==== 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 NUCLEIC ACID BINDING PROTEIN/DNA/RNA 28-MAY-09 3HM9 . COMPND 2 MOLECULE: ARGONAUTE; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS THERMOPHILUS; . AUTHOR Y.WANG,H.LI,G.SHENG,D.J.PATEL . 654 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 31506.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 414 63.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 30 4.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 108 16.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 56 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 52 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 134 20.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 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 0 0 0 0 1 0 3 1 0 1 1 0 1 2 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 0 3 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 PARALLEL BRIDGES PER LADDER . 5 5 7 4 0 3 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 . 1 2 2 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 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 H 0 0 116 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 17.0 1.7 6.2 0.8 2 4 A L - 0 0 82 292,-0.1 2,-0.4 293,-0.1 292,-0.1 -0.717 360.0-155.7-115.5 153.6 -1.8 7.5 -0.4 3 5 A G E -A 293 0A 43 290,-0.7 290,-1.4 -2,-0.3 288,-0.0 -0.974 30.5-123.2-126.4 119.3 -4.2 7.3 -3.4 4 6 A K E +A 292 0A 141 -2,-0.4 2,-0.2 288,-0.2 288,-0.2 -0.220 31.5 167.5 -66.7 140.0 -6.7 10.1 -3.8 5 7 A T E -A 291 0A 82 286,-2.0 286,-1.5 2,-0.0 2,-0.4 -0.725 30.9-127.1-119.9 179.0 -10.5 9.9 -4.1 6 8 A E E +A 290 0A 103 -2,-0.2 556,-0.8 284,-0.2 2,-0.3 -0.937 30.1 174.3-132.0 118.0 -12.9 12.8 -3.9 7 9 A V E -AB 289 561A 9 282,-1.2 282,-1.4 -2,-0.4 2,-0.4 -0.737 22.0-140.2-105.2 157.3 -15.8 12.7 -1.4 8 10 A F E -AB 288 560A 33 552,-2.3 552,-1.1 -2,-0.3 280,-0.2 -0.987 16.9-149.7-121.8 129.2 -18.3 15.4 -0.5 9 11 A L E - B 0 559A 16 278,-0.7 2,-2.1 -2,-0.4 550,-0.2 -0.193 39.4 -80.1 -80.0 172.0 -19.3 15.9 3.1 10 12 A N E S+ 0 0 2 548,-1.3 155,-0.9 276,-0.1 2,-0.3 -0.409 93.0 102.8 -82.3 65.5 -22.7 17.1 4.4 11 13 A R E - C 0 164A 63 -2,-2.1 276,-1.2 276,-0.3 2,-0.3 -0.938 50.8-158.8-131.6 160.0 -22.1 20.8 3.8 12 14 A F E -AC 286 163A 9 151,-1.2 151,-1.8 -2,-0.3 2,-0.7 -0.998 14.6-132.8-144.3 137.2 -23.5 23.1 1.1 13 15 A A E -AC 285 162A 39 272,-0.8 272,-1.2 -2,-0.3 149,-0.2 -0.803 