==== 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 UNKNOWN FUNCTION 20-JAN-08 3C0F . COMPND 2 MOLECULE: UNCHARACTERIZED PROTEIN AF_1514; . SOURCE 2 ORGANISM_SCIENTIFIC: ARCHAEOGLOBUS FULGIDUS DSM 4304; . AUTHOR Y.LI,P.BAHTI,N.SHAW,G.SONG,J.YIN,J.-Y.ZHU,H.ZHANG,H.XU,B.-C. . 85 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 5542.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 63 74.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 7.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 19 22.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 . 0 0.0 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-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 . 13 15.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 6 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 18 21.2 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 0 0 0 0 1 0 0 0 1 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 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 PARALLEL BRIDGES PER LADDER . 0 1 0 0 1 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 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 B I 0 0 155 0, 0.0 2,-0.3 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 125.2 20.1 31.8 -12.0 2 4 B M - 0 0 33 1,-0.0 66,-0.2 67,-0.0 65,-0.1 -0.851 360.0 -67.7-136.2 171.0 18.1 28.9 -10.6 3 5 B D E -a 68 0A 125 64,-0.9 66,-2.4 -2,-0.3 2,-0.4 -0.379 57.0-156.5 -59.9 142.2 17.2 27.4 -7.2 4 6 B E E -a 69 0A 121 64,-0.2 2,-0.4 -2,-0.0 66,-0.2 -0.969 21.7-171.1-132.4 141.9 20.3 25.8 -5.7 5 7 B I E -a 70 0A 46 64,-2.7 66,-2.9 -2,-0.4 2,-0.6 -0.991 11.0-166.8-130.2 122.2 21.1 23.0 -3.2 6 8 B X E -a 71 0A 158 -2,-0.4 2,-0.5 64,-0.2 66,-0.2 -0.949 2.5-165.3-116.2 117.1 24.7 22.6 -2.0 7 9 B V E -a 72 0A 25 64,-3.3 66,-2.6 -2,-0.6 2,-0.5 -0.879 5.2-172.2-105.2 127.1 25.6 19.5 -0.1 8 10 B N - 0 0 111 -2,-0.5 2,-0.3 64,-0.2 64,-0.1 -0.930 10.6-174.2-120.1 103.4 28.9 19.2 1.8 9 11 B L - 0 0 53 -2,-0.5 4,-0.1 2,-0.2 -2,-0.0 -0.779 28.1-138.6-101.2 142.2 29.6 15.7 3.2 10 12 B Q S S+ 0 0 212 -2,-0.3 -1,-0.1 2,-0.1 2,-0.1 0.846 86.4 71.0 -63.9 -36.1 32.5 14.8 5.5 11 13 B K S S- 0 0 108 1,-0.1 2,-0.3 -3,-0.0 -2,-0.2 -0.409 92.2-106.0 -80.6 157.4 33.1 11.6 3.6 12 14 B E - 0 0 125 -2,-0.1 2,-0.4 61,-0.1 -1,-0.1 -0.636 37.5-154.9 -80.2 141.2 34.5 11.3 0.0 13 15 B V - 0 0 9 -2,-0.3 61,-0.1 -4,-0.1 2,-0.1 -0.926 8.2-137.9-122.1 145.0 32.0 10.5 -2.7 14 16 B S > - 0 0 54 -2,-0.4 