==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 25-SEP-96 1KCW . COMPND 2 MOLECULE: CERULOPLASMIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR G.L.CARD,V.N.ZAITSEV,P.F.LINDLEY . 1017 4 5 5 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 36135.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 679 66.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 70 6.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 222 21.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 0.8 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 . 152 14.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 107 10.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 66 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 0.8 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 2 3 4 1 3 0 1 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 3 4 2 0 1 2 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 . 16 5 6 4 4 5 3 3 1 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 . 3 2 3 6 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 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 K 0 0 183 0, 0.0 84,-1.3 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 162.2 126.7 3.7 -19.2 2 2 A E - 0 0 110 82,-0.2 2,-0.1 83,-0.1 82,-0.0 -0.839 360.0-160.6-132.1 94.8 128.4 2.0 -16.1 3 3 A K - 0 0 28 -2,-0.4 84,-2.2 76,-0.1 2,-0.4 -0.380 3.1-157.5 -72.6 150.7 132.0 3.0 -15.8 4 4 A H E -a 87 0A 81 82,-0.2 2,-0.4 -2,-0.1 84,-0.2 -0.994 10.4-176.2-130.8 135.2 134.5 1.0 -13.7 5 5 A Y E -a 88 0A 13 82,-1.6 84,-3.1 -2,-0.4 2,-0.7 -0.990 17.3-144.8-131.9 143.4 137.7 2.5 -12.3 6 6 A Y E -aB 89 56A 39 50,-0.6 50,-3.0 -2,-0.4 2,-0.6 -0.869 21.3-179.6-113.2 102.8 140.5 0.9 -10.4 7 7 A I E -aB 90 55A 0 82,-2.2 84,-2.0 -2,-0.7 2,-0.4 -0.886 4.8-176.3-108.2 124.5 142.0 3.0 -7.8 8 8 A G E -aB 91 54A 0 46,-2.2 46,-2.6 -2,-0.6 2,-0.7 -0.885 20.0-139.7-111.8 148.9 144.9 1.9 -5.6 9 9 A I E + B 0 53A 0 82,-2.1 2,-0.2 -2,-0.4 44,-0.2 -0.878 30.2 179.6-109.9 100.8 146.3 4.0 -2.8 10 10 A I E - B 0 52A 27 42,-1.6 42,-2.3 -2,-0.7 2,-0.3 -0.669 26.7-125.8-106.4 158.2 150.1 3.7 -2.7 11 11 A E + 0 0 54 82,-0.5 2,-0.3 -2,-0.2 40,-0.2 -0.658 45.9 139.8 -93.0 