30.8-178.8 -97.9 117.5 -22.3 26.4 -0.2 14 16 A L E - 0 0 8 147,-2.3 268,-0.2 -2,-0.7 262,-0.0 -0.435 39.0 -42.3-108.5-179.5 -25.0 29.0 -0.6 15 17 A R E - 0 0 63 266,-3.0 146,-1.8 145,-0.2 -1,-0.2 0.042 63.6-103.7 -47.7 144.4 -25.2 32.6 -1.8 16 18 A P E - C 0 160A 86 0, 0.0 144,-0.3 0, 0.0 -1,-0.1 -0.287 45.5 -93.7 -57.9 150.0 -22.5 35.1 -0.9 17 19 A L - 0 0 13 142,-1.3 5,-0.0 4,-0.1 138,-0.0 -0.404 42.3-130.2 -65.2 146.4 -23.4 37.7 1.8 18 20 A N >> - 0 0 66 -3,-0.1 3,-2.8 -2,-0.1 4,-0.8 -0.692 29.5 -91.2-100.4 156.0 -24.7 41.0 0.5 19 21 A P G >4 S+ 0 0 76 0, 0.0 3,-2.1 0, 0.0 4,-0.2 0.760 124.6 51.9 -25.6 -62.8 -23.6 44.5 1.5 20 22 A E G >4 S+ 0 0 114 1,-0.3 3,-0.8 2,-0.2 -3,-0.0 0.788 109.3 52.0 -53.4 -30.7 -26.1 45.0 4.3 21 23 A E G <4 S+ 0 0 20 -3,-2.8 -1,-0.3 1,-0.2 -4,-0.1 0.637 99.9 63.8 -80.5 -16.1 -24.9 41.7 5.8 22 24 A L G << S+ 0 0 44 -3,-2.1 74,-2.6 -4,-0.8 -1,-0.2 0.282 106.9 42.7 -92.1 9.9 -21.3 42.8 5.7 23 25 A R S < S- 0 0 103 -3,-0.8 -1,-0.2 72,-0.3 -2,-0.0 -0.494 79.3-165.6-156.4 78.3 -21.9 45.7 8.2 24 26 A P - 0 0 14 0, 0.0 70,-1.1 0, 0.0 2,-0.4 -0.020 23.9-105.8 -65.2 166.5 -24.1 44.8 11.2 25 27 A W E -QR 64 93B 58 39,-3.3 39,-1.9 68,-0.2 2,-0.3 -0.835 28.9-149.9 -99.0 129.8 -25.8 47.1 13.7 26 28 A R E -Q 63 0B 45 66,-2.1 65,-0.9 -2,-0.4 66,-0.5 -0.739 14.2-176.4 -98.1 147.1 -24.4 47.5 17.3 27 29 A L E -QR 62 90B 15 35,-1.5 35,-1.2 -2,-0.3 2,-0.3 -0.974 16.7-143.7-146.6 129.3 -26.5 48.3 20.3 28 30 A E E - R 0 89B 56 61,-2.1 61,-3.3 -2,-0.3 33,-0.1 -0.713 23.1-148.5 -92.5 145.2 -25.7 48.9 24.0 29 31 A V - 0 0 59 -2,-0.3 2,-0.4 59,-0.2 59,-0.2 -0.254 9.4-121.6-103.0-177.6 -28.1 47.7 26.7 30 32 A V - 0 0 56 57,-0.1 2,-0.8 -2,-0.1 57,-0.3 -0.989 12.7-160.9-129.7 123.9 -29.2 48.7 30.2 31 33 A L - 0 0 52 -2,-0.4 55,-0.1 55,-0.1 53,-0.0 -0.888 15.2-159.5-102.0 100.9 -28.8 46.4 33.2 32 34 A D S S+ 0 0 55 -2,-0.8 53,-0.5 1,-0.4 -2,-0.0 -0.882 88.4 10.1-126.5 100.0 -31.2 47.7 35.9 33 35 A P S S- 0 0 89 0, 0.0 -1,-0.4 0, 0.0 52,-0.1 0.639 111.4-109.5 -82.0 163.7 -30.1 46.5 38.3 34 36 A P - 0 0 99 0, 0.0 -2,-0.1 0, 0.0 -4,-0.0 -0.028 34.3-113.7 -48.7 153.6 -26.7 45.1 37.1 35 37 A P - 0 0 66 0, 0.0 2,-0.2 0, 0.0 5,-0.1 0.388 33.8-101.5 -70.0-151.3 -26.3 41.3 36.9 36 38 A G - 0 0 43 3,-0.5 0, 0.0 0, 0.0 0, 0.0 -0.473 37.8 -77.5-127.1-164.3 -24.0 39.0 39.0 37 39 A R S S+ 0 0 120 -2,-0.2 3,-0.1 1,-0.1 0, 0.0 0.562 129.1 4.5 -79.8 -10.9 -20.7 37.1 39.1 38 40 A E S > S+ 0 