==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 30-DEC-99 1DQ3 . COMPND 2 MOLECULE: ENDONUCLEASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS FURIOSUS; . AUTHOR K.ICHIYANAGI,Y.ISHINO,K.MORIKAWA . 454 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21484.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 341 75.1 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 . 130 28.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 1.3 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 . 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 . 45 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 37 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 118 26.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.3 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 2 0 0 0 1 1 1 1 4 0 0 3 0 0 0 0 0 0 0 0 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 . 5 7 1 5 5 3 1 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 1 2 0 0 0 0 1 0 1 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 C 0 0 6 0, 0.0 95,-0.9 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 143.5 27.4 18.4 57.2 2 2 A I E -AB 95 432A 2 430,-2.8 430,-2.7 93,-0.2 93,-0.2 -0.876 360.0 -72.3-130.8 163.3 27.4 20.5 54.0 3 3 A D E > - B 0 431A 10 91,-2.1 3,-1.8 -2,-0.3 18,-0.3 -0.151 39.5-123.3 -55.3 141.2 25.9 23.7 52.7 4 4 A G T 3 S+ 0 0 0 426,-1.1 18,-1.9 1,-0.3 17,-0.6 0.636 104.9 67.0 -61.2 -16.9 22.2 23.8 51.9 5 5 A K T 3 S+ 0 0 102 15,-0.2 -1,-0.3 16,-0.2 2,-0.1 0.566 72.7 113.0 -83.6 -7.2 22.7 24.8 48.3 6 6 A A < - 0 0 7 -3,-1.8 15,-1.7 88,-0.1 440,-0.2 -0.403 68.8-125.1 -65.1 139.8 24.4 21.5 47.4 7 7 A K E -IJ 20 445B 22 438,-2.6 438,-1.9 441,-0.3 2,-0.3 -0.576 29.8-175.1 -86.5 150.1 22.2 19.4 45.0 8 8 A I E -IJ 19 444B 0 11,-2.8 11,-1.9 -2,-0.2 2,-0.5 -0.999 18.2-145.2-147.8 144.4 21.2 15.9 45.8 9 9 A I E +I 18 0B 9 434,-0.6 45,-0.5 -2,-0.3 2,-0.3 -0.930 30.6 157.7-110.8 131.6 19.4 13.0 44.0 10 10 A F E -IK 17 53B 4 7,-1.9 7,-2.6 -2,-0.5 2,-0.3 -0.963 23.1-143.2-147.0 163.0 17.2 10.7 46.0 11 11 A E E -IK 16 52B 33 41,-2.2 41,-2.2 -2,-0.3 5,-0.2 -0.898 12.9-179.0-131.2 161.9 14.3 8.3 45.6 12 12 A N S S+ 0 0 28 3,-1.8 2,-1.2 -2,-0.3 -1,-0.1 0.453 84.2 0.7-116.2-101.6 11.1 7.2 47.3 13 13 A E S S- 0 0 170 1,-0.1 3,-0.1 2,-0.1 38,-0.1 -0.433 129.9 -60.6 -92.2 58.8 8.9 4.5 45.7 14 14 A G S S+ 0 0 48 -2,-1.2 2,-0.7 1,-0.3 -1,-0.1 0.354 112.5 128.3 79.5 -6.6 11.2 4.2 42.7 15 15 A E - 0 0 72 219,-0.1 -3,-1.8 220,-0.1 -1,-0.3 -0.739 49.0-151.1 -86.8 114.0 10.4 7.8 42.3 16 16 A E E -I 11 0B 11 -2,-0.7 2,-0.3 217,-0.6 -5,-0.2 -0.537 12.3-171.4 -88.5 154.1 13.5 10.0 41.9 17 17 A H E -I 10 0B 26 -7,-2.6 -7,-1.9 -2,-0.2 2,-0.4 -0.948 13.5-157.5-139.2 156.4 13.9 13.7 42.9 18 18 A L E +I 9 0B 18 -2,-0.3 2,-0.3 -9,-0.2 -9,-0.2 -0.942 37.7 130.4-139.2 109.9 16.6 16.2 42.4 19 19 A T E -I 8 0B 28 -11,-1.9 -11,-2.8 -2,-0.4 2,-0.1 -0.870 56.1 -87.1-147.9 178.0 16.6 19.2 44.8 20 20 A T E > -I 7 0B 16 -2,-0.3 4,-1.5 -13,-0.2 -13,-0.2 -0.415 43.9-105.8 -86.3 170.7 19.0 21.1 47.1 21 21 A M H > S+ 0 0 3 -15,-1.7 4,-1.7 -17,-0.6 -16,-0.2 0.888 120.0 54.4 -64.6 -38.2 19.7 19.9 50.6 22 22 A E H >> S+ 0 0 81 -18,-1.9 4,-2.7 1,-0.2 3,-0.6 0.972 108.4 47.4 -57.9 -56.8 17.5 22.8 52.0 23 23 A E H 3> S+ 0 0 107 -19,-0.3 4,-1.8 1,-0.3 -1,-0.2 0.788 107.4 57.3 -56.0 -32.1 14.5 21.8 49.9 24 24 A M H 3X S+ 0 0 1 -4,-1.5 4,-0.7 2,-0.2 -1,-0.3 0.893 109.8 44.5 -68.3 -38.0 14.9 18.2 51.0 25 25 A Y H XX S+ 0 0 0 -4,-1.7 3,-1.3 -3,-0.6 4,-0.7 0.965 113.5 49.8 -68.0 -51.4 14.7 19.2 54.6 26 26 A E H 3< S+ 0 0 98 -4,-2.7 3,-0.4 1,-0.3 4,-0.4 0.791 104.5 61.6 -55.8 -31.6 11.7 21.5 53.9 27 27 A R H 3< S+ 0 0 109 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.740 114.6 30.1 -70.4 -26.4 10.0 18.7 52.0 28 28 A Y H X< S+ 0 0 14 -3,-1.3 3,-1.5 -4,-0.7 -1,-0.2 0.284 86.3 105.9-116.9 10.2 9.8 16.4 55.0 29 29 A K G >< + 0 0 61 -4,-0.7 3,-2.6 -3,-0.4 -2,-0.1 0.848 69.4 69.5 -57.3 -37.0 9.5 18.9 57.8 30 30 A H G 3 S+ 0 0 145 -4,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.759 82.8 71.4 -54.9 -28.0 5.8 18.1 58.2 31 31 A L G < S- 0 0 80 -3,-1.5 -1,-0.3 1,-0.1 -2,-0.2 0.547 121.1 -99.2 -66.7 -3.9 6.8 14.8 59.6 32 32 A G < - 0 0 43 -3,-2.6 13,-0.5 -4,-0.1 2,-0.4 0.515 31.6-127.5 90.7 125.4 7.9 16.8 62.6 33 33 A E E -C 44 0A 65 11,-0.1 2,-0.3 -4,-0.1 11,-0.2 -0.878 17.9-152.9-108.8 137.6 11.4 17.9 63.5 34 34 A F E -C 43 0A 85 9,-1.5 9,-3.1 -2,-0.4 2,-0.5 -0.790 13.3-127.4-107.9 151.5 13.0 17.3 66.9 35 35 A Y E -C 42 0A 87 -2,-0.3 2,-1.3 7,-0.2 7,-0.2 -0.866 7.9-150.0-102.5 124.5 15.7 19.4 68.6 36 36 A D E >> -C 41 0A 33 5,-3.2 5,-1.2 -2,-0.5 