4,-2.6 1,-0.1 5,-0.2 -0.396 37.8-101.3 -83.5 170.8 32.2 8.8 -6.1 15 17 B L H > S+ 0 0 63 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.925 124.6 48.3 -58.5 -45.9 30.4 10.1 -9.2 16 18 B E H > S+ 0 0 151 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.914 113.1 47.2 -61.3 -46.7 27.7 7.3 -8.8 17 19 B E H > S+ 0 0 64 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.909 113.4 48.1 -61.4 -45.2 27.3 8.0 -5.0 18 20 B A H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.879 111.1 50.7 -64.0 -41.0 27.0 11.8 -5.6 19 21 B E H X S+ 0 0 51 -4,-2.5 4,-3.0 2,-0.2 5,-0.2 0.906 109.6 50.4 -63.7 -43.1 24.5 11.3 -8.4 20 22 B R H X S+ 0 0 121 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.922 111.3 48.9 -59.9 -46.3 22.4 9.1 -6.2 21 23 B Y H X S+ 0 0 77 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.911 114.3 45.9 -56.5 -47.1 22.5 11.7 -3.4 22 24 B A H X S+ 0 0 0 -4,-2.4 4,-2.8 2,-0.2 -2,-0.2 0.913 112.6 48.7 -64.5 -46.8 21.5 14.4 -5.9 23 25 B X H X S+ 0 0 131 -4,-3.0 4,-1.9 1,-0.2 -1,-0.2 0.865 109.3 54.4 -63.0 -37.8 18.6 12.4 -7.5 24 26 B N H < S+ 0 0 107 -4,-2.3 4,-0.4 -5,-0.2 -1,-0.2 0.910 112.0 43.0 -62.7 -43.7 17.3 11.5 -4.1 25 27 B I H >< S+ 0 0 45 -4,-1.8 3,-1.5 1,-0.2 4,-0.3 0.940 112.8 52.5 -64.9 -49.9 17.1 15.2 -3.1 26 28 B A H >X S+ 0 0 0 -4,-2.8 3,-2.1 1,-0.2 4,-0.7 0.834 96.5 70.0 -53.1 -36.9 15.6 16.3 -6.5 27 29 B S T 3< S+ 0 0 78 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.664 85.4 66.7 -63.3 -20.1 12.9 13.6 -6.2 28 30 B X T <4 S+ 0 0 222 -3,-1.5 -1,-0.3 -4,-0.4 -2,-0.2 0.686 105.1 44.5 -70.5 -17.0 11.1 15.5 -3.4 29 31 B Y T <4 S- 0 0 125 -3,-2.1 2,-0.3 1,-0.3 -2,-0.2 0.583 123.3 -79.0-107.7 -13.1 10.3 18.3 -5.8 30 32 B G S < S- 0 0 28 -4,-0.7 2,-0.8 -3,-0.2 -1,-0.3 -0.980 81.4 -11.3 148.7-157.7 9.1 16.3 -8.8 31 33 B D E -B 82 0A 102 51,-3.0 51,-2.8 -2,-0.3 2,-0.9 -0.684 64.7-146.2 -81.0 106.9 10.4 14.3 -11.8 32 34 B G E -B 81 0A 21 -2,-0.8 2,-0.9 49,-0.2 49,-0.2 -0.651 13.2-169.2 -84.2 103.5 14.2 15.0 -11.9 33 35 B I E -B 80 0A 50 47,-2.4 47,-2.5 -2,-0.9 2,-0.5 -0.824 17.9-143.3 -90.7 105.6 15.5 15.1 -15.5 34 36 B L E +B 79 0A 40 -2,-0.9 45,-0.2 45,-0.2 3,-0.1 -0.595 26.5 171.5 -73.7 119.4 19.3 15.1 -15.1 35 37 B L E - 0 0 23 43,-3.0 2,-0.3 -2,-0.5 44,-0.2 0.849 57.1 -5.6 -97.6 -43.9 20.7 17.3 -17.9 36 38 B S E -B 78 0A 3 42,-1.3 42,-2.6 2,-0.0 2,-0.3 -0.988 50.6-157.1-153.1 158.8 24.4 17.7 -17.0 37 39 B V E -BC 77 46A 8 9,-2.6 9,-2.1 -2,-0.3 2,-0.4 -0.985 6.8-169.8-136.9 147.3 27.1 16.9 -14.5 38 40 B H E -BC 76 45A 18 38,-1.9 38,-2.5 -2,-0.3 2,-0.6 -0.999 14.2-150.5-137.8 137.4 30.5 18.5 -13.7 39 41 B D E > -B 75 0A 16 5,-2.9 4,-2.5 -2,-0.4 36,-0.2 -0.940 6.9-165.6-104.5 111.4 33.4 17.3 -11.5 40 42 B S T 4 S+ 0 0 74 34,-3.1 35,-0.1 -2,-0.6 -1,-0.1 0.626 86.4 54.5 -73.4 -14.3 35.2 20.4 -10.2 41 43 B X T 4 S+ 0 0 176 33,-0.2 -1,-0.2 3,-0.1 34,-0.1 0.850 124.6 19.5 -82.8 -39.5 38.1 18.3 -9.0 42 44 B T T 4 S- 0 0 101 2,-0.1 -2,-0.2 32,-0.1 3,-0.1 0.637 97.3-121.3-106.6 -21.8 38.9 16.5 -12.3 43 45 B G < + 0 0 27 -4,-2.5 -3,-0.1 1,-0.3 0, 0.0 0.370 59.0 151.9 90.2 -3.2 37.2 18.8 -14.9 44 46 B Y + 0 0 107 -5,-0.2 -5,-2.9 -6,-0.1 2,-0.3 -0.276 18.4 177.8 -59.0 140.7 35.0 16.0 -16.1 45 47 B R E -C 38 0A 33 -7,-0.2 -7,-0.2 -3,-0.1 4,-0.1 -0.993 19.7-120.2-142.5 153.3 31.6 16.8 -17.6 46 48 B A E S+C 37 0A 29 -9,-2.1 -9,-2.6 -2,-0.3 2,-0.2 -0.991 88.8 44.0-133.2 136.8 28.6 15.0 -19.2 47 49 B P S S- 0 0 43 0, 0.0 2,-1.8 0, 0.0 -10,-0.1 0.574 105.4-101.1 -70.4 178.2 27.4 15.4 -21.8 48 50 B E + 0 0 171 -2,-0.2 2,-0.5 -4,-0.0 -2,-0.1 -0.498 65.6 147.5 -75.7 84.4 30.7 15.5 -23.8 49 51 B V + 0 0 35 -2,-1.8 2,-0.3 -4,-0.1 8,-0.2 -0.967 14.8 162.3-125.1 114.4 31.0 19.3 -24.4 50 52 B Y + 0 0 123 -2,-0.5 -2,-0.0 1,-0.1 0, 0.0 -0.944 54.3 14.6-131.9 146.6 34.5 20.7 -24.5 51 53 B C S S+ 0 0 84 -2,-0.3 -1,-0.1 2,-0.2 3,-0.1 0.844 85.1 113.7 64.3 41.2 36.0 24.0 -25.8 52 54 B C S S- 0 0 77 1,-0.4 2,-0.1 -3,-0.1 -1,-0.1 -0.018 79.7-110.7-160.3 47.4 32.8 25.9 -26.1 53 55 B G S S+ 0 0 63 -4,-0.0 2,-0.6 0, 0.0 -1,-0.4 -0.507 70.2 23.0-132.6 -62.2 33.6 27.8 -24.0 54 56 B E S S- 0 0 63 1,-0.2 5,-0.2 -2,-0.1 4,-0.0 -0.758 121.9 -26.3 -87.3 119.9 32.8 29.0 -20.4 55 57 B K S >> S+ 0 0 73 -2,-0.6 4,-1.9 1,-0.1 3,-1.2 0.892 74.5 179.9 41.3 58.7 31.1 26.3 -18.3 56 58 B P H 3> S+ 0 0 9 0, 0.0 4,-2.6 0, 0.0 5,-0.1 0.768 74.7 60.5 -60.4 -28.9 29.5 24.6 -21.4 57 59 B W H 3> S+ 0 0 24 2,-0.2 4,-1.5 1,-0.2 -2,-0.1 0.818 108.5 44.8 -65.8 -32.8 27.8 21.9 -19.2 58 60 B E H <> S+ 0 0 42 -3,-1.2 4,-2.8 2,-0.2 5,-0.2 0.902 112.3 50.1 -77.0 -44.9 25.8 24.7 -17.5 59 61 B V H X S+ 0 0 75 -4,-1.9 4,-2.2 -5,-0.2 -2,-0.2 0.925 110.7 51.7 -56.9 -46.8 25.0 26.5 -20.7 60 62 B Y H X S+ 0 0 77 -4,-2.6 4,-0.5 1,-0.2 -1,-0.2 0.924 112.6 44.7 -53.6 -51.0 23.8 23.2 -22.2 61 63 B A H ><>S+ 0 0 0 -4,-1.5 5,-1.7 1,-0.2 3,-1.2 0.914 111.6 51.5 -63.2 -45.9 21.5 22.6 -19.1 62 64 B C H ><5S+ 0 0 58 -4,-2.8 3,-1.4 1,-0.3 -1,-0.2 0.846 105.7 55.7 -63.3 -35.5 20.1 26.1 -19.0 63 65 B N H 3<5S+ 0 0 118 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.643 106.7 52.6 -68.7 -16.7 19.2 26.0 -22.7 64 66 B R T <<5S- 0 0 91 -3,-1.2 -1,-0.3 -4,-0.5 -2,-0.2 0.052 128.8 -94.9-106.2 21.7 17.2 22.8 -21.8 65 67 B G T < 5 - 0 0 40 -3,-1.4 -3,-0.2 1,-0.2 16,-0.2 0.781 54.1-177.2 75.3 30.1 15.2 24.5 -19.0 66 68 B A < + 0 0 15 -5,-1.7 14,-0.3 14,-0.1 -1,-0.2 -0.363 10.5 169.2 -56.3 134.7 17.3 23.5 -16.0 67 69 B N + 0 0 70 12,-2.4 -64,-0.9 1,-0.2 2,-0.3 0.321 57.4 50.5-133.6 3.0 15.7 24.9 -12.9 68 70 B L E -aD 3 79A 11 11,-1.7 11,-3.0 -66,-0.2 2,-0.5 -0.921 56.9-165.2-148.7 121.7 17.6 23.2 -10.0 69 71 B X E -aD 4 78A 58 -66,-2.4 -64,-2.7 -2,-0.3 2,-0.5 -0.923 9.9-172.8-104.0 122.7 21.3 22.9 -9.4 70 72 B I E -aD 5 77A 0 7,-3.0 7,-2.8 -2,-0.5 2,-0.4 -0.969 2.9-166.3-118.9 119.2 22.4 20.3 -6.8 71 73 B S E -aD 6 76A 5 -66,-2.9 -64,-3.3 -2,-0.5 2,-0.4 -0.869 5.7-173.1-101.7 136.6 26.0 20.2 -5.7 72 74 B V E > -aD 7 75A 0 3,-2.3 3,-2.5 -2,-0.4 -64,-0.2 -0.951 63.5 -61.4-129.1 109.6 27.4 17.2 -3.8 73 75 B N T 3 S- 0 0 26 -66,-2.6 -66,-0.1 -2,-0.4 -61,-0.1 -0.317 125.2 -6.1 44.2-118.4 31.0 17.9 -2.7 74 76 B Q T 3 S+ 0 0 37 -61,-0.1 -34,-3.1 -3,-0.1 2,-0.3 0.531 121.1 88.8 -77.9 -7.4 33.0 18.4 -5.9 75 77 B F E < -BD 39 72A 6 -3,-2.5 -3,-2.3 -36,-0.2 2,-0.4 -0.717 56.1-162.6 -98.5 141.5 30.1 17.5 -8.2 76 78 B E E -BD 38 71A 12 -38,-2.5 -38,-1.9 -2,-0.3 2,-0.4 -0.992 7.0-166.5-120.7 131.3 27.5 19.8 -9.7 77 79 B F E -BD 37 70A 0 -7,-2.8 -7,-3.0 -2,-0.4 2,-0.6 -0.965 6.5-155.2-119.2 130.0 24.3 18.3 -11.1 78 80 B Y E -BD 36 69A 2 -42,-2.6 -43,-3.0 -2,-0.4 -42,-1.3 -0.926 19.1-175.9-110.6 117.7 21.9 20.3 -13.3 79 81 B F E -BD 34 68A 0 -11,-3.0 -12,-2.4 -2,-0.6 -11,-1.7 -0.836 29.3-147.3-111.5 145.3 18.2 19.2 -13.3 80 82 B R E -B 33 0A 70 -47,-2.5 -47,-2.4 -2,-0.3 2,-0.7 -0.966 27.2-151.8 -98.6 108.3 15.0 20.1 -15.1 81 83 B I E -B 32 0A 20 -2,-0.7 2,-0.4 -49,-0.2 -49,-0.2 -0.755 11.6-160.2 -82.5 115.8 12.4 19.3 -12.4 82 84 B E E -B 31 0A 82 -51,-2.8 -51,-3.0 -2,-0.7 2,-0.3 -0.830 6.7-167.7-100.3 137.2 9.2 18.4 -14.1 83 85 B V - 0 0 111 -2,-0.4 -53,-0.1 -53,-0.2 -54,-0.0 -0.829 32.9-117.7-121.1 161.4 5.8 18.6 -12.3 84 86 B E 0 0 209 -2,-0.3 -1,-0.1 1,-0.2 -54,-0.0 0.833 360.0 360.0 -67.2 -34.1 2.3 17.3 -13.2 85 87 B G 0 0 116 -3,-0.0 -1,-0.2 0, 0.0 -3,-0.0 0.270 360.0 360.0 43.3 360.0 1.0 20.8 -13.2