0 84 2,-0.0 2,-2.4 0, 0.0 3,-1.3 0.395 104.2 99.0-142.6 -18.6 -22.1 34.2 37.0 39 41 A E T 3 + 0 0 43 1,-0.2 -3,-0.5 2,-0.1 40,-0.1 -0.343 66.1 78.4 -77.2 59.3 -25.7 35.5 36.1 40 42 A V T 3> S+ 0 0 57 -2,-2.4 4,-1.4 -5,-0.1 5,-0.4 0.383 71.9 73.9-138.1 -15.2 -24.7 36.8 32.6 41 43 A Y T <4 S+ 0 0 85 -3,-1.3 -2,-0.1 1,-0.2 0, 0.0 0.772 117.7 19.3 -76.2 -30.6 -24.6 33.5 30.6 42 44 A P T 4 S+ 0 0 73 0, 0.0 -1,-0.2 0, 0.0 -3,-0.1 0.565 127.7 53.9-105.5 -11.2 -28.4 33.3 30.6 43 45 A L T 4 S+ 0 0 28 2,-0.2 3,-0.2 1,-0.1 -2,-0.2 0.655 115.0 36.5-100.8 -21.8 -29.1 37.0 31.4 44 46 A L S X S+ 0 0 56 -4,-1.4 4,-1.1 1,-0.1 3,-0.4 0.648 120.5 53.4 -88.3 -28.3 -27.0 38.6 28.6 45 47 A A T 4 S+ 0 0 60 -5,-0.4 -2,-0.2 1,-0.2 -1,-0.1 -0.095 103.1 56.3 -98.2 31.2 -28.2 35.6 26.5 46 48 A Q T > S+ 0 0 43 -3,-0.2 4,-0.7 3,-0.0 -1,-0.2 0.364 108.4 44.0-128.7 -9.8 -31.9 36.2 27.3 47 49 A V H > S+ 0 0 22 -3,-0.4 4,-1.0 2,-0.2 -2,-0.2 0.721 104.6 61.3-101.2 -34.6 -32.1 39.9 26.0 48 50 A A H < S+ 0 0 13 -4,-1.1 4,-0.2 1,-0.2 -3,-0.1 0.651 115.0 39.1 -63.7 -15.0 -30.1 39.2 22.8 49 51 A R H >4 S+ 0 0 68 2,-0.1 3,-1.0 7,-0.1 -1,-0.2 0.784 104.6 63.3-101.1 -40.4 -33.0 36.8 22.0 50 52 A R H 3< S+ 0 0 121 -4,-0.7 -2,-0.2 1,-0.2 -3,-0.1 0.651 91.8 71.6 -60.3 -17.6 -36.0 38.9 23.3 51 53 A A T 3< S- 0 0 8 -4,-1.0 21,-1.0 1,-0.1 -1,-0.2 0.885 92.2-150.7 -68.7 -42.7 -35.2 41.5 20.7 52 54 A G X + 0 0 23 -3,-1.0 3,-0.5 -4,-0.2 2,-0.4 -0.246 55.1 58.0 96.0 176.2 -36.3 39.4 17.7 53 55 A G T 3 S- 0 0 21 1,-0.2 -1,-0.1 64,-0.1 64,-0.1 -0.518 122.7 -26.6 69.0-120.3 -35.4 39.1 14.0 54 56 A V T 3 S+ 0 0 7 -2,-0.4 11,-0.9 -3,-0.1 2,-0.5 -0.487 87.0 150.0-125.7 58.3 -31.7 38.3 13.7 55 57 A T E < +S 64 0B 17 -3,-0.5 2,-0.3 9,-0.2 9,-0.2 -0.826 13.5 162.1 -89.7 125.2 -30.4 39.7 17.0 56 58 A V E -S 63 0B 15 7,-3.0 7,-0.8 -2,-0.5 -7,-0.1 -0.967 38.7 -90.0-153.3 133.4 -27.4 37.9 18.4 57 59 A R E -S 62 0B 44 -2,-0.3 5,-0.3 5,-0.2 2,-0.2 0.267 17.8-159.1 -49.6 155.5 -24.7 38.9 21.0 58 60 A M - 0 0 110 3,-2.2 2,-0.2 1,-0.3 4,-0.1 -0.652 58.4 -83.9-133.6 72.2 -21.4 40.7 20.4 59 61 A G S S+ 0 0 60 -2,-0.2 2,-2.4 1,-0.2 -1,-0.3 -0.459 120.5 16.7 61.1-124.4 -19.4 39.8 23.6 60 62 A D S S+ 0 0 107 -2,-0.2 2,-0.3 -3,-0.1 -1,-0.2 -0.496 140.2 5.3 -75.0 74.3 -20.4 42.3 26.3 61 63 A G S S- 0 0 14 -2,-2.4 -3,-2.2 -33,-0.1 2,-0.3 -0.942 88.6 -69.4 143.2-165.1 -23.6 43.3 24.4 62 64 A L E -QS 27 57B 19 -35,-1.2 -35,-1.5 -5,-0.3 2,-0.3 -0.852 