==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ELECTRON TRANSPORT 19-FEB-04 1SFH . COMPND 2 MOLECULE: AMICYANIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PARACOCCUS DENITRIFICANS; . AUTHOR C.J.CARRELL,D.SUN,S.JIANG,V.L.DAVIDSON,F.S.MATHEWS . 210 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10819.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 132 62.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 22 10.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 58 27.6 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 . 6 2.9 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 . 25 11.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 7.6 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+4), 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 . 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 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 RESIDUES PER ALPHA HELIX . 0 0 0 2 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 PARALLEL BRIDGES PER LADDER . 4 8 0 0 2 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 2 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 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 D 0 0 157 0, 0.0 62,-0.2 0, 0.0 61,-0.1 0.000 360.0 360.0 360.0 169.5 34.6 15.9 10.7 2 2 A K + 0 0 56 60,-2.7 81,-2.1 1,-0.1 82,-0.6 0.404 360.0 34.2-104.2 -1.0 31.4 14.6 9.1 3 3 A A E -A 82 0A 11 59,-0.5 2,-0.3 79,-0.2 79,-0.2 -0.981 64.3-144.8-150.7 152.4 28.8 15.8 11.6 4 4 A T E -A 81 0A 82 77,-1.9 77,-2.6 -2,-0.3 -2,-0.0 -0.792 18.3-128.2-117.2 164.4 28.3 18.8 13.9 5 5 A I - 0 0 72 -2,-0.3 3,-0.2 75,-0.2 75,-0.2 -0.906 17.2-175.8-122.9 100.8 26.7 18.8 17.4 6 6 A P S S+ 0 0 83 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 0.717 84.3 29.5 -71.1 -21.8 23.9 21.2 18.1 7 7 A S - 0 0 30 72,-0.4 72,-0.3 1,-0.1 4,-0.1 -0.904 63.8-166.1-139.1 106.0 23.7 20.2 21.8 8 8 A E S S+ 0 0 171 -2,-0.4 -1,-0.1 -3,-0.2 3,-0.1 0.892 80.3 43.6 -58.3 -42.6 26.8 19.0 23.5 9 9 A S S S- 0 0 77 1,-0.1 68,-0.1 60,-0.1 63,-0.1 -0.617 104.3 -86.7 -96.5 162.7 24.8 17.7 26.5 10 10 A P - 0 0 36 0, 0.0 2,-0.3 0, 0.0 68,-0.2 -0.367 49.6-161.6 -61.1 151.4 21.6 15.7 26.5 11 11 A F E -B 77 0A 38 66,-2.3 66,-2.9 -4,-0.1 2,-0.1 -0.866 27.8 -73.6-133.4 169.4 18.5 17.9 26.4 12 12 A A E > -B 76 0A 46 -2,-0.3 3,-2.1 64,-0.2 64,-0.2 -0.344 29.9-136.1 -67.1 137.1 14.9 17.6 27.2 13 13 A A G > S+ 0 0 14 62,-2.4 3,-1.9 1,-0.3 -1,-0.2 0.834 104.2 68.2 -57.5 -32.0 12.7 15.6 24.7 14 14 A A G 3 S+ 0 0 102 