==== 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 STRUCTURAL GENOMICS, UNKNOWN FUNCTION 03-NOV-06 2NS9 . COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN APE2225; . SOURCE 2 ORGANISM_SCIENTIFIC: AEROPYRUM PERNIX; . AUTHOR X.JIN,A.BERA,S.WASSERMAN,D.SMITH,J.M.SAUDER,S.K.BURLEY,L.SHA . 304 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16207.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 248 81.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 144 47.4 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 . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 2.6 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-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 4.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 29 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 61 20.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 3 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 0 0 0 0 0 2 0 1 5 0 2 1 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 0 0 0 1 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 5 A A 0 0 93 0, 0.0 166,-2.3 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 153.0 70.2 -7.0 34.6 2 6 A G E +A 166 0A 32 164,-0.2 2,-0.3 2,-0.0 164,-0.2 -0.879 360.0 165.1-156.5 127.5 69.3 -7.9 30.9 3 7 A V E -A 165 0A 85 162,-2.3 162,-2.1 -2,-0.3 2,-0.3 -0.913 8.7-173.6-143.5 158.9 66.4 -6.5 28.9 4 8 A W E +A 164 0A 53 -2,-0.3 2,-0.3 160,-0.2 160,-0.2 -0.998 11.0 174.4-154.9 158.7 65.2 -6.2 25.2 5 9 A G E -A 163 0A 9 158,-1.9 158,-3.0 -2,-0.3 2,-0.3 -0.924 31.9-105.9-151.4 172.4 62.7 -4.8 22.7 6 10 A L E -AB 162 118A 2 112,-2.6 112,-2.9 -2,-0.3 2,-0.4 -0.805 16.1-159.8-111.0 146.9 62.3 -4.9 18.9 7 11 A K E -AB 161 117A 88 154,-2.6 154,-2.6 -2,-0.3 2,-0.4 -0.968 19.0-173.3-115.5 142.7 62.8 -2.2 16.3 8 12 A V E -AB 160 116A 9 108,-2.8 108,-2.6 -2,-0.4 2,-0.4 -0.982 15.2-176.8-140.5 144.0 61.1 -2.7 12.9 9 13 A R E +AB 159 115A 84 150,-2.3 150,-2.5 -2,-0.4 2,-0.4 -0.969 6.3 175.5-137.1 132.3 61.1 -1.0 9.5 10 14 A Y E +AB 158 114A 3 104,-2.5 104,-3.2 -2,-0.4 2,-0.3 -0.964 3.8 177.4-125.7 146.3 58.9 -1.8 6.5 11 15 A E E +AB 157 113A 86 146,-2.7 146,-2.1 -2,-0.4 2,-0.3 -0.994 15.7 124.2-144.6 151.9 58.7 0.0 3.2 12 16 A G E -AB 156 112A 11 100,-2.0 100,-2.6 -2,-0.3 2,-0.3 -0.961 35.1-129.6-176.6-171.6 56.9 -0.6 0.0 13 17 A S E - B 0 111A 17 142,-2.1 142,-0.4 -2,-0.3 2,-0.3 -0.977 13.9-174.1-158.2 157.9 54.5 0.8 -2.6 14 18 A F E - B 0 110A 23 96,-1.8 96,-2.6 -2,-0.3 2,-0.3 -0.944 19.3-123.3-150.5 165.6 51.3 -0.3 -4.3 15 19 A E E - B 0 109A 91 -2,-0.3 2,-0.3 94,-0.2 94,-0.2 -0.883 19.5-176.4-120.8 147.4 49.1 1.1 -7.1 16 20 A V E - B 0 108A 8 92,-2.3 92,-2.7 -2,-0.3 88,-0.1 -0.938 31.7-127.1-137.3 161.3 45.5 2.0 -7.4 17 21 A S S S+ 0 0 77 -2,-0.3 2,-0.1 90,-0.2 92,-0.1 0.636 78.9 98.3 -82.5 -18.0 43.3 3.2 -10.2 18 22 A K S S- 0 0 59 1,-0.1 -2,-0.2 90,-0.1 132,-0.0 -0.310 82.5 -97.5 -75.2 159.1 42.0 6.2 -8.4 19 23 A T > - 0 0 43 1,-0.1 4,-2.6 88,-0.1 5,-0.3 -0.262 33.9-110.6 -71.1 152.9 43.3 9.7 -8.8 20 24 A P H > S+ 0 0 21 0, 0.0 4,-3.2 0, 0.0 5,-0.3 0.911 119.6 54.6 -54.3 -38.8 45.8 11.0 -6.3 21 25 A E H > S+ 0 0 141 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.891 110.6 44.8 -58.0 -45.5 43.2 13.4 -4.9 22 26 A E H > S+ 0 0 82 2,-0.2 4,-2.0 -3,-0.2 -1,-0.2 0.892 116.3 46.7 -66.7 -42.4 40.7 10.6 -4.3 23 27 A V H X S+ 0 0 0 -4,-2.6 4,-2.7 2,-0.2 -2,-0.2 0.928 112.0 49.1 -67.4 -44.9 43.4 8.4 -2.7 24 28 A F H X S+ 0 0 4 -4,-3.2 4,-1.0 -5,-0.3 -2,-0.2 0.920 109.7 52.5 -63.3 -40.2 44.8 11.1 -0.5 25 29 A E H >< S+ 0 0 100 -4,-2.0 3,-0.6 -5,-0.3 -1,-0.2 0.932 112.1 45.8 -59.1 -46.5 41.3 12.0 0.8 26 30 A F H >< S+ 0 0 2 -4,-2.0 3,-1.7 1,-0.2 7,-0.5 0.941 111.7 50.4 -61.0 -49.4 40.6 8.3 1.7 27 31 A L H 3< S+ 0 0 20 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.571 113.2 47.3 -73.6 -7.1 44.0 7.8 3.4 28 32 A T T << S+ 0 0 25 -4,-1.0 -1,-0.3 -3,-0.6 -2,-0.2 0.180 94.6 81.7-113.3 15.4 43.5 11.0 5.5 29 33 A D X> - 0 0 46 -3,-1.7 4,-2.5 1,-0.1 3,-1.2 -0.887 59.4-168.6-120.4 92.7 39.9 10.2 6.6 30 34 A P H 3> S+ 0 0 9 0, 0.0 4,-2.0 0, 0.0 5,-0.2 0.787 85.5 60.7 -56.6 -31.1 40.1 7.7 9.6 31 35 A K H 34 S+ 0 0 141 2,-0.2 4,-0.3 1,-0.2 -5,-0.1 0.871 115.5 35.2 -62.2 -32.8 36.4 7.0 9.4 32 36 A R H X4 S+ 0 0 94 -3,-1.2 3,-1.0 -6,-0.2 4,-0.2 0.932 120.5 44.1 -84.6 -52.5 36.9 5.6 5.9 33 37 A F H >< S+ 0 0 23 -4,-2.5 3,-2.1 -7,-0.5 4,-0.5 0.803 98.3 71.8 -68.8 -23.3 40.4 4.0 6.1 34 38 A S G >< S+ 0 0 0 -4,-2.0 3,-1.4 -5,-0.3 -1,-0.2 0.851 89.6 63.9 -60.3 -28.5 39.7 2.3 9.5 35 39 A R