==== 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 HEME-BINDING PROTEIN 19-DEC-08 3FM2 . COMPND 2 MOLECULE: UNCHARACTERIZED PROTEIN, DISTANTLY RELATED TO A H . SOURCE 2 ORGANISM_SCIENTIFIC: ANABAENA VARIABILIS ATCC 29413; . AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) . 266 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12868.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 191 71.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 2.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 99 37.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 5 1.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 2.3 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 . 2 0.8 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 . 26 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 20 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 33 12.4 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 2 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 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 0 0 0 PARALLEL BRIDGES PER LADDER . 0 2 0 3 7 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 ANTIPARALLEL BRIDGES PER LADDER . 2 0 0 0 0 0 0 2 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 X 0 0 161 0, 0.0 127,-2.2 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 170.5 43.6 8.4 8.8 2 2 A S E +a 128 0A 58 125,-0.2 2,-0.3 127,-0.0 125,-0.0 -0.835 360.0 166.5-108.7 143.1 42.5 4.7 9.1 3 3 A H E -a 129 0A 37 125,-1.7 127,-1.9 -2,-0.4 2,-0.5 -0.940 43.8 -81.6-144.9 166.3 41.2 2.8 12.1 4 4 A S > - 0 0 24 -2,-0.3 4,-2.3 125,-0.2 5,-0.1 -0.592 27.0-157.2 -73.5 119.7 39.4 -0.5 13.0 5 5 A L H > S+ 0 0 4 -2,-0.5 4,-2.7 125,-0.3 5,-0.2 0.870 95.6 56.2 -64.4 -36.2 35.7 -0.2 12.3 6 6 A K H > S+ 0 0 44 127,-0.2 4,-2.2 2,-0.2 5,-0.2 0.972 108.9 44.7 -59.3 -53.9 35.2 -3.0 14.9 7 7 A D H > S+ 0 0 94 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.888 112.8 53.6 -57.6 -38.5 37.1 -1.1 17.6 8 8 A F H X S+ 0 0 0 -4,-2.3 4,-1.4 2,-0.2 -1,-0.2 0.935 108.0 48.0 -63.0 -46.6 35.1 2.0 16.6 9 9 A L H < S+ 0 0 3 -4,-2.7 4,-0.3 1,-0.2 -1,-0.2 0.881 111.7 50.6 -63.4 -37.9 31.7 0.3 17.0 10 10 A E H >< S+ 0 0 78 -4,-2.2 3,-1.2 1,-0.2 -1,-0.2 0.880 108.3 53.4 -63.8 -38.0 32.8 -1.1 20.4 11 11 A A H >< S+ 0 0 24 -4,-2.1 3,-2.0 1,-0.2 -2,-0.2 0.762 92.0 74.2 -67.8 -26.5 33.8 2.5 21.3 12 12 A C G >< S+ 0 0 0 -4,-1.4 3,-2.0 1,-0.3 23,-0.4 0.669 75.3 79.7 -61.8 -17.0 30.3 3.7 20.4 13 13 A E G X S+ 0 0 87 -3,-1.2 3,-1.0 -4,-0.3 -1,-0.3 0.794 84.1 63.8 -59.6 -27.2 29.0 2.1 23.6 14 14 A T G < S+ 0 0 92 -3,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.580 86.9 73.4 -71.2 -11.2 30.4 5.2 25.3 15 15 A L G < S- 0 0 1 -3,-2.0 -1,-0.2 1,-0.2 -2,-0.1 0.398 88.7-147.5 -86.6 2.1 27.9 7.4 23.4 16 16 A G < + 0 0 14 -3,-1.0 19,-0.5 19,-0.1 2,-0.3 -0.283 60.8 10.1 66.5-149.7 24.8 6.3 25.4 17 17 A T E S-B 34 0B 27 17,-0.2 84,-2.7 84,-0.1 17,-0.2 -0.443 75.3-175.3 -70.1 123.5 21.4 6.1 23.7 18 18 A L E -BC 33 100B 1 15,-1.8 15,-2.9 -2,-0.3 2,-0.5 -0.653 27.8-128.6-113.1 170.2 21.6 6.5 20.0 19 19 A R E -BC 32 99B 7 80,-2.6 80,-2.6 13,-0.2 2,-0.6 -0.986 25.0-151.1-119.5 111.5 19.1 6.7 17.1 20 20 A L E -BC 31 98B 0 11,-3.2 11,-2.4 -2,-0.5 2,-0.5 -0.794 13.8-168.0 -89.2 119.9 20.0 4.2 14.5 21 21 A I E +BC 30 97B 23 76,-3.1 76,-2.1 -2,-0.6 2,-0.5 -0.943 11.2 176.5-118.2 120.4 19.0 5.3 11.0 22 22 A V E -B 29 0B 0 7,-2.2 7,-2.3 -2,-0.5 2,-0.4 -0.983 9.9-166.6-122.3 129.9 18.9 3.1 8.0 23 23 A T E -B 28 0B 63 -2,-0.5 137,-0.2 71,-0.3 5,-0.2 -0.954 6.3-172.7-121.4 132.9 17.6 4.4 4.7 24 24 A S - 0 0 18 3,-2.7 135,-0.1 -2,-0.4 205,-0.1 -0.185 55.8 -74.9 -98.5-160.8 16.7 2.5 1.5 25 25 A S S S+ 0 0 50 133,-0.2 204,-0.1 1,-0.1 134,-0.1 0.815 128.2 6.9 -68.6 -28.6 15.8 4.0 -1.8 26 26 A A S S+ 0 0 6 203,-0.1 170,-3.6 1,-0.1 2,-0.3 0.410 119.2 63.4-135.5 -1.3 12.4 5.0 -0.5 27 27 A A E - D 0 195B 0 168,-0.2 -3,-2.7 202,-0.2 2,-0.4 -0.950 50.6-159.5-133.2 154.2 12.1 4.3 3.3 28 28 A V E -BD 23 194B 28 166,-2.7 166,-2.4 -2,-0.3 2,-0.4 -0.997 6.6-171.7-131.3 131.4 13.7 5.4 6.5 29 29 A L E -BD 22 193B 0 -7,-2.3 -7,-2.2 -2,-0.4 2,-0.4 -0.990 3.1-171.4-123.4 132.9 13.7 3.4 9.7 30 30 A E E -BD 21 192B 18 162,-2.7 162,-2.6 -2,-0.4 2,-0.4 -0.996 4.4-174.8-127.5 122.7 15.0 5.0 13.0 31 31 A A E -BD 20 191B 1 -11,-2.4 -11,-3.2 -2,-0.4 2,-0.4 -0.960 19.1-133.3-122.8 141.2 15.4 2.9 16.1 32 32 A