151.5 152.7 5.2 -0.6 12 12 A T - 0 0 53 -2,-0.3 38,-3.5 2,-0.0 2,-0.4 -0.985 49.5 -86.0-175.7 173.2 155.6 7.1 -2.3 13 13 A T E -E 49 0B 77 -2,-0.3 2,-0.4 36,-0.3 36,-0.3 -0.852 33.9-158.7-101.5 132.7 158.0 10.1 -2.4 14 14 A W E -E 48 0B 32 34,-3.2 34,-2.3 -2,-0.4 2,-0.6 -0.935 4.3-157.4-114.6 135.5 156.9 13.3 -4.0 15 15 A D E -E 47 0B 64 -2,-0.4 32,-0.2 32,-0.2 3,-0.1 -0.977 10.5-157.0-112.9 114.3 159.3 16.0 -5.2 16 16 A Y - 0 0 0 30,-1.7 231,-1.3 -2,-0.6 232,-0.4 0.385 50.2-140.9 -70.1 5.4 157.7 19.5 -5.4 17 17 A A - 0 0 14 29,-0.5 -1,-0.2 229,-0.1 230,-0.1 0.265 37.3-155.7 51.7 174.8 160.6 19.8 -7.9 18 18 A S > - 0 0 41 -3,-0.1 3,-1.1 232,-0.1 -1,-0.1 -0.010 39.4-128.5-161.7 10.0 163.0 22.6 -8.7 19 19 A D T 3 - 0 0 80 1,-0.3 3,-0.0 231,-0.1 -2,-0.0 0.600 38.0-114.5 34.8 24.8 163.5 21.2 -12.2 20 20 A H T 3 S+ 0 0 90 1,-0.1 2,-0.3 0, 0.0 -1,-0.3 0.752 90.8 60.5 13.2 64.8 167.2 21.5 -11.1 21 21 A G S < S- 0 0 50 -3,-1.1 -1,-0.1 1,-0.0 3,-0.1 -0.932 75.4-127.1 175.7 176.6 167.9 24.1 -13.7 22 22 A E + 0 0 143 -2,-0.3 3,-0.1 1,-0.1 -1,-0.0 0.420 56.0 129.6-113.0-111.0 166.7 27.6 -14.4 23 23 A K + 0 0 132 1,-0.1 2,-0.7 443,-0.0 -1,-0.1 0.518 69.4 115.4 57.2 11.5 165.3 29.5 -17.5 24 24 A K + 0 0 35 442,-0.2 2,-1.4 443,-0.1 3,-0.3 -0.753 39.8 171.1-113.6 80.4 162.8 30.2 -14.7 25 25 A L + 0 0 54 -2,-0.7 441,-2.3 1,-0.2 224,-0.0 -0.781 6.0 165.6 -92.5 91.4 162.6 33.8 -13.7 26 26 A I + 0 0 8 -2,-1.4 2,-1.1 439,-0.2 -1,-0.2 0.767 22.3 151.4 -68.8 -29.2 159.6 33.5 -11.4 27 27 A S + 0 0 45 -3,-0.3 437,-0.4 3,-0.1 2,-0.3 0.360 21.2 120.1 -11.6 45.9 160.7 36.9 -10.3 28 28 A V S S- 0 0 7 -2,-1.1 2,-0.2 1,-0.3 483,-0.1 -0.196 110.0 -39.3 -75.8-156.5 157.6 38.2 -9.4 29 29 A D S S+ 0 0 35 -2,-0.3 299,-0.3 -3,-0.1 2,-0.3 -0.468 101.7 142.6 -62.6 123.5 159.1 38.6 -5.8 30 30 A T + 0 0 30 -2,-0.2 -3,-0.1 -3,-0.1 297,-0.1 -0.919 11.1 90.4-173.1 134.9 161.2 35.5 -5.3 31 31 A E > + 0 0 131 -2,-0.3 2,-3.2 295,-0.3 3,-0.8 -0.009 61.9 91.0 175.5 -40.3 164.4 34.0 -3.9 32 32 A H T 3 + 0 0 96 1,-0.2 4,-0.2 294,-0.2 3,-0.1 -0.482 49.7 129.4 -72.7 68.3 164.0 32.8 -0.3 33 33 A S T >> + 0 0 24 -2,-3.2 2,-2.4 1,-0.1 4,-2.0 0.718 46.6 87.8 -89.2 -37.8 163.0 29.4 -1.8 34 34 A