==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-SEP-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 13-APR-12 4ENZ . COMPND 2 MOLECULE: CERULOPLASMIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR V.R.SAMYGINA,A.V.SOKOLOV,G.BOURENKOV,V.B.VASILYEV,H.BARTUNIK . 1029 3 5 5 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 38229.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 684 66.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 84 8.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 235 22.8 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 . 10 1.0 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 . 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 . 135 13.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 111 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 72 7.0 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 4 2 4 2 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 . 2 0 3 3 1 0 1 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 18 8 6 2 3 5 7 0 1 2 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 1 3 5 2 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 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 0 147 0, 0.0 84,-1.6 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 172.9 39.6 75.5 33.1 2 2 A E E -a 85 0A 113 82,-0.2 2,-0.3 84,-0.1 84,-0.2 -0.934 360.0-167.9-104.1 124.1 40.2 73.0 30.4 3 3 A K E -a 86 0A 21 82,-2.0 84,-2.9 -2,-0.5 2,-0.4 -0.888 6.1-155.2-115.1 143.6 37.4 70.4 30.0 4 4 A H E -a 87 0A 83 -2,-0.3 2,-0.4 82,-0.2 84,-0.2 -0.948 9.4-177.3-122.9 129.3 37.4 67.1 27.9 5 5 A Y E -a 88 0A 11 82,-2.4 84,-3.1 -2,-0.4 2,-0.6 -0.968 14.4-151.6-122.9 147.2 34.4 65.2 26.5 6 6 A Y E +aB 89 56A 38 50,-0.6 50,-2.9 -2,-0.4 2,-0.5 -0.966 19.5 179.5-119.0 111.5 34.5 61.9 24.6 7 7 A I E -aB 90 55A 1 82,-2.3 84,-1.7 -2,-0.6 2,-0.3 -0.956 7.6-166.9-121.2 117.7 31.7 61.5 22.1 8 8 A G E -aB 91 54A 0 46,-2.0 46,-2.8 -2,-0.5 2,-0.6 -0.747 15.5-140.9 -95.1 145.3 31.2 58.5 19.9 9 9 A I E +aB 92 53A 0 82,-2.5 84,-2.4 -2,-0.3 2,-0.3 -0.954 32.0 172.6 -98.4 114.1 28.9 58.4 17.0 10 10 A I E - B 0 52A 42 42,-2.1 42,-2.5 -2,-0.6 2,-0.4 -0.800 32.4-123.7-113.1 162.0 27.2 54.9 16.9 11 11 A E E + B 0 51A 55 82,-0.3 2,-0.3 -2,-0.3 40,-0.2 -0.871 45.4 154.5 -97.0 136.8 24.5 53.5 14.8 12 12 A T E - B 0 50A 47 38,-2.3 38,-2.3 -2,-0.4 2,-0.4 -0.993 46.5 -96.9-160.7 160.9 21.6 52.1 16.8 13 13 A T E - B 0 49A 85 -2,-0.3 2,-0.4 36,-0.2 36,-0.3 -0.680 38.9-158.4 -88.4 130.9 18.0 51.4 16.7 14 14 A W E - B 0 48A 31 34,-3.7 34,-2.2 -2,-0.4 2,-0.6 -0.942 8.8-147.3-118.8 135.1 15.7 54.1 18.3 15 15 A D E - B 0 47A 37 -2,-0.4 3,-0.5 32,-0.2 32,-0.2 -0.868 3.1-164.2-104.0 119.7 12.2 53.8 19.6 16 16 A Y S S+ 0 0 0 30,-2.0 231,-2.5 -2,-0.6 234,-0.2 0.421 90.4 18.9 -83.4 -3.8 9.9 56.8 19.2 17 17 A A S S- 0 0 6 229,-0.2 2,-4.0 29,-0.2 -1,-0.3 -0.353 70.7-165.7-162.9 73.0 7.3 55.7 21.7 18 18 A S - 0 0 56 -3,-0.5 2,-0.3 232,-0.1 -2,-0.0 0.091 44.2-130.2 -64.7 37.7 8.9 53.1 23.9 19 19 A D + 0 0 88 -2,-4.0 2,-0.1 1,-0.1 3,-0.0 -0.660 59.4 134.1 76.3-146.1 5.4 52.2 25.1 20 20 A H + 0 0 164 -2,-0.3 -1,-0.1 1,-0.1 -2,-0.0 -0.952 42.4 99.3-123.1 -2.8 4.0 51.8 27.9 21 21 A G - 0 0 29 -2,-0.1 -1,-0.1 1,-0.1 454,-0.0 0.270 53.5-152.7 64.5-174.9 0.6 53.5 28.4 22 22 A E + 0 0 133 453,-0.2 2,-0.2 451,-0.1 -1,-0.1 0.252 52.3 165.0-107.1 127.8 -2.3 53.8 28.6 23 23 A K - 0 0 45 225,-0.1 2,-0.5 7,-0.1 452,-0.0 -0.523 33.3-155.6-104.2 152.9 -2.6 57.5 27.7 24 24 A K B -F 473 0B 74 449,-2.4 449,-2.1 -2,-0.2 2,-0.3 -0.975 24.7-171.1-122.1 117.1 -5.2 60.0 26.7 25 25 A L B > -G 28 0C 9 3,-0.6 3,-1.4 -2,-0.5 2,-0.1 -0.701 34.2 -85.9-102.0 158.7 -3.6 62.9 24.8 26 26 A I T 3 S- 0 0 5 1,-0.3 302,-0.2 -2,-0.3 493,-0.1 -0.389 107.9 -5.0 -65.1 133.5 -5.2 66.2 23.8 27 27 A S T 3 S+ 0 0 21 491,-0.3 2,-0.4 490,-0.1 -1,-0.3 0.706 108.1 112.1 56.5 28.8 -7.0 66.0 20.4 28 28 A V B < -G 25 0C 10 -3,-1.4 -3,-0.6 299,-0.1 -1,-0.1 -0.919 55.3-149.6-137.3 110.0 -5.9 62.4 19.8 29 29 A D >> - 0 0 92 -2,-0.4 3,-0.7 1,-0.1 4,-0.5 -0.291 37.0-102.5 -65.9 159.5 -8.2 59.4 19.8 30 30 A T T 34 S+ 0 0 98 1,-0.2 4,-0.1 2,-0.1 -1,-0.1 0.609 119.2 48.4 -63.8 -11.6 -6.7 56.0 20.8 31 31 A E T >4 S+ 0 0 131 1,-0.1 3,-1.4 2,-0.1 4,-0.3 0.721 87.8 80.4-100.2 -26.4 -6.4 54.9 17.1 32 32 A H T X4 S+ 0 0 54 -3,-0.7 3,-1.3 1,-0.3 4,-0.4 0.743 80.3 68.4 -57.1 -31.4 -4.7 57.9 15.5 33 33 A S T >X S+ 0 0 30 -4,-0.5 4,-2.7 1,-0.3 3,-1.5 0.845 81.9 75.8 -60.5 -35.3 -1.2 57.0 16.6 34 34 A N H <> S+ 0 0 51 -3,-1.4 4,-2.0 1,-0.3 -1,-0.3 0.846 81.6 69.5 -43.0 -40.5 -1.2 53.9 14.3 35 35 A I H <4 S+ 0 0 78 -3,-1.3 -1,-0.3 -4,-0.3 -2,-0.2 0.900 118.8 17.8 -45.3 -46.5 -0.6 56.3 11.4 36 36 A Y H <4 S+ 0 0 17 -3,-1.5 -2,-0.2 -4,-0.4 -1,-0.2 0.762 133.0 41.3 -98.7 -35.5 3.0 57.0 12.7 37 37 A L H < S+ 0 0 30 -4,-2.7 2,-0.8 9,-0.1 9,-0.7 0.462 86.0 105.6 -97.7 -2.4 3.7 54.1 15.1 38 38 A Q < - 0 0 103 -4,-2.0 7,-0.4 -5,-0.3 -1,-0.0 -0.732 59.8-144.1 -96.0 102.9 2.2 51.0 13.2 39 39 A N + 0 0 99 -2,-0.8 5,-0.2 5,-0.2 6,-0.1 -0.270 38.4 153.2 -48.9 139.3 4.6 48.6 11.5 40 40 A G B > -H 43 0D 16 3,-2.4 182,-0.9 180,-0.1 