G < S+ 0 0 131 -3,-1.0 -1,-0.3 -4,-0.3 -2,-0.2 0.650 88.7 68.7 -72.1 -14.0 37.4 -0.1 7.5 36 40 A A G < S+ 0 0 3 -3,-2.1 108,-0.3 -4,-0.2 -1,-0.3 0.724 82.4 95.0 -71.2 -21.7 40.5 -1.3 5.6 37 41 A F S X S- 0 0 55 -3,-1.4 3,-1.4 -4,-0.5 2,-0.1 -0.474 82.4-119.2 -76.4 135.0 41.8 -2.9 8.8 38 42 A P T 3 S+ 0 0 35 0, 0.0 17,-0.2 0, 0.0 -1,-0.1 -0.452 99.2 19.3 -69.3 144.5 41.1 -6.5 9.4 39 43 A G T 3 S- 0 0 37 1,-0.2 16,-2.4 15,-0.1 -4,-0.1 0.731 84.6-179.6 71.3 20.7 39.1 -7.0 12.6 40 44 A F E < +C 54 0A 42 -3,-1.4 14,-0.2 14,-0.2 -1,-0.2 -0.260 13.4 165.6 -53.2 135.6 37.9 -3.4 12.7 41 45 A K E - 0 0 109 12,-2.6 2,-0.3 1,-0.4 13,-0.2 0.683 57.0 -24.4-119.3 -49.3 35.7 -2.7 15.7 42 46 A S E -C 53 0A 47 11,-1.6 11,-2.9 -8,-0.1 -1,-0.4 -0.992 46.7-150.4-161.9 162.3 35.4 1.1 16.1 43 47 A V E -C 52 0A 34 -2,-0.3 2,-0.4 9,-0.2 9,-0.2 -1.000 1.5-163.9-139.6 144.0 37.1 4.5 15.4 44 48 A E E -C 51 0A 91 7,-2.3 7,-2.3 -2,-0.4 2,-0.4 -0.986 15.3-172.5-124.0 137.2 37.0 7.8 17.1 45 49 A V E +C 50 0A 77 -2,-0.4 2,-0.2 5,-0.2 5,-0.2 -0.998 16.6 140.1-135.4 130.7 38.2 11.0 15.2 46 50 A E E > +C 49 0A 140 3,-2.8 3,-2.1 -2,-0.4 -2,-0.0 -0.867 66.5 0.3-163.7 142.6 38.9 14.6 16.3 47 51 A D T 3 S- 0 0 148 1,-0.3 3,-0.1 -2,-0.2 -2,-0.0 0.799 126.9 -54.0 55.9 33.4 41.4 17.4 15.7 48 52 A G T 3 S+ 0 0 43 1,-0.3 23,-2.1 22,-0.1 2,-0.3 0.459 119.8 103.0 80.3 3.7 43.4 15.3 13.2 49 53 A S E < +CD 46 70A 45 -3,-2.1 -3,-2.8 21,-0.2 2,-0.3 -0.846 46.3 178.2-122.2 153.3 43.9 12.5 15.7 50 54 A F E -CD 45 69A 13 19,-2.7 19,-2.9 -2,-0.3 2,-0.4 -0.979 21.3-146.9-152.2 157.1 42.1 9.2 15.9 51 55 A T E -CD 44 68A 15 -7,-2.3 -7,-2.3 -2,-0.3 2,-0.4 -0.999 14.6-164.1-129.9 132.5 41.9 6.0 17.8 52 56 A I E -CD 43 67A 6 15,-2.6 15,-2.8 -2,-0.4 2,-0.5 -0.957 6.2-154.1-115.6 130.8 41.0 2.6 16.1 53 57 A E E +CD 42 66A 53 -11,-2.9 -12,-2.6 -2,-0.4 -11,-1.6 -0.910 22.9 177.1-101.9 133.3 39.9 -0.4 18.1 54 58 A L E -CD 40 65A 7 11,-2.6 11,-2.7 -2,-0.5 2,-0.6 -0.940 33.2-130.3-133.1 153.3 40.7 -3.8 16.4 55 59 A R E - D 0 64A 130 -16,-2.4 2,-0.3 -2,-0.3 9,-0.2 -0.943 32.2-145.1-101.3 116.3 40.4 -7.5 17.0 56 60 A L E + D 0 63A 34 7,-2.8 7,-1.8 -2,-0.6 3,-0.1 -0.587 27.7 172.4 -83.8 138.3 43.7 -9.0 16.2 57 61 A S E + D 0 62A 81 -2,-0.3 5,-0.2 5,-0.2 -1,-0.1 -0.256 49.0 109.7-131.4 