61,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.703 97.0 54.4 -61.9 -20.1 10.1 18.4 25.1 15 15 A E G < S+ 0 0 145 -3,-2.1 -1,-0.3 3,-0.0 -2,-0.2 0.242 73.8 133.9 -99.9 13.4 12.6 20.8 23.3 16 16 A V < - 0 0 29 -3,-1.9 3,-0.1 1,-0.1 4,-0.1 -0.462 61.1-102.7 -60.8 133.8 13.1 18.6 20.2 17 17 A A > - 0 0 67 1,-0.2 3,-0.8 -2,-0.2 2,-0.3 0.501 45.7 -60.0 -46.0 176.3 12.8 20.8 17.2 18 18 A D T 3 S- 0 0 160 1,-0.3 -1,-0.2 -3,-0.1 -3,-0.0 -0.522 115.0 -20.9 -56.2 117.1 10.2 21.5 14.6 19 19 A G T 3 S- 0 0 85 -2,-0.3 -1,-0.3 -3,-0.1 3,-0.1 0.659 94.5-173.1 42.6 23.6 9.3 18.3 12.6 20 20 A A < - 0 0 30 -3,-0.8 2,-0.7 1,-0.1 -1,-0.1 0.014 31.5-110.4 -42.4 144.9 12.6 16.9 13.7 21 21 A I E -c 43 0A 54 21,-0.8 23,-2.9 2,-0.0 2,-0.4 -0.722 48.5-167.5 -80.0 108.8 14.0 13.5 12.4 22 22 A V E -c 44 0A 43 -2,-0.7 2,-0.5 21,-0.2 23,-0.2 -0.885 26.6-167.0-111.0 136.0 13.8 11.3 15.4 23 23 A V E -c 45 0A 0 21,-2.5 23,-2.3 -2,-0.4 2,-0.2 -0.979 22.1-150.4-114.1 111.4 15.1 7.9 16.4 24 24 A D E -c 46 0A 43 -2,-0.5 7,-3.2 21,-0.2 2,-0.5 -0.580 0.9-148.2 -80.6 149.5 13.4 6.5 19.5 25 25 A I E +cD 47 30A 0 21,-2.2 23,-2.8 5,-0.2 24,-0.3 -0.985 35.5 138.0-119.3 120.3 15.3 4.2 21.9 26 26 A A E > + D 0 29A 22 3,-2.2 3,-1.3 -2,-0.5 -2,-0.0 -0.976 56.0 19.9-158.8 152.4 13.2 1.6 23.7 27 27 A K T 3 S- 0 0 177 -2,-0.3 3,-0.1 1,-0.3 -1,-0.1 0.871 128.2 -60.1 53.0 40.4 13.4 -2.1 24.8 28 28 A M T 3 S+ 0 0 55 1,-0.2 2,-0.3 23,-0.1 -1,-0.3 0.785 117.4 100.1 63.0 31.3 17.2 -2.1 24.3 29 29 A K E < S-D 26 0A 136 -3,-1.3 -3,-2.2 69,-0.1 2,-0.6 -0.998 77.4-120.3-144.2 147.5 16.9 -1.2 20.6 30 30 A Y E -D 25 0A 7 -2,-0.3 -5,-0.2 69,-0.3 69,-0.1 -0.794 32.1-145.2 -77.2 123.4 17.2 1.8 18.3 31 31 A E S S+ 0 0 103 -7,-3.2 -1,-0.1 -2,-0.6 -6,-0.1 0.755 93.3 37.8 -73.9 -26.7 13.6 1.8 16.9 32 32 A T S S+ 0 0 57 -8,-0.4 -1,-0.3 1,-0.1 69,-0.2 -0.770 72.4 168.2-118.0 77.8 14.7 3.0 13.4 33 33 A P S S+ 0 0 68 0, 0.0 68,-1.6 0, 0.0 2,-0.4 0.596 71.9 44.9 -77.3 -8.2 18.0 1.2 13.0 34 34 A E E S+f 101 0B 107 66,-0.2 2,-0.5 -3,-0.1 68,-0.2 -0.831 78.7 178.9-130.1 90.4 18.4 2.0 9.3 35 35 A L E -f 102 0B 18 66,-2.3 68,-3.2 -2,-0.4 2,-0.5 -0.833 15.5-154.4-100.5 127.4 17.6 5.6 8.9 36 36 A H E +f 103 0B 95 -2,-0.5 2,-0.2 66,-0.2 68,-0.2 -0.894 26.9 154.9-102.7 124.6 17.8 7.3 5.5 37 37 A V E -f 104 0B 7 66,-2.8 68,-2.6 -2,-0.5 2,-0.3 -0.778 35.8-112.1-132.2 178.4 18.4 11.1 5.6 38 38 A K > - 0 0 141 66,-0.3 3,-2.5 67,-0.3 44,-0.2 -0.792 46.5 -76.9-113.6 158.6 19.9 13.7 3.2 39 39 A V T 3 S+ 0 0 72 -2,-0.3 44,-0.2 1,-0.3 3,-0.1 -0.327 120.5 28.0 -53.7 130.4 23.1 15.8 3.4 40 40 A G T 3 S+ 0 0 44 42,-3.1 -1,-0.3 1,-0.3 43,-0.1 0.150 90.1 131.3 98.4 -12.3 22.4 18.6 5.9 41 41 A D < - 0 0 57 -3,-2.5 41,-2.4 41,-0.3 2,-0.5 -0.391 50.3-136.4 -73.9 148.8 19.8 16.8 8.0 42 42 A T E - E 0 81A 53 39,-0.2 -21,-0.8 -2,-0.1 2,-0.4 -0.898 13.8-157.4-103.0 130.4 19.8 16.7 11.8 43 43 A V E -cE 21 80A 0 37,-2.9 37,-2.3 -2,-0.5 2,-0.5 -0.908 5.2-162.5-105.0 135.9 19.0 13.4 13.5 44 44 A T E -cE 22 79A 5 -23,-2.9 -21,-2.5 -2,-0.4 2,-0.4 -0.979 3.1-157.4-122.3 122.4 17.8 13.4 17.1 45 45 A W E -cE 23 78A 0 33,-2.9 33,-2.0 -2,-0.5 2,-0.4 -0.771 9.0-166.5 -91.5 140.3 17.8 10.3 19.3 46 46 A I E -cE 24 77A 5 -23,-2.3 -21,-2.2 -2,-0.4 2,-0.6 -0.989 16.1-139.1-130.0 121.6 15.4 10.2 22.2 47 47 A N E -c 25 0A 0 29,-2.6 28,-2.8 -2,-0.4 29,-0.5 -0.708 19.4-177.8 -78.4 120.6 15.7 7.7 25.0 48 48 A R + 0 0 87 -23,-2.8 2,-0.3 -2,-0.6 -22,-0.1 0.419 57.6 61.4 -98.5 1.7 12.2 6.5 25.8 49 49 A E S S- 0 0 38 -24,-0.3 4,-0.1 2,-0.3 26,-0.1 -0.785 84.4-111.2-131.8 167.5 13.0 4.2 28.7 50 50 A A S S+ 0 0 80 -2,-0.3 24,-0.3 23,-0.1 -1,-0.1 0.841 90.5 90.5 -65.9 -40.5 14.6 4.2 32.1 51 51 A M S S- 0 0 37 22,-0.1 -2,-0.3 1,-0.1 -23,-0.1 -0.474 85.7-119.1 -57.7 127.1 17.8 2.2 31.1 52 52 A P + 0 0 12 0, 0.0 2,-0.3 0, 0.0 21,-0.2 -0.353 39.9 170.4 -70.9 151.5 20.4 4.8 30.0 53 53 A H B -J 72 0C 0 19,-1.7 19,-2.7 -4,-0.1 2,-0.2 -0.934 11.7-176.2-144.3 169.2 21.7 4.7 26.4 54 54 A N - 0 0 5 -2,-0.3 2,-0.4 17,-0.2 17,-0.1 -0.827 29.0-107.9-146.5-170.7 23.9 6.8 24.1 55 55 A V - 0 0 1 -2,-0.2 14,-3.0 15,-0.2 2,-0.4 -0.989 31.7-172.8-123.4 142.7 25.1 6.7 20.5 56 56 A H E -GH 68 91B 26 35,-1.7 35,-2.0 -2,-0.4 2,-0.5 -0.985 10.7-167.7-143.2 120.0 28.7 5.9 19.7 57 57 A F E -G 67 0B 0 10,-2.7 10,-2.5 -2,-0.4 33,-0.1 -0.938 29.5-123.9-109.3 123.4 30.5 6.1 16.3 58 58 A V > - 0 0 73 -2,-0.5 3,-2.1 31,-0.3 4,-0.5 -0.134 43.9 -65.4 -69.8 167.3 33.9 4.4 16.3 59 59 A A T 3 S+ 0 0 65 1,-0.3 7,-0.2 2,-0.1 6,-0.2 -0.207 121.9 20.5 -53.1 136.3 37.1 6.1 15.4 60 60 A G T 3 S+ 0 0 43 3,-1.8 -1,-0.3 5,-0.3 4,-0.1 0.071 99.3 94.0 93.3 -20.2 37.3 7.2 11.7 61 61 A V S < S+ 0 0 36 -3,-2.1 -2,-0.1 1,-0.2 3,-0.1 0.958 107.8 2.3 -74.2 -53.3 33.5 7.2 11.2 62 62 A L S S- 0 0 5 -4,-0.5 -60,-2.7 3,-0.3 -59,-0.5 0.463 138.1 -17.6-109.8 -8.0 32.6 10.8 11.8 63 63 A G S S- 0 0 9 -5,-0.3 -3,-1.8 2,-0.2 -1,-0.2 -0.954 87.8 -67.1-175.0-175.7 36.1 12.1 12.5 64 64 A E S S+ 0 0 189 -2,-0.3 2,-0.2 -5,-0.2 -3,-0.1 0.811 117.8 38.1 -60.8 -32.5 39.7 11.0 13.4 65 65 A A S S- 0 0 68 -6,-0.2 -3,-0.3 1,-0.1 -5,-0.3 -0.672 102.8 -80.8-111.6 166.4 38.5 9.9 16.8 66 66 A A - 0 0 42 -2,-0.2 2,-0.7 -7,-0.2 -8,-0.2 -0.337 33.2-136.5 -59.8 149.4 35.4 8.2 18.1 67 67 A L E -G 57 0B 28 -10,-2.5 -10,-2.7 -4,-0.1 2,-0.7 -0.947 24.1-174.3-109.1 104.0 32.3 10.3 18.7 68 68 A K E -G 56 0B 105 -2,-0.7 -12,-0.2 -12,-0.2 24,-0.1 -0.905 14.9-144.9-103.5 107.4 31.0 9.1 22.0 69 69 A G - 0 0 6 -14,-3.0 24,-0.1 -2,-0.7 3,-0.1 -0.219 27.1 -91.6 -69.0 161.5 27.7 10.7 22.7 70 70 A P - 0 0 30 0, 0.0 -15,-0.2 0, 0.0 2,-0.1 -0.359 47.9 -88.8 -71.6 154.0 26.6 11.6 26.2 71 71 A M - 0 0 45 -17,-0.1 2,-0.5 -19,-0.1 -17,-0.2 -0.410 44.9-151.1 -59.6 131.0 24.7 9.3 28.5 72 72 A M B -J 53 0C 0 -19,-2.7 -19,-1.7 -2,-0.1 2,-0.1 -0.948 7.4-160.7-112.4 122.3 20.9 9.8 27.9 73 73 A K > - 0 0 120 -2,-0.5 3,-1.9 1,-0.2 -26,-0.3 -0.296 49.9 -50.9 -86.5 179.2 18.4 9.2 30.6 74 74 A K T 3 S+ 0 0 130 -24,-0.3 -26,-0.2 1,-0.3 -1,-0.2 -0.253 128.3 8.1 -56.1 133.9 14.6 8.7 30.1 75 75 A E T 3 S+ 0 0 81 -28,-2.8 -62,-2.4 1,-0.3 2,-0.3 0.731 99.1 130.6 60.7 29.7 13.1 11.5 27.9 76 76 A Q E < -B 12 0A 50 -3,-1.9 -29,-2.6 -29,-0.5 2,-0.3 -0.852 40.2-156.7-108.4 149.4 16.5 12.9 27.1 77 77 A A E -BE 11 46A 0 -66,-2.9 -66,-2.3 -2,-0.3 2,-0.3 -0.826 12.5-172.8-124.4 157.6 17.6 13.7 23.5 78 78 A Y E - E 0 45A 7 -33,-2.0 -33,-2.9 -2,-0.3 2,-0.3 -0.975 12.2-156.8-154.1 138.6 20.8 14.2 21.6 79 79 A S E - E 0 44A 6 -72,-0.3 -72,-0.4 -2,-0.3 2,-0.3 -0.879 12.0-171.2-123.9 152.3 21.4 15.4 18.0 80 80 A L E - E 0 43A 0 -37,-2.3 -37,-2.9 -2,-0.3 2,-0.6 -0.998 15.7-146.5-137.2 141.2 23.9 15.1 15.2 81 81 A T E -AE 4 42A 23 -77,-2.6 -77,-1.9 -2,-0.3 2,-0.5 -0.930 17.4-147.3-109.3 118.9 23.8 17.1 11.9 82 82 A F E +A 3 0A 0 -41,-2.4 -42,-3.1 -2,-0.6 -41,-0.3 -0.775 22.7 171.9 -94.6 123.3 25.3 15.1 9.0 83 83 A T + 0 0 70 -81,-2.1 2,-0.4 -2,-0.5 -80,-0.1 0.358 58.2 59.3-113.5 3.9 27.1 17.0 6.3 84 84 A E S S- 0 0 102 -82,-0.6 20,-0.1 -46,-0.1 -1,-0.1 -0.998 81.1-114.2-138.2 133.6 28.6 14.3 4.1 85 85 A A + 0 0 53 -2,-0.4 2,-0.3 20,-0.1 20,-0.2 -0.342 68.1 89.9 -63.4 144.2 27.0 11.5 2.1 86 86 A G E S- I 0 104B 29 18,-2.2 18,-3.2 2,-0.0 2,-0.5 -0.916 76.6 -79.3 155.7-179.2 27.9 8.1 3.3 87 87 A T E - I 0 103B 75 -2,-0.3 2,-0.6 16,-0.2 16,-0.2 -0.987 37.7-166.5-118.2 130.1 26.7 5.4 5.7 88 88 A Y E - I 0 102B 13 14,-2.7 14,-2.3 -2,-0.5 2,-0.2 -0.942 4.0-159.2-123.8 105.8 27.6 5.9 9.4 89 89 A D E + I 0 101B 89 -2,-0.6 -31,-0.3 12,-0.2 2,-0.3 -0.531 15.4 175.1 -81.0 152.2 27.1 2.9 11.8 90 90 A Y E - 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