3,-0.6 -0.938 61.1 -79.3-158.0-178.3 3.0 47.3 8.2 41 41 A P T 3 S+ 0 0 68 0, 0.0 182,-1.5 0, 0.0 185,-0.2 0.774 133.0 17.3 -61.2 -25.0 3.7 45.9 4.8 42 42 A D T 3 S+ 0 0 63 180,-0.1 2,-0.3 179,-0.1 186,-0.1 0.031 117.4 76.5-135.1 23.8 4.4 49.5 3.6 43 43 A R B < -H 40 0D 54 -3,-0.6 -3,-2.4 177,-0.1 179,-0.2 -0.999 61.6-150.0-142.3 137.6 5.1 51.3 6.9 44 44 A I - 0 0 3 -2,-0.3 3,-0.4 1,-0.2 2,-0.4 0.848 32.8-158.0 -78.0 -37.8 8.1 51.2 9.1 45 45 A G - 0 0 3 -7,-0.4 -7,-0.3 1,-0.2 -1,-0.2 -0.744 47.3 -36.1 94.4-139.0 6.4 51.8 12.4 46 46 A R S S+ 0 0 86 -9,-0.7 -30,-2.0 -2,-0.4 2,-0.5 0.556 109.6 83.0-106.7 -15.5 8.0 53.2 15.5 47 47 A L E +B 15 0A 56 -3,-0.4 2,-0.3 -32,-0.2 -32,-0.2 -0.812 53.2 170.5 -91.1 130.4 11.5 51.6 15.4 48 48 A Y E -B 14 0A 0 -34,-2.2 -34,-3.7 -2,-0.5 2,-0.3 -0.999 32.9-126.6-134.2 145.1 14.2 53.3 13.2 49 49 A K E +B 13 0A 64 -2,-0.3 2,-0.3 -36,-0.3 -36,-0.2 -0.682 45.1 159.4 -72.8 137.5 18.0 52.9 12.8 50 50 A K E -B 12 0A 0 -38,-2.3 -38,-2.3 -2,-0.3 2,-0.6 -0.952 43.5-104.2-152.9 174.1 19.7 56.2 13.2 51 51 A A E +B 11 0A 0 121,-2.2 2,-0.3 -2,-0.3 -40,-0.2 -0.932 43.5 178.6-106.0 123.7 23.1 57.8 14.0 52 52 A L E -B 10 0A 10 -42,-2.5 -42,-2.1 -2,-0.6 2,-0.4 -0.918 29.4-121.3-128.3 152.2 23.4 59.1 17.6 53 53 A Y E -B 9 0A 0 120,-0.5 2,-0.3 20,-0.4 -44,-0.2 -0.784 31.8-176.5 -86.8 131.9 26.1 60.8 19.7 54 54 A L E -B 8 0A 33 -46,-2.8 -46,-2.0 -2,-0.4 2,-0.3 -0.901 21.7-122.9-123.1 158.1 27.0 59.0 23.0 55 55 A Q E -B 7 0A 45 10,-0.5 10,-2.8 -2,-0.3 2,-0.3 -0.776 25.2-163.4-103.6 145.3 29.3 60.0 25.8 56 56 A Y E -BC 6 64A 16 -50,-2.9 -50,-0.6 -2,-0.3 8,-0.2 -0.837 25.7-137.2-127.1 159.9 32.3 58.0 26.9 57 57 A T S S+ 0 0 60 6,-1.9 2,-0.3 -2,-0.3 7,-0.1 0.656 82.4 30.1 -79.6 -13.9 34.5 57.9 29.9 58 58 A D S S- 0 0 58 5,-0.3 -1,-0.1 2,-0.1 4,-0.1 -0.978 72.8-113.0-161.5 145.7 37.6 57.4 27.9 59 59 A E S S+ 0 0 105 -2,-0.3 2,-0.9 1,-0.2 -1,-0.0 0.616 112.4 67.8 -58.5 -23.1 39.9 57.8 24.8 60 60 A T S > S- 0 0 68 3,-0.1 2,-2.4 0, 0.0 3,-0.5 -0.920 96.9-143.8 -94.2 97.0 39.5 54.0 24.4 61 61 A F T 3 + 0 0 15 -2,-0.9 -2,-0.1 1,-0.2 3,-0.1 -0.338 63.2 108.0 -75.7 74.1 35.8 54.4 23.5 62 62 A R T 3 + 0 0 193 -2,-2.4 2,-0.6 1,-0.2 -1,-0.2 0.782 60.3 56.0-123.0 -38.3 34.4 51.4 25.3 63 63 A T S < S- 0 0 81 -3,-0.5 -6,-1.9 -5,-0.1 -5,-0.3 -0.904 74.7-143.4-106.3 121.7 32.4 52.3 28.4 64 64 A T B -C 56 0A 69 -2,-0.6 2,-0.7 -8,-0.2 -8,-0.3 -0.436 7.4-135.1 -78.8 148.6 29.5 54.7 27.8 65 65 A I - 0 0 73 -10,-2.8 -10,-0.5 -2,-0.1 -1,-0.0 -0.931 35.1-129.2-101.1 108.8 28.4 57.5 30.3 66 66 A E - 0 0 176 -2,-0.7 