49.4 43.8 -12.6 14.7 58 62 A L S S- 0 0 17 3,-2.1 4,-0.2 5,-0.1 79,-0.1 0.053 71.6-154.8-131.6 16.0 47.5 -12.5 14.0 59 63 A G S S+ 0 0 32 2,-0.3 3,-0.1 -3,-0.1 4,-0.0 -0.571 76.7 62.3 144.7 66.6 47.8 -14.6 16.2 60 64 A P S S+ 0 0 91 0, 0.0 2,-0.8 0, 0.0 -2,-0.0 -0.447 123.3 63.0 -32.7 -29.9 49.9 -16.0 18.6 61 65 A L S S+ 0 0 40 61,-0.0 -3,-2.1 27,-0.0 2,-0.3 -0.911 82.9 146.0-103.7 106.9 49.0 -12.3 18.9 62 66 A R E +D 57 0A 199 -2,-0.8 27,-0.3 -5,-0.2 -5,-0.2 -0.944 19.6 49.9-140.2 160.2 45.2 -12.2 19.4 63 67 A G E S-D 56 0A 16 -7,-1.8 -7,-2.8 -2,-0.3 -5,-0.1 -0.490 87.6 -17.7 107.2-174.0 42.5 -10.2 21.1 64 68 A D E +D 55 0A 82 -9,-0.2 25,-0.3 -2,-0.2 2,-0.3 -0.353 58.8 175.9 -72.9 138.5 41.5 -6.6 21.4 65 69 A A E -D 54 0A 12 -11,-2.7 -11,-2.6 23,-0.2 2,-0.4 -0.950 16.2-150.4-137.2 160.7 44.0 -3.9 20.5 66 70 A R E -DE 53 87A 66 21,-2.5 21,-2.2 -2,-0.3 2,-0.5 -0.998 3.3-163.9-134.6 132.7 43.9 -0.1 20.3 67 71 A V E -DE 52 86A 34 -15,-2.8 -15,-2.6 -2,-0.4 2,-0.5 -0.989 5.8-170.9-118.2 128.0 45.9 2.2 18.0 68 72 A R E +DE 51 85A 142 17,-2.5 17,-2.4 -2,-0.5 2,-0.3 -0.980 21.0 157.7-118.6 122.7 46.0 6.0 18.9 69 73 A A E -DE 50 84A 3 -19,-2.9 -19,-2.7 -2,-0.5 2,-0.4 -0.912 28.3-151.2-147.8 166.2 47.6 8.2 16.3 70 74 A S E -DE 49 83A 46 13,-2.5 13,-2.5 -2,-0.3 2,-0.3 -0.995 24.2-120.0-137.4 139.0 47.9 11.8 14.9 71 75 A F E + E 0 82A 30 -23,-2.1 11,-0.3 -2,-0.4 3,-0.1 -0.674 33.4 168.1 -70.8 140.1 48.6 13.2 11.5 72 76 A E E + 0 0 120 9,-2.8 -1,-0.1 1,-0.5 10,-0.1 0.604 65.2 35.6-111.9 -87.4 51.7 15.4 11.5 73 77 A D E + 0 0 53 2,-0.0 8,-2.2 1,-0.0 -1,-0.5 -0.431 67.4 167.0 -66.0 138.4 52.8 16.1 7.8 74 78 A L E + E 0 80A 69 6,-0.2 2,-0.6 -3,-0.1 6,-0.2 -0.600 3.7 163.3-160.2 91.6 49.7 16.5 5.6 75 79 A E E >> - E 0 79A 104 4,-3.6 4,-2.1 -2,-0.2 3,-2.1 -0.919 43.0-104.4-119.1 100.0 50.2 18.0 2.2 76 80 A K T 34 S- 0 0 150 -2,-0.6 -55,-0.1 1,-0.3 -2,-0.0 -0.522 90.9 -2.3 -70.2 135.9 47.3 17.4 -0.2 77 81 A P T 34 S+ 0 0 61 0, 0.0 -1,-0.3 0, 0.0 -53,-0.2 -0.778 132.2 41.6-106.9 35.7 47.3 15.4 -2.4 78 82 A S T <4 S+ 0 0 49 -3,-2.1 23,-2.1 1,-0.2 2,-0.3 0.687 99.8 24.6-119.8 -29.8 50.9 14.1 -2.0 79 83 A K E < +EF 75 100A 94 -4,-2.1 -4,-3.6 21,-0.3 2,-0.3 -0.997 44.9 166.5-153.4 143.4 52.3 13.4 1.5 80 84 A A E -EF 74 99A 2 19,-2.2 19,-2.7 -2,-0.3 2,-0.4 -0.987 15.4-155.2-151.7 152.6 51.4 12.6 5.1 81 85 A T E - F 0 98A 9 -8,-2.2 -9,-2.8 -2,-0.3 2,-0.4 -0.994 7.9-166.3-130.3 139.3 52.9 11.4 8.3 82 86 A V E -EF 71 97A 7 15,-2.6 15,-3.2 -2,-0.4 2,-0.4 -0.989 3.2-171.2-123.5 133.3 51.1 9.6 11.1 83 87 A K E +EF 70 96A 62 -13,-2.5 -13,-2.5 -2,-0.4 2,-0.3 -0.983 28.4 115.3-122.2 133.4 52.6 9.1 14.6 84 88 A G E -EF 69 95A 20 11,-2.2 11,-2.8 -2,-0.4 2,-0.3 -0.958 47.6-105.3-168.9-163.9 51.1 6.9 17.2 85 89 A S E -EF 68 94A 40 -17,-2.4 -17,-2.5 -2,-0.3 2,-0.3 -0.926 16.8-152.3-140.1 159.2 51.1 3.9 19.5 86 90 A G E -EF 67 93A 9 7,-3.0 7,-2.6 -2,-0.3 2,-0.4 -0.970 11.1-172.5-132.0 147.4 49.4 0.6 19.6 87 91 A R E +EF 66 92A 162 -21,-2.2 -21,-2.5 -2,-0.3 5,-0.2 -0.993 7.1 173.2-140.1 133.4 48.5 -1.6 22.6 88 92 A G - 0 0 26 3,-1.9 -23,-0.2 -2,-0.4 -25,-0.1 -0.438 60.4 -66.9-109.6-158.4 47.1 -5.1 23.0 89 93 A A S S- 0 0 107 -25,-0.3 -24,-0.1 -27,-0.3 3,-0.1 0.696 128.3 -2.3 -63.8 -17.3 46.7 -7.2 26.1 90 94 A G S S+ 0 0 31 1,-0.1 31,-2.9 29,-0.1 2,-0.3 0.410 117.0 76.3-156.9 -1.0 50.4 -7.5 26.6 91 95 A S E - G 0 120A 23 29,-0.3 -3,-1.9 30,-0.2 2,-0.3 -0.857 52.2-154.1-124.7 161.0 52.3 -5.7 23.9 92 96 A T E -FG 87 119A 50 27,-2.2 27,-1.9 -2,-0.3 2,-0.4 -0.953 5.9-172.0-131.1 145.5 53.2 -2.1 22.9 93 97 A L E -FG 86 118A 44 -7,-2.6 -7,-3.0 -2,-0.3 2,-0.4 -0.993 3.9-174.1-135.1 134.9 54.0 -0.5 19.6 94 98 A D E +FG 85 117A 85 23,-2.2 23,-2.4 -2,-0.4 2,-0.3 -0.995 27.2 167.4-121.8 135.9 55.1 3.0 19.0 95 99 A F E -FG 84 116A 25 -11,-2.8 -11,-2.2 -2,-0.4 2,-0.4 -0.954 37.5-149.5-148.1 161.3 55.4 4.0 15.4 96 100 A T E -FG 83 115A 32 19,-2.6 19,-2.6 -2,-0.3 2,-0.5 -0.999 17.1-168.8-129.1 133.8 55.7 6.5 12.6 97 101 A L E -FG 82 114A 48 -15,-3.2 -15,-2.6 -2,-0.4 2,-0.4 -0.984 4.1-174.9-122.5 122.7 54.1 5.9 9.2 98 102 A R E +FG 81 113A 123 15,-2.7 15,-2.0 -2,-0.5 2,-0.3 -0.957 8.1 178.2-117.1 134.0 55.0 8.2 6.2 99 103 A F E -FG 80 112A 20 -19,-2.7 -19,-2.2 -2,-0.4 2,-0.4 -0.974 14.7-162.7-136.3 155.3 53.3 7.9 2.9 100 104 A A E -FG 79 111A 32 11,-2.7 11,-2.6 -2,-0.3 2,-0.4 -0.971 6.0-157.1-132.0 141.4 53.3 9.6 -0.5 101 105 A V E + G 0 110A 4 -23,-2.1 9,-0.2 -2,-0.4 -2,-0.0 -0.993 19.2 176.6-118.7 122.0 50.8 9.5 -3.3 102 106 A E E - 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