-0.3 -0.852 23.2-175.0-102.1 131.6 53.0 -33.6 3.3 49 109 A T - 0 0 12 -2,-0.4 2,-0.5 17,-0.1 17,-0.2 -0.963 14.5-154.9-127.3 144.4 52.9 -37.4 3.5 50 110 A K E -D 65 0A 106 15,-2.9 15,-2.7 -2,-0.4 2,-0.7 -0.948 7.2-152.9-123.1 109.8 50.0 -39.9 3.7 51 111 A I E +D 64 0A 45 -2,-0.5 13,-0.3 13,-0.2 3,-0.1 -0.747 18.3 179.0 -78.0 113.7 50.6 -43.3 5.2 52 112 A L E - 0 0 88 11,-2.4 2,-0.3 -2,-0.7 -1,-0.2 0.788 61.2 -4.0 -87.4 -35.3 47.9 -45.4 3.4 53 113 A H E -D 63 0A 41 10,-1.1 10,-3.4 2,-0.0 2,-0.5 -0.976 52.5-145.5-159.4 149.2 48.5 -48.8 4.9 54 114 A V E -D 62 0A 27 -2,-0.3 8,-0.3 8,-0.3 2,-0.2 -0.976 31.3-130.5-122.8 107.8 51.0 -50.5 7.3 55 115 A F E +D 61 0A 3 6,-1.6 6,-1.0 -2,-0.5 2,-0.2 -0.435 32.0 172.2 -65.6 128.7 51.6 -54.1 6.2 56 116 A H + 0 0 76 -2,-0.2 -1,-0.1 4,-0.1 -29,-0.0 -0.748 61.5 16.9-142.9 86.7 51.3 -56.6 9.0 57 117 A G S S+ 0 0 47 -2,-0.2 -2,-0.0 2,-0.2 -29,-0.0 0.150 122.4 38.0 144.1 -30.2 51.4 -60.3 8.1 58 118 A L S S+ 0 0 10 1,-0.4 -3,-0.0 139,-0.0 143,-0.0 0.716 124.4 8.8-112.1 -51.8 52.8 -60.9 4.7 59 119 A L S S- 0 0 13 2,-0.1 2,-0.6 -35,-0.0 -1,-0.4 -0.988 71.1-120.4-131.2 143.1 55.6 -58.3 4.5 60 120 A P S S+ 0 0 31 0, 0.0 -38,-3.9 0, 0.0 2,-0.3 -0.694 76.2 74.9 -80.0 118.0 57.1 -56.0 7.1 61 121 A G E -CD 21 55A 0 -6,-1.0 -6,-1.6 -2,-0.6 2,-0.3 -0.979 62.1-113.3 166.5-175.4 56.5 -52.5 5.6 62 122 A F E -CD 20 54A 0 -42,-2.2 -42,-2.0 -2,-0.3 2,-0.5 -0.887 17.8-117.3-145.1 172.9 54.1 -49.7 4.7 63 123 A L E -CD 19 53A 7 -10,-3.4 -11,-2.4 -2,-0.3 -10,-1.1 -0.984 30.9-176.4-119.8 123.6 52.4 -47.8 2.0 64 124 A V E -CD 18 51A 0 -46,-2.2 -46,-2.6 -2,-0.5 2,-0.7 -0.991 22.9-155.5-128.4 128.5 53.1 -44.0 1.6 65 125 A K E +CD 17 50A 95 -15,-2.7 -15,-2.9 -2,-0.4 2,-0.3 -0.931 51.0 132.7 -95.6 110.5 51.7 -41.5 -0.8 66 126 A M - 0 0 10 -50,-2.4 2,-0.2 -2,-0.7 -17,-0.1 -0.969 59.6 -76.8-156.5 169.3 54.6 -38.9 -0.9 67 127 A S > - 0 0 41 -19,-0.3 3,-1.9 -2,-0.3 4,-0.2 -0.515 32.1-131.0 -76.4 142.2 56.8 -36.8 -3.2 68 128 A G G > S+ 0 0 30 1,-0.3 3,-1.0 -2,-0.2 4,-0.3 0.626 104.5 75.4 -64.8 -14.0 59.6 -38.6 -5.0 69 129 A D G 3 S+ 0 0 116 1,-0.2 3,-0.3 2,-0.1 -1,-0.3 0.701 91.9 56.2 -67.7 -21.3 61.9 -35.8 -3.7 70 130 A L G <> S+ 0 0 5 -3,-1.9 4,-2.7 1,-0.2 -1,-0.2 0.474 78.2 96.1 -90.8 -6.0 61.7 -37.7 -0.3 71 131 A L H <> S+ 0 0 22 -3,-1.0 4,-2.5 1,-0.2 -1,-0.2 0.842 82.3 50.2 -54.1 -44.2 63.0 -41.0 -1.6 72 132 A E H > S+ 0 0 124 -3,-0.3 4,-1.1 -4,-0.3 -1,-0.2 0.904 113.6 46.5 -63.9 -39.2 66.6 -40.4 -0.6 73 133 A L H 4 S+ 0 0 16 -4,-0.3 3,-0.5 1,-0.2 4,-0.3 0.917 113.8 48.6 -64.5 -46.0 65.5 -39.5 2.9 74 134 A A H >< S+ 0 0 0 -4,-2.7 3,-1.0 1,-0.2 -2,-0.2 0.821 107.0 56.6 -63.3 -35.7 63.1 -42.6 2.9 75 135 A L H 3< S+ 0 0 9 -4,-2.5 -73,-1.4 1,-0.2 -1,-0.2 0.781 102.2 54.9 -67.3 -31.3 66.0 -44.9 1.7 76 136 A K T 3< S+ 0 0 143 -4,-1.1 -1,-0.2 -3,-0.5 -2,-0.2 0.488 85.0 120.4 -81.3 -5.3 68.2 -43.9 4.7 77 137 A L S X S- 0 0 8 -3,-1.0 3,-1.3 -4,-0.3 -75,-0.1 -0.271 73.3 -96.1 -63.2 142.0 65.4 -44.9 7.1 78 138 A P T 3 S+ 0 0 70 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.245 103.8 10.6 -59.2 149.9 66.1 -47.7 9.8 79 139 A H T 3 S+ 0 0 48 1,-0.2 -56,-3.2 -57,-0.1 2,-0.3 0.350 88.0 145.3 60.8 0.2 65.1 -51.3 9.0 80 140 A V E < + B 0 22A 8 -3,-1.3 -58,-0.3 -58,-0.3 -1,-0.2 -0.533 26.1 179.2 -71.5 127.3 64.3 -50.4 5.3 81 141 A D E - 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