R E +B 19 0B 108 158,-2.6 2,-0.2 -2,-0.4 -13,-0.2 -0.766 50.5 105.9 -93.1 132.5 16.4 4.1 19.6 33 33 A G E -B 18 0B 16 -15,-2.9 -15,-1.8 -2,-0.4 2,-0.2 -0.859 63.3 -90.7 170.0 159.6 19.0 2.2 21.5 34 34 A K E -B 17 0B 75 -2,-0.2 2,-1.2 -17,-0.2 -17,-0.2 -0.539 39.5-117.7 -79.8 152.0 22.6 2.0 22.8 35 35 A I S S+ 0 0 3 -19,-0.5 2,-0.3 -23,-0.4 -20,-0.1 -0.816 70.5 126.4 -90.1 94.0 25.2 0.4 20.6 36 36 A E + 0 0 57 -2,-1.2 -26,-0.0 1,-0.1 -27,-0.0 -0.931 45.7 35.4-145.6 166.4 26.0 -2.4 23.0 37 37 A K S S- 0 0 170 -2,-0.3 15,-0.3 1,-0.2 -1,-0.1 0.858 75.2-179.3 51.7 41.5 26.2 -6.2 23.1 38 38 A L - 0 0 24 13,-0.1 2,-0.3 -3,-0.1 13,-0.2 -0.429 8.6-168.8 -68.9 143.4 27.6 -6.2 19.5 39 39 A F E -J 50 0C 95 11,-2.0 11,-2.2 -2,-0.1 2,-0.3 -0.965 7.4-145.9-132.9 150.8 28.3 -9.6 18.0 40 40 A Y E +J 49 0C 47 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.868 17.5 172.7-118.6 149.1 30.1 -10.3 14.8 41 41 A A E -J 48 0C 35 7,-1.9 7,-3.2 -2,-0.3 2,-0.8 -0.985 30.0-129.1-154.1 143.4 29.7 -13.0 12.2 42 42 A E E -J 47 0C 120 -2,-0.3 5,-0.3 5,-0.2 2,-0.2 -0.880 33.8-179.1 -95.8 114.4 31.2 -13.8 8.8 43 43 A L E > -J 46 0C 85 3,-3.1 3,-1.4 -2,-0.8 -2,-0.0 -0.502 46.2 -92.8-102.1 174.6 28.4 -14.4 6.4 44 44 A A T 3 S+ 0 0 110 1,-0.3 3,-0.1 -2,-0.2 -1,-0.0 0.866 128.1 47.1 -55.5 -39.2 28.7 -15.2 2.7 45 45 A K T 3 S- 0 0 171 1,-0.2 -1,-0.3 0, 0.0 2,-0.3 0.495 125.8 -75.8 -83.5 -7.8 28.5 -11.5 1.8 46 46 A G E < -J 43 0C 4 -3,-1.4 -3,-3.1 16,-0.0 2,-0.5 -0.857 64.6 -34.8 144.2-176.1 31.0 -10.4 4.4 47 47 A K E -J 42 0C 44 -2,-0.3 15,-1.8 -5,-0.3 16,-0.7 -0.711 59.4-162.0 -84.9 124.3 31.9 -9.7 8.0 48 48 A Y E -JK 41 61C 38 -7,-3.2 -7,-1.9 -2,-0.5 2,-0.4 -0.853 20.0-148.7-113.5 144.2 28.9 -8.2 9.9 49 49 A A E -JK 40 60C 0 11,-2.2 11,-2.8 -2,-0.3 2,-0.3 -0.862 33.8-178.8 -99.0 142.0 28.5 -6.3 13.1 50 50 A N E -JK 39 59C 6 -11,-2.2 -11,-2.0 -2,-0.4 2,-0.3 -0.962 22.7-168.2-143.8 157.7 25.1 -7.1 14.7 51 51 A X E - K 0 58C 3 7,-2.2 7,-2.9 -2,-0.3 2,-0.4 -0.987 4.7-163.8-143.0 146.9 22.8 -6.4 17.6 52 52 A H E + K 0 57C 117 -15,-0.3 2,-0.3 -2,-0.3 5,-0.2 -0.995 19.3 159.8-130.7 121.8 19.6 -8.1 18.8 53 53 A T - 0 0 41 3,-2.7 -2,-0.0 -2,-0.4 -20,-0.0 -0.818 53.5-103.9-128.4 