N T <4 S+ 0 0 87 -3,-0.8 -1,-0.1 1,-0.2 203,-0.0 -0.460 79.6 55.6 -72.5 80.8 165.5 27.7 0.4 35 35 A I T 34 S+ 0 0 56 -2,-2.4 10,-0.4 202,-0.1 -1,-0.2 -0.127 114.6 38.8-161.0 -55.8 163.2 27.2 3.4 36 36 A Y T <4 S+ 0 0 18 -3,-1.0 -2,-0.2 -4,-0.2 9,-0.1 0.963 133.7 23.7 -69.0 -53.4 160.7 25.4 1.4 37 37 A L S < S+ 0 0 21 -4,-2.0 9,-0.7 9,-0.1 2,-0.6 0.311 92.3 113.6-101.2 7.8 163.1 23.4 -0.8 38 38 A Q - 0 0 96 -5,-0.4 7,-1.1 7,-0.3 2,-0.1 -0.703 51.4-154.5 -85.4 118.7 166.3 23.4 1.4 39 39 A N B +F 44 0C 68 -2,-0.6 5,-0.2 5,-0.2 4,-0.2 -0.357 41.4 91.6 -80.3 168.1 167.3 19.9 2.7 40 40 A G S S- 0 0 8 3,-0.7 182,-1.6 180,-0.5 183,-0.4 -0.935 75.3 -15.9 151.5-172.2 169.3 19.8 5.9 41 41 A P S S- 0 0 71 0, 0.0 182,-1.1 0, 0.0 185,-0.2 0.824 134.8 -5.9 -39.8 -51.9 169.9 19.7 9.7 42 42 A D S S+ 0 0 65 179,-0.1 -2,-0.2 -3,-0.1 185,-0.1 0.644 119.6 81.3-109.9 -72.4 166.3 20.5 10.4 43 43 A R - 0 0 50 -4,-0.2 -3,-0.7 1,-0.1 179,-0.3 0.228 61.7-150.4 -38.7 150.2 164.6 21.3 7.1 44 44 A I B > -F 39 0C 0 193,-0.3 3,-0.5 1,-0.2 -5,-0.2 0.593 27.0-146.4-102.4 -19.2 163.4 18.4 4.9 45 45 A G T 3 - 0 0 1 -7,-1.1 -7,-0.3 -10,-0.4 -1,-0.2 -0.468 50.8 -38.5 85.9-157.6 163.7 20.0 1.4 46 46 A R T 3 S+ 0 0 55 -9,-0.7 -30,-1.7 -2,-0.1 -29,-0.5 -0.010 109.5 91.6 -99.7 32.4 161.4 19.3 -1.5 47 47 A L E < +E 15 0B 51 -3,-0.5 2,-0.4 -32,-0.2 -32,-0.2 -0.981 44.5 163.3-130.2 119.4 160.9 15.5 -0.9 48 48 A Y E -E 14 0B 0 -34,-2.3 -34,-3.2 -2,-0.5 2,-0.4 -0.993 37.0-124.1-136.2 140.4 158.0 14.2 1.2 49 49 A K E +E 13 0B 52 -2,-0.4 2,-0.3 163,-0.3 -36,-0.3 -0.713 43.3 167.0 -81.6 130.7 156.6 10.7 1.5 50 50 A K - 0 0 0 -38,-3.5 123,-0.1 -2,-0.4 -40,-0.1 -0.942 35.4-124.1-155.6 126.6 153.0 10.9 0.7 51 51 A A + 0 0 0 -2,-0.3 2,-0.3 -40,-0.2 -40,-0.2 -0.311 38.2 179.7 -60.9 149.6 150.2 8.4 -0.0 52 52 A L E -B 10 0A 11 -42,-2.3 -42,-1.6 122,-0.1 2,-0.2 -0.933 31.6-106.4-164.0 140.8 148.3 8.9 -3.3 53 53 A Y E -B 9 0A 1 120,-0.4 2,-0.3 -2,-0.3 -44,-0.2 -0.408 38.3-180.0 -66.4 131.6 145.5 7.7 -5.6 54 54 A L E -B 8 0A 34 -46,-2.6 -46,-2.2 -2,-0.2 2,-0.7 -0.940 26.5-119.2-130.1 151.4 146.7 6.0 -8.8 55 55 A Q E -BC 7 65A 45 10,-0.6 10,-3.8 -2,-0.3 2,-0.3 -0.794 27.7-168.4-100.2 115.7 144.7 4.4 -11.6 56 56 A Y E -BC 6 64A 17 -50,-3.0 -50,-0.6 -2,-0.7 8,-0.3 -0.683 21.8-136.6 -99.4 153.5 145.2 0.7 -12.3 57 57 A T S S+ 0 0 66 6,-3.1 2,-0.2 -2,-0.3 7,-0.1 0.849 79.2 20.9 -68.1 -48.5 144.0 -1.3 -15.4 58 58 A D S S- 0 0 76 2,-0.7 4,-0.2 5,-0.4 5,-0.1 -0.756 86.5 -95.2-121.0 176.0 142.7 -4.4 -13.7 59 59 A E S S+ 0 0 114 -2,-0.2 2,-1.0 2,-0.1 -2,-0.0 0.515 111.3 85.7 -65.6 -9.7 141.5 -5.8 -10.5 60 60 A T S > S- 0 0 85 3,-0.1 2,-2.5 -54,-0.0 3,-1.1 -0.894 82.4-148.6 -93.8 98.9 145.2 -6.8 -10.4 61 61 A F T 3 S+ 0 0 19 -2,-1.0 3,-0.1 1,-0.2 -2,-0.1 -0.538 76.3 85.8 -76.4 78.9 146.5 -3.7 -8.9 62 62 A R T 3 + 0 0 80 -2,-2.5 2,-0.7 1,-0.3 -1,-0.2 0.386 69.4 69.7-140.1 -45.9 149.8 -4.1 -10.7 63 63 A T S < S- 0 0 75 -3,-1.1 -6,-3.1 -5,-0.1 -5,-0.4 -0.793 71.9-160.7 -89.4 111.6 149.3 -2.5 -14.2 64 64 A T E -C 56 0A 68 -2,-0.7 2,-0.4 -8,-0.3 -8,-0.3 -0.630 12.8-139.7 -93.6 156.7 149.0 1.3 -13.8 65 65 A I E -C 55 0A 71 -10,-3.8 2,-0.7 -2,-0.2 -10,-0.6 -0.890 28.5-118.7-111.8 139.2 147.5 4.0 -16.1 66 66 A E - 0 0 176 -2,-0.4 3,-0.1 -12,-0.1 -12,-0.0 -0.726 19.0-148.0 -94.5 121.7 149.4 7.2 -16.4 67 67 A K - 0 0 44 -2,-0.7 5,-0.1 1,-0.2 4,-0.0 -0.518 39.7 -79.0 -80.3 141.9 147.8 10.5 -15.4 68 68 A P > - 0 0 55 0, 0.0 3,-1.5 0, 0.0 4,-0.4 0.038 35.8-122.7 -40.1 140.7 148.7 13.8 -17.2 69 69 A V G > S+ 0 0 90 1,-0.3 3,-1.2 2,-0.2 184,-0.1 0.848 110.5 56.4 -56.5 -40.3 151.9 15.4 -16.2 70 70 A W G 3 S+ 0 0 35 1,-0.3 -1,-0.3 181,-0.1 176,-0.1 0.585 89.3 76.2 -70.9 -14.2 150.2 18.7 -15.3 71 71 A L G X S- 0 0 0 -3,-1.5 3,-1.5 1,-0.2 -1,-0.3 0.743 77.9-173.4 -69.3 -23.8 147.9 16.8 -12.9 72 72 A G T < - 0 0 10 -3,-1.2 -1,-0.2 -4,-0.4 173,-0.2 -0.355 61.5 -19.6 63.9-142.2 150.8 16.6 -10.4 73 73 A F T 3 S+ 0 0 3 171,-1.0 102,-0.3 -3,-0.1 -1,-0.2 0.331 102.0 119.7 -82.5 7.1 149.9 14.5 -7.4 74 74 A L S < S- 0 0 0 -3,-1.5 102,-0.3 170,-0.4 3,-0.1 -0.183 71.1 -96.4 -65.7 165.6 146.1 14.6 -7.7 75 75 A G - 0 0 1 100,-1.6 -21,-0.1 85,-0.2 -1,-0.1 -0.328 56.4 -70.2 -77.5 168.0 144.2 11.4 -8.1 76 76 A P - 0 0 2 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 -0.283 57.4 -98.8 -59.9 141.8 143.1 10.2 -11.6 77 77 A I - 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