==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ELECTRON TRANSPORT 11-AUG-04 1U9U . COMPND 2 MOLECULE: CYTOCHROME B5; . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR L.SHAN,J.-X.LU,J.-H.GAN,Y.-H.WANG,Z.-X.HUANG,Z.-X.XIA . 82 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 5824.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 52 63.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 5 6.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 12 14.6 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 . 2 2.4 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 . 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 . 4 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 13 15.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 16 19.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 1.2 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 0 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 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 1 0 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 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 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 3 A A 0 0 163 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 163.4 33.5 -0.3 14.9 2 4 A V - 0 0 68 2,-0.0 2,-0.5 73,-0.0 73,-0.1 -0.998 360.0-140.8-135.1 137.2 29.9 -1.5 14.5 3 5 A K - 0 0 133 -2,-0.4 73,-2.6 71,-0.1 2,-0.4 -0.833 17.4-156.4 -98.9 130.5 26.8 -0.6 16.5 4 6 A Y E -a 76 0A 94 -2,-0.5 2,-0.3 71,-0.2 73,-0.2 -0.914 6.6-167.5-113.4 134.0 24.3 -3.4 17.2 5 7 A Y E -a 77 0A 25 71,-2.7 73,-3.3 -2,-0.4 2,-0.2 -0.884 15.7-131.6-116.6 147.9 20.7 -2.9 18.1 6 8 A T > - 0 0 36 -2,-0.3 4,-1.9 71,-0.2 3,-0.3 -0.577 26.6-113.3 -93.2 160.1 18.2 -5.4 19.4 7 9 A L H > S+ 0 0 77 1,-0.2 4,-2.2 -2,-0.2 5,-0.2 0.878 115.8 62.5 -58.0 -37.1 14.7 -6.0 18.0 8 10 A E H 4 S+ 0 0 141 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.912 108.4 38.2 -56.9 -46.0 13.3 -4.6 21.2 9 11 A E H >4 S+ 0 0 70 -3,-0.3 3,-0.6 1,-0.2 -1,-0.2 0.823 113.0 57.0 -78.3 -26.9 14.9 -1.1 20.7 10 12 A I H >< S+ 0 0 0 -4,-1.9 3,-1.8 1,-0.2 10,-0.3 0.872 98.0 61.2 -70.0 -35.8 14.3 -1.1 17.0 11 13 A Q T 3< S+ 0 0 116 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.713 92.4 67.8 -65.1 -18.7 10.5 -1.6 17.4 12 14 A K T < S+ 0 0 140 -3,-0.6 2,-1.1 -4,-0.4 -1,-0.3 0.630 82.6 78.4 -76.1 -12.1 10.4 1.7 19.4 13 15 A H < + 0 0 47 -3,-1.8 7,-2.3 -4,-0.2 36,-0.4 -0.553 61.2 101.4 -99.5 70.5 11.2 3.8 16.3 14 16 A N B +E 19 0B 95 -2,-1.1 2,-0.2 5,-0.2 5,-0.2 -0.296 57.0 92.8-145.5 50.1 7.8 3.8 14.5 15 17 A N S S- 0 0 73 3,-1.9 3,-0.2 -3,-0.0 -2,-0.0 -0.678 92.2 -81.4-131.4-172.2 6.3 7.2 15.3 16 18 A S S S+ 0 0 112 -2,-0.2 3,-0.1 1,-0.2 -3,-0.0 0.715 126.5 49.8 -66.8 -18.9 6.1 10.6 13.7 17 19 A K S S+ 0 0 175 1,-0.3 2,-0.3 0, 0.0 -1,-0.2 0.790 119.3 18.4 -90.8 -32.3 9.5 11.4 15.1 18 20 A S - 0 0 16 -3,-0.2 -3,-1.9 -6,-0.1 2,-0.5 -0.989 52.9-171.9-148.4 135.1 11.6 8.4 14.0 19 21 A T B +E 14 0B 2 -2,-0.3 11,-2.2 -5,-0.2 12,-0.7 -0.940 16.7 166.6-130.0 108.3 11.2 5.6 11.5 20 22 A W E +B 29 0A 21 -7,-2.3 29,-3.7 -2,-0.5 30,-0.3 -0.871 4.4 173.1-116.6 154.0 13.7 2.7 11.5 21 23 A L E -B 28 0A 5 7,-1.7 7,-3.0 -2,-0.3 2,-0.4 -0.977 26.8-117.8-154.3 162.1 13.5 -0.6 9.7 22 24 A I E +Bc 27 51A 0 28,-2.8 30,-2.5 -2,-0.3 2,-0.4 -0.862 24.7 175.8-108.2 138.4 15.6 -3.7 9.1 23 25 A L E > S-B 26 0A 10 3,-2.2 3,-2.0 -2,-0.4 -2,-0.0 -0.961 76.0 -18.4-141.3 119.7 16.9 -4.9 5.7 24 26 A H T 3 S- 0 0 77 -2,-0.4 3,-0.1 1,-0.3 -1,-0.0 0.903 127.0 -53.3 48.1 50.5 19.2 -7.9 5.5 25 27 A Y T 3 S+ 0 0 110 1,-0.2 52,-2.5 51,-0.1 2,-0.3 0.528 114.8 116.2 64.5 9.2 20.2 -7.5 9.2 26 28 A K E < -BD 23 76A 66 -3,-2.0 -3,-2.2 50,-0.2 2,-0.5 -0.840 62.0-132.4-106.5 146.9 21.1 -3.9 8.8 27 29 A V E -BD 22 75A 0 48,-3.0 47,-2.8 -2,-0.3 48,-1.0 -0.870 22.1-166.1-102.1 127.5 19.3 -1.1 10.6 28 30 A Y E -BD 21 73A 10 -7,-3.0 -7,-1.7 -2,-0.5 2,-0.8 -0.909 16.8-149.3-115.6 137.9 18.2 1.9 8.5 29 31 A D E +B 20 0A 54 43,-2.5 3,-0.3 -2,-0.4 -9,-0.2 -0.895 24.2 168.2-104.2 102.9 17.0 5.3 9.8 30 32 A L >> + 0 0 13 -11,-2.2 3,-1.7 -2,-0.8 4,-1.4 0.285 35.5 119.1 -99.0 10.2 14.6 6.4 7.1 31 33 A T T 34 S+ 0 0 44 -12,-0.7 3,-0.3 1,-0.3 4,-0.2 0.846 83.8 34.6 -40.5 -51.7 13.1 9.3 9.0 32 34 A K T 34 S+ 0 0 195 -3,-0.3 -1,-0.3 1,-0.2 3,-0.1 0.496 112.7 61.6 -87.1 -5.1 14.2 12.0 6.5 33 35 A F T X> S+ 0 0 35 -3,-1.7 4,-1.9 1,-0.1 3,-1.4 0.635 75.4 92.6 -94.5 -17.7 13.7 9.8 3.5 34 36 A L T 3< S+ 0 0 9 -4,-1.4 3,-0.1 -3,-0.3 -1,-0.1 0.849 89.9 42.3 -44.9 -48.1 10.0 9.2 3.9 35 37 A E T 34 S+ 0 0 174 -4,-0.2 -1,-0.3 1,-0.2 -2,-0.1 0.658 116.1 49.2 -78.2 -14.9 9.0 12.2 1.7 36 38 A E T <4 S+ 0 0 146 -3,-1.4 -2,-0.2 -4,-0.1 -1,-0.2 0.670 78.5 115.1 -96.4 -19.8 11.6 11.5 -1.0 37 39 A H >< - 0 0 26 -4,-1.9 3,-2.7 1,-0.2 7,-0.1 -0.317 60.6-146.7 -55.5 116.4 10.9 7.7 -1.5 38 40 A P T 3 S+ 0 0 130 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 0.785 99.7 58.7 -56.7 -25.3 9.7 7.2 -5.0 39 41 A G T 3 S- 0 0 52 1,-0.2 4,-0.3 2,-0.0 -2,-0.1 0.441 117.3-110.5 -84.2 0.9 7.5 4.4 -3.6 40 42 A G < - 0 0 31 -3,-2.7 4,-0.3 1,-0.1 -1,-0.2 -0.071 20.0 -94.3 91.8 164.9 5.7 6.7 -1.2 41 43 A E S > S+ 0 0 79 2,-0.2 4,-2.8 1,-0.1 3,-0.4 0.735 111.1 70.3 -91.3 -23.7 5.9 7.0 2.5 42 44 A E H > S+ 0 0 161 1,-0.2 4,-1.5 2,-0.2 -1,-0.1 0.853 97.0 53.2 -61.4 -35.8 2.9 4.8 3.4 43 45 A V H 4 S+ 0 0 67 -4,-0.3 4,-0.4 2,-0.2 -1,-0.2 0.799 113.2 43.9 -71.3 -26.7 4.8 1.7 2.3 44 46 A L H >> S+ 0 0 18 -3,-0.4 3,-1.2 -4,-0.3 4,-1.1 0.918 110.1 52.5 -82.9 -47.4 7.7 2.6 4.6 45 47 A R H 3< S+ 0 0 97 -4,-2.8 3,-0.3 1,-0.3 -2,-0.2 0.844 103.5 59.9 -57.6 -34.6 5.7 3.6 7.7 46 48 A E T 3< S+ 0 0 152 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.793 110.8 40.2 -64.9 -27.9 3.8 0.3 7.5 47 49 A Q T X4 S+ 0 0 50 -3,-1.2 3,-1.7 -4,-0.4 -25,-0.2 0.568 86.9 131.2 -96.3 -11.0 7.1 -1.6 7.9 48 50 A A T 3< + 0 0 17 -4,-1.1 -27,-0.2 -3,-0.3 -34,-0.1 -0.041 68.4 21.9 -46.1 138.6 8.6 0.7 10.5 49 51 A G T 3 S+ 0 0 15 -29,-3.7 -1,-0.2 -36,-0.4 2,-0.2 0.385 118.1 59.9 84.8 -3.8 10.1 -0.9 13.6 50 52 A G S < S- 0 0 23 -3,-1.7 -28,-2.8 -30,-0.3 2,-0.6 -0.680 94.8 -63.7-139.0-166.3 10.5 -4.3 12.0 51 53 A D B +c 22 0A 81 -2,-0.2 -28,-0.2 -30,-0.2 3,-0.2 -0.773 39.7 169.0 -90.7 117.8 12.1 -6.4 9.3 52 54 A A > + 0 0 6 -30,-2.5 4,-2.1 -2,-0.6 5,-0.2 0.101 37.9 119.5-114.5 21.7 11.0 -5.4 5.8 53 55 A T H > S+ 0 0 22 -31,-0.3 4,-2.4 1,-0.2 5,-0.2 0.896 74.6 47.3 -55.1 -47.9 13.6 -7.4 3.8 54 56 A E H > S+ 0 0 167 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.933 113.7 46.2 -62.7 -47.0 11.1 -9.6 1.9 55 57 A N H > S+ 0 0 84 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.843 113.2 52.6 -63.5 -32.6 8.8 -6.7 0.9 56 58 A Y H <>S+ 0 0 33 -4,-2.1 5,-0.7 2,-0.2 4,-0.5 0.914 114.7 38.9 -68.3 -46.2 11.9 -4.8 -0.1 57 59 A E H <5S+ 0 0 69 -4,-2.4 3,-0.5 1,-0.2 -2,-0.2 0.795 107.1 67.3 -74.1 -29.4 13.2 -7.6 -2.3 58 60 A D H <5S+ 0 0 136 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.845 102.7 45.1 -59.8 -36.1 9.7 -8.4 -3.5 59 61 A V T <5S- 0 0 97 -4,-1.1 -1,-0.3 -3,-0.2 -2,-0.2 0.657 107.0-135.0 -82.3 -16.8 9.6 -5.1 -5.3 60 62 A G T 5 - 0 0 48 -4,-0.5 -3,-0.2 -3,-0.5 -2,-0.1 0.986 18.6-143.8 61.5 67.2 13.1 -5.6 -6.7 61 63 A H < - 0 0 53 -5,-0.7 -1,-0.1 1,-0.1 -5,-0.0 -0.220 18.6-109.2 -60.3 149.3 14.8 -2.3 -6.2 62 64 A S > - 0 0 72 1,-0.1 4,-1.8 4,-0.0 5,-0.2 -0.187 29.7-101.5 -74.7 169.7 17.3 -1.1 -8.8 63 65 A T H > S+ 0 0 108 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.887 122.4 52.5 -58.6 -43.1 21.1 -0.9 -8.4 64 66 A D H > S+ 0 0 132 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.868 106.5 53.1 -63.2 -37.4 20.9 2.8 -7.8 65 67 A A H > S+ 0 0 31 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.896 110.1 48.0 -65.0 -40.2 18.3 2.5 -5.1 66 68 A R H X S+ 0 0 77 -4,-1.8 4,-0.9 2,-0.2 -1,-0.2 0.846 109.7 52.3 -70.2 -33.8 20.5 -0.1 -3.3 67 69 A E H < S+ 0 0 107 -4,-2.0 3,-0.5 1,-0.2 4,-0.3 0.921 111.7 47.4 -67.5 -40.2 23.5 2.2 -3.5 68 70 A L H >< S+ 0 0 81 -4,-2.2 3,-1.7 1,-0.2 4,-0.3 0.851 100.2 66.2 -68.0 -35.3 21.5 5.0 -2.0 69 71 A S H >< S+ 0 0 18 -4,-1.9 3,-2.1 1,-0.3 4,-0.3 0.830 87.4 70.7 -57.0 -33.1 20.2 2.9 0.8 70 72 A K G >< S+ 0 0 126 -4,-0.9 3,-1.3 -3,-0.5 -1,-0.3 0.790 86.0 65.5 -56.5 -28.6 23.6 2.5 2.2 71 73 A T G < S+ 0 0 97 -3,-1.7 -1,-0.3 -4,-0.3 -2,-0.2 0.709 99.6 53.3 -69.6 -15.5 23.6 6.2 3.3 72 74 A F G < S+ 0 0 50 -3,-2.1 -43,-2.5 -4,-0.3 2,-0.3 0.374 77.7 118.7 -99.5 2.8 20.8 5.5 5.8 73 75 A I E < + D 0 28A 62 -3,-1.3 -45,-0.2 -4,-0.3 3,-0.1 -0.536 28.3 169.1 -72.4 130.5 22.5 2.6 7.6 74 76 A I E - 0 0 57 -47,-2.8 2,-0.3 1,-0.3 -46,-0.2 0.415 61.5 -49.1-118.6 -4.2 23.0 3.3 11.3 75 77 A G E - D 0 27A 7 -48,-1.0 -48,-3.0 -73,-0.1 -1,-0.3 -0.994 60.4 -78.0 165.1-164.4 24.0 -0.2 12.5 76 78 A E E -aD 4 26A 65 -73,-2.6 -71,-2.7 -2,-0.3 2,-0.3 -0.883 43.0 -92.9-130.4 162.1 23.2 -3.9 12.5 77 79 A L E -a 5 0A 6 -52,-2.5 -71,-0.2 -2,-0.3 5,-0.1 -0.580 55.0 -99.4 -74.4 132.2 20.8 -6.2 14.2 78 80 A H > - 0 0 61 -73,-3.3 3,-2.1 -2,-0.3 4,-0.4 -0.245 28.3-123.4 -53.0 132.4 22.4 -7.8 17.3 79 81 A P G > S+ 0 0 67 0, 0.0 3,-1.3 0, 0.0 -1,-0.1 0.805 108.8 62.2 -47.6 -36.7 23.6 -11.3 16.6 80 82 A D G 3 S+ 0 0 135 1,-0.2 -2,-0.1 2,-0.2 -74,-0.1 0.744 102.0 50.4 -65.5 -24.8 21.5 -12.7 19.4 81 83 A D G < 0 0 61 -3,-2.1 -1,-0.2 1,-0.2 -3,-0.1 0.390 360.0 360.0 -94.2 1.7 18.3 -11.6 17.7 82 84 A R < 0 0 138 -3,-1.3 -2,-0.2 -4,-0.4 -1,-0.2 0.801 360.0 360.0 -87.7 360.0 19.1 -13.2 14.3