173.1 17.3 -6.3 21.3 54 54 A E S S+ 0 0 111 -2,-0.3 3,-0.1 1,-0.2 -1,-0.1 0.910 121.8 42.1 -65.0 -39.3 13.6 -7.0 22.1 55 55 A G S S- 0 0 39 1,-0.2 112,-2.9 -23,-0.1 2,-0.3 0.726 126.1 -0.7 -80.4 -27.2 12.6 -3.9 20.0 56 56 A F E - L 0 166C 8 110,-0.2 -3,-2.7 98,-0.1 2,-0.4 -0.996 50.8-137.7-161.0 161.1 14.9 -4.4 17.0 57 57 A E E -KL 52 165C 48 108,-2.2 108,-2.8 -2,-0.3 2,-0.4 -0.938 23.9-162.7-120.6 145.2 17.7 -6.4 15.2 58 58 A F E -KL 51 164C 1 -7,-2.9 -7,-2.2 -2,-0.4 2,-0.4 -0.994 9.8-178.6-135.4 137.3 20.6 -4.6 13.5 59 59 A H E -KL 50 163C 31 104,-2.3 104,-2.7 -2,-0.4 2,-0.4 -0.999 2.1-174.3-137.7 132.3 23.1 -5.8 10.9 60 60 A L E -KL 49 162C 0 -11,-2.8 -11,-2.2 -2,-0.4 2,-1.2 -0.990 22.4-141.2-129.1 124.8 26.0 -3.9 9.3 61 61 A N E > -K 48 0C 7 100,-3.8 3,-1.5 -2,-0.4 4,-0.2 -0.731 19.4-167.4 -83.1 101.0 28.2 -5.2 6.5 62 62 A X G > S+ 0 0 1 -15,-1.8 3,-1.3 -2,-1.2 -1,-0.2 0.816 78.8 64.6 -61.4 -31.1 31.4 -3.8 7.8 63 63 A E G 3 S+ 0 0 94 -16,-0.7 -1,-0.3 1,-0.2 -15,-0.1 0.600 96.1 58.8 -72.1 -9.3 33.3 -4.5 4.5 64 64 A K G < S+ 0 0 57 -3,-1.5 2,-0.6 97,-0.1 26,-0.4 0.469 80.6 97.8 -98.1 -4.1 31.1 -2.1 2.6 65 65 A I < + 0 0 9 -3,-1.3 24,-0.3 -4,-0.2 3,-0.1 -0.786 40.3 171.1 -90.5 118.7 31.9 1.0 4.6 66 66 A T + 0 0 57 22,-2.2 2,-0.3 -2,-0.6 23,-0.2 0.681 65.3 13.1 -99.0 -23.2 34.5 3.2 2.9 67 67 A Q E -E 88 0B 30 21,-1.3 21,-3.2 61,-0.2 2,-0.4 -0.995 56.0-153.9-155.8 149.8 34.4 6.2 5.2 68 68 A V E -EF 87 127B 0 59,-2.7 59,-2.1 -2,-0.3 2,-0.4 -0.996 17.3-169.4-128.7 131.7 33.0 7.4 8.5 69 69 A K E -EF 86 126B 55 17,-2.3 17,-2.7 -2,-0.4 2,-0.5 -0.979 17.2-144.0-127.9 134.8 32.2 11.1 9.3 70 70 A F E +E 85 0B 9 55,-2.9 2,-0.4 -2,-0.4 15,-0.2 -0.820 28.7 178.7 -90.1 132.7 31.2 13.0 12.4 71 71 A E E -E 84 0B 78 13,-2.9 13,-3.1 -2,-0.5 2,-0.5 -0.985 25.5-154.3-141.4 130.4 28.7 15.8 11.8 72 72 A T E +E 83 0B 86 -2,-0.4 11,-0.3 11,-0.2 2,-0.2 -0.856 33.4 167.6 -94.5 132.8 26.9 18.3 14.0 73 73 A G E -E 82 0B 32 9,-2.5 9,-2.4 -2,-0.5 2,-0.4 -0.617 34.2-109.6-130.4-170.1 23.6 19.3 12.4 74 74 A E E -E 81 0B 147 7,-0.3 7,-0.2 -2,-0.2 2,-0.1 -1.000 31.6-119.5-130.5 131.7 20.4 21.2 13.2 75 75 A A > - 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