3,-0.1 1,-0.1 -12,-0.0 -0.199 16.6-135.3 -69.0 147.4 24.6 57.2 30.3 67 67 A K - 0 0 45 1,-0.1 -1,-0.1 5,-0.1 5,-0.1 -0.598 32.2 -84.7 -96.7 158.3 22.4 60.2 29.7 68 68 A P > - 0 0 54 0, 0.0 3,-1.5 0, 0.0 4,-0.4 -0.351 40.7-118.8 -57.4 142.9 19.3 61.2 31.6 69 69 A V G > S+ 0 0 92 1,-0.3 3,-1.0 2,-0.2 185,-0.1 0.743 108.5 61.5 -59.5 -27.4 16.3 59.5 30.2 70 70 A W G 3 S+ 0 0 27 1,-0.2 -1,-0.3 183,-0.2 3,-0.1 0.643 87.2 73.6 -77.9 -16.3 14.5 62.8 29.3 71 71 A L G X S- 0 0 0 -3,-1.5 3,-1.5 1,-0.2 -1,-0.2 0.734 80.2-172.5 -64.6 -25.8 17.3 63.8 26.8 72 72 A G T < - 0 0 9 -3,-1.0 -1,-0.2 -4,-0.4 173,-0.2 -0.424 62.8 -21.9 64.8-136.4 16.0 61.1 24.4 73 73 A F T 3 S+ 0 0 3 171,-1.0 -20,-0.4 -2,-0.1 -1,-0.2 0.512 102.2 124.0 -86.2 -2.7 18.3 60.6 21.5 74 74 A L S < S- 0 0 0 -3,-1.5 102,-0.3 170,-0.2 3,-0.1 -0.144 71.9 -99.5 -53.4 150.5 19.9 64.0 21.8 75 75 A G - 0 0 0 100,-2.1 -21,-0.1 85,-0.2 -1,-0.1 -0.208 56.7 -72.7 -59.5 166.1 23.7 64.0 22.2 76 76 A P - 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0 0 0 -2,-0.3 2,-0.4 30,-0.2 65,-0.1 -0.860 20.7-121.6-141.8-179.7 31.3 65.8 12.0 100 100 A F + 0 0 1 27,-0.4 2,-0.5 -2,-0.3 62,-0.2 -0.920 31.8 173.9-126.5 101.6 30.9 67.8 15.2 101 101 A H E -J 161 0E 0 60,-2.8 60,-2.4 -2,-0.4 2,-0.4 -0.946 15.0-155.9-107.8 132.9 29.9 71.4 14.5 102 102 A S E -J 160 0E 1 -2,-0.5 3,-0.4 58,-0.2 58,-0.3 -0.889 7.3-152.3-116.6 138.2 29.1 73.6 17.5 103 103 A H S S+ 0 0 5 56,-3.4 2,-0.6 -2,-0.4 -1,-0.1 0.949 79.2 35.3 -78.5 -49.9 27.0 76.7 17.5 104 104 A G S S+ 0 0 1 55,-0.4 2,-0.3 74,-0.1 -1,-0.2 -0.181 97.9 72.8-111.5 54.0 27.9 79.1 20.3 105 105 A I S S- 0 0 1 -2,-0.6 2,-0.4 -3,-0.4 37,-0.2 -0.971 76.7 -98.7-158.6 156.1 31.7 78.9 20.8 106 106 A T B +E 141 0A 7 35,-2.7 35,-2.5 -2,-0.3 2,-0.3 -0.727 43.1 156.8-101.1 139.0 34.8 80.1 19.1 107 107 A Y - 0 0 7 -2,-0.4 33,-0.1 865,-0.2 2,-0.1 -0.990 37.8-116.5-147.8 152.7 37.0 77.9 16.9 108 108 A Y > - 0 0 146 -2,-0.3 3,-2.2 31,-0.3 4,-0.2 -0.324 50.7 -91.9 -75.7 172.4 39.5 78.2 14.1 109 109 A K G > S+ 0 0 6 896,-0.3 3,-0.9 1,-0.3 4,-0.3 0.791 125.3 65.7 -59.0 -26.6 38.7 76.6 10.7 110 110 A E G 3 S+ 0 0 41 1,-0.2 -1,-0.3 2,-0.1 17,-0.1 0.521 109.4 38.8 -63.0 -16.0 40.4 73.3 11.8 111 111 A H G < S+ 0 0 11 -3,-2.2 -1,-0.2 27,-0.1 -2,-0.2 0.211 84.8 94.4-129.3 18.5 37.6 73.0 14.4 112 112 A E S < S- 0 0 0 -3,-0.9 -10,-0.2 12,-0.2 -2,-0.1 0.726 70.0-148.9 -81.7 -30.2 34.4 74.1 12.8 113 113 A G + 0 0 0 -4,-0.3 50,-0.5 1,-0.2 2,-0.4 0.860 55.7 113.4 63.7 37.6 33.3 70.7 11.7 114 114 A A - 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