24.9-161.8-131.4 158.6 -25.6 42.5 21.3 63 65 A A E -QS 26 56B 15 -7,-0.8 -7,-3.0 -2,-0.3 2,-0.3 -0.933 9.0-176.1-134.6 160.4 -25.6 42.8 17.4 64 66 A S E -QS 25 55B 2 -39,-1.9 -39,-3.3 -2,-0.3 -9,-0.2 -0.988 35.1-155.9-149.5 155.7 -28.2 42.6 14.6 65 67 A W S S+ 0 0 28 -11,-0.9 -10,-0.1 -2,-0.3 -1,-0.1 0.480 83.9 91.3 -96.0 -15.8 -28.6 42.7 10.9 66 68 A S S S- 0 0 25 -12,-0.3 -41,-0.1 -14,-0.2 5,-0.1 -0.589 93.4-102.8 -77.9 137.3 -32.1 44.0 11.7 67 69 A P >> - 0 0 48 0, 0.0 3,-1.6 0, 0.0 4,-0.5 -0.304 30.7-122.7 -51.9 139.8 -32.7 47.8 11.9 68 70 A P T 34 S+ 0 0 41 0, 0.0 20,-0.1 0, 0.0 5,-0.1 0.629 107.7 66.7 -70.7 -10.2 -32.8 48.8 15.6 69 71 A E T 34 S+ 0 0 146 1,-0.2 4,-0.1 3,-0.1 -3,-0.0 0.680 102.4 46.4 -82.3 -20.7 -36.3 50.3 15.1 70 72 A V T <4 S+ 0 0 105 -3,-1.6 -1,-0.2 2,-0.1 2,-0.1 0.448 96.1 97.1 -96.6 -3.2 -37.7 46.9 14.4 71 73 A L S < S- 0 0 24 -4,-0.5 2,-0.9 -5,-0.1 -19,-0.1 -0.499 88.5-116.3 -68.5 150.1 -35.8 45.6 17.5 72 74 A V + 0 0 75 -21,-1.0 3,-0.1 1,-0.2 -2,-0.1 -0.875 42.4 175.8 -87.7 108.3 -37.9 45.5 20.6 73 75 A L + 0 0 28 -2,-0.9 2,-0.6 1,-0.2 15,-0.5 0.890 58.6 44.2 -86.4 -43.7 -35.9 48.1 22.6 74 76 A E B S+T 87 0C 135 13,-0.2 -1,-0.2 14,-0.0 13,-0.2 -0.917 75.3 120.8-115.2 112.2 -37.9 48.4 25.9 75 77 A G - 0 0 24 11,-1.5 2,-0.3 -2,-0.6 -24,-0.0 -0.679 48.8-113.5-145.7-162.0 -39.1 45.3 27.7 76 78 A T + 0 0 101 9,-0.2 2,-0.3 -2,-0.2 9,-0.2 -0.891 36.0 149.0-155.8 119.0 -39.0 43.3 30.9 77 79 A L - 0 0 8 7,-0.4 7,-0.6 -2,-0.3 2,-0.3 -0.917 16.3-165.8-145.3 167.2 -37.6 39.8 31.6 78 80 A A E -U 83 0D 50 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -1.000 23.4-143.0-157.2 148.7 -35.9 37.8 34.5 79 81 A R E > -U 82 0D 40 3,-0.9 3,-0.6 -2,-0.3 2,-0.5 -0.791 68.3 -69.4 -98.5 159.1 -34.0 34.8 35.7 80 82 A M T 3 S+ 0 0 118 -2,-0.3 3,-0.1 1,-0.2 -2,-0.0 -0.304 120.7 20.1 -60.8 103.6 -35.2 33.6 39.1 81 83 A G T 3 S+ 0 0 85 -2,-0.5 2,-0.6 0, 0.0 -1,-0.2 -0.422 115.7 53.9 141.1 -61.5 -34.2 36.2 41.7 82 84 A Q E < -U 79 0D 57 -3,-0.6 2,-1.2 -49,-0.0 -3,-0.9 -0.936 66.9-154.2-109.3 115.3 -33.6 39.5 40.0 83 85 A T E -U 78 0D 85 -2,-0.6 -5,-0.2 -5,-0.2 -3,-0.1 -0.727 24.6-166.2 -90.1 91.0 -36.5 40.7 37.8 84 86 A Y - 0 0 20 -2,-1.2 -7,-0.4 -7,-0.6 2,-0.2 -0.072 18.4-155.6 -74.5 171.8 -34.7 42.9 35.2 85 87 A A - 0 0 49 -53,-0.5 -9,-0.2 -9,-0.2 -53,-0.1 -0.743 18.7-153.9-152.0 100.3 -36.1 45.4 32.7 86 88 A Y - 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