4,-0.8 -0.747 13.5-171.3 -92.1 89.3 18.9 17.6 69.8 37 37 A E T >45S+ 0 0 160 -2,-1.3 3,-0.5 1,-0.2 -1,-0.2 0.835 80.3 55.8 -50.7 -40.0 19.7 19.8 72.7 38 38 A E T 345S+ 0 0 170 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.1 0.908 120.1 28.4 -61.8 -44.8 23.1 18.1 73.3 39 39 A Y T 345S- 0 0 148 -3,-0.5 -1,-0.2 2,-0.2 -2,-0.2 0.241 101.6-126.9-103.1 13.0 24.4 18.7 69.7 40 40 A N T <<5 + 0 0 89 -4,-0.8 35,-0.5 -3,-0.5 2,-0.3 0.871 66.7 125.9 42.9 49.8 22.4 21.9 69.0 41 41 A R E < -C 36 0A 47 -5,-1.2 -5,-3.2 33,-0.1 2,-0.4 -0.965 57.0-129.8-136.0 152.7 20.9 20.4 65.8 42 42 A W E -CD 35 73A 99 31,-2.4 31,-2.5 -2,-0.3 2,-0.3 -0.829 30.9-175.4-101.4 139.2 17.5 19.9 64.4 43 43 A G E -CD 34 72A 0 -9,-3.1 -9,-1.5 -2,-0.4 2,-0.3 -0.791 21.2-155.4-130.0 173.5 16.5 16.5 63.0 44 44 A I E -CD 33 71A 0 27,-0.7 27,-1.9 -2,-0.3 2,-0.7 -0.935 20.3-136.0-149.6 120.2 13.7 14.7 61.2 45 45 A D E + D 0 70A 74 -13,-0.5 25,-0.2 -2,-0.3 3,-0.1 -0.726 34.5 158.9 -84.0 116.2 13.2 10.9 61.5 46 46 A V > + 0 0 0 23,-2.1 3,-0.6 -2,-0.7 5,-0.3 0.089 35.9 116.8-120.8 17.9 12.5 9.5 58.0 47 47 A S T 3 S+ 0 0 36 22,-1.0 -1,-0.1 1,-0.3 4,-0.1 0.822 82.6 44.4 -56.3 -33.5 13.5 5.9 58.9 48 48 A N T 3 S+ 0 0 145 21,-0.2 -1,-0.3 -3,-0.1 -2,-0.1 0.672 100.7 78.1 -85.5 -18.8 9.9 4.8 58.2 49 49 A V S < S- 0 0 35 -3,-0.6 2,-1.0 20,-0.1 19,-0.1 -0.823 93.2-122.7 -90.6 115.8 9.8 6.9 55.0 50 50 A P + 0 0 57 0, 0.0 2,-0.5 0, 0.0 -3,-0.1 -0.430 46.7 162.8 -63.6 100.5 11.6 5.0 52.4 51 51 A I - 0 0 0 -2,-1.0 17,-2.6 17,-0.4 2,-0.4 -0.988 12.9-174.8-122.9 126.1 14.3 7.5 51.3 52 52 A Y E -KL 11 67B 73 -41,-2.2 -41,-2.2 -2,-0.5 2,-0.2 -0.949 5.7-176.8-125.2 143.3 17.3 6.3 49.3 53 53 A V E -KL 10 66B 5 13,-2.5 13,-3.1 -2,-0.4 2,-0.6 -0.742 40.0 -89.8-125.3 173.0 20.4 8.1 48.1 54 54 A K E - L 0 65B 32 -45,-0.5 389,-1.5 389,-0.3 2,-0.3 -0.795 51.0-176.4 -88.6 123.4 23.4 7.1 46.1 55 55 A S E - L 0 64B 0 9,-3.4 9,-3.3 -2,-0.6 2,-0.5 -0.898 22.7-130.3-122.2 152.4 26.1 5.7 48.4 56 56 A F E - L 0 63B 0 -2,-0.3 7,-0.2 7,-0.2 3,-0.1 -0.854 12.2-149.8-102.3 131.6 29.7 4.5 47.8 57 57 A D E >> - L 0 62B 24 5,-2.8 4,-2.4 -2,-0.5 5,-0.9 -0.848 6.0-167.6-103.2 100.7 30.7 1.1 49.3 58 58 A P T 45S+ 0 0 42 0, 0.0 -1,-0.2 0, 0.0 52,-0.1 0.787 85.1 57.8 -54.3 -30.8 34.5 1.3 50.1 59 59 A E T 45S+ 0 0 170 1,-0.2 -2,-0.0 -3,-0.1 -3,-0.0 0.998 121.1 19.8 -65.3 -69.1 34.5 -2.5 50.5 60 60 A S T 45S- 0 0 30 2,-0.1 -1,-0.2 1,-0.0 3,-0.1 0.589 101.6-130.7 -79.4 -10.7 33.2 -3.7 47.2 61 61 A K T <5 + 0 0 79 -4,-2.4 2,-0.3 1,-0.2 351,-0.1 0.897 65.7 112.6 63.3 42.9 34.1 -0.4 45.6 62 62 A R E - 0 0 26 -2,-0.5 3,-2.6 351,-0.1 350,-0.1 -0.422 45.9 -70.2-109.5-172.8 28.8 30.0 63.6 78 78 A K T 3 S+ 0 0 152 1,-0.3 349,-0.1 -2,-0.1 -2,-0.0 0.505 115.8 79.1 -58.2 -5.3 32.1 31.9 63.7 79 79 A D T 3 S+ 0 0 145 1,-0.1 2,-0.4 347,-0.1 -1,-0.3 0.661 96.6 50.8 -77.5 -13.1 33.4 29.4 66.4 80 80 A V S < S- 0 0 25 -3,-2.6 2,-0.5 346,-0.1 -1,-0.1 -0.981 81.1-134.3-128.1 134.0 34.0 27.0 63.5 81 81 A T - 0 0 61 -2,-0.4 2,-0.3 343,-0.0 345,-0.2 -0.743 21.5-141.5 -88.4 123.1 35.9 27.6 60.3 82 82 A K E -F 425 0A 0 343,-2.9 343,-0.9 -2,-0.5 2,-0.6 -0.649 9.3-141.1 -83.7 141.3 34.1 26.2 57.1 83 83 A Y E -FG 424 95A 50 12,-2.1 12,-2.4 -2,-0.3 2,-0.6 -0.897 8.1-159.3-108.1 118.1 36.2 24.6 54.3 84 84 A E E -FG 423 94A 59 339,-2.9 339,-2.1 -2,-0.6 2,-0.5 -0.840 11.6-166.6 -95.8 124.2 35.3 25.3 50.7 85 85 A I E -FG 422 93A 2 8,-2.7 8,-2.4 -2,-0.6 2,-0.4 -0.952 7.0-175.7-117.9 126.3 36.6 22.6 48.3 86 86 A I E -FG 421 92A 32 335,-2.6 334,-3.1 -2,-0.5 335,-2.0 -0.975 10.7-153.0-120.9 130.3 36.8 23.0 44.5 87 87 A T E > -F 419 0A 3 4,-2.0 3,-1.4 -2,-0.4 332,-0.2 -0.400 35.2 -99.0 -94.8 175.8 37.9 20.3 42.1 88 88 A N T 3 S+ 0 0 57 330,-1.9 331,-0.1 1,-0.3 -1,-0.1 0.830 123.8 58.3 -59.9 -34.0 39.5 20.5 38.6 89 89 A K T 3 S- 0 0 5 329,-0.2 -1,-0.3 1,-0.1 3,-0.1 0.596 122.0-106.8 -72.4 -15.2 36.0 19.8 37.2 90 90 A G < + 0 0 16 -3,-1.4 -2,-0.1 1,-0.3 358,-0.1 0.317 66.3 155.7 102.0 -6.4 34.6 22.9 38.9 91 91 A T - 0 0 0 -5,-0.1 -4,-2.0 358,-0.1 2,-0.4 -0.294 28.9-151.6 -56.8 132.1 32.7 20.8 41.5 92 92 A K E +HG 446 86A 57 354,-3.3 354,-2.2 -6,-0.2 2,-0.4 -0.923 19.2 175.3-116.1 132.9 32.1 22.8 44.7 93 93 A I E - G 0 85A 5 -8,-2.4 -8,-2.7 -2,-0.4 2,-0.6 -0.925 8.1-170.2-137.4 108.8 31.7 21.4 48.3 94 94 A L E + G 0 84A 11 -2,-0.4 -91,-2.1 -10,-0.2 -10,-0.2 -0.896 31.8 144.2-100.3 119.5 31.3 23.7 51.3 95 95 A T E -AG 2 83A 0 -12,-2.4 -12,-2.1 -2,-0.6 -93,-0.2 -0.721 47.1 -76.6-141.6-171.6 31.6 21.7 54.5 96 96 A S > - 0 0 0 -95,-0.9 3,-0.9 -14,-0.2 19,-0.4 -0.578 43.8-108.9 -93.3 158.2 32.8 21.5 58.1 97 97 A P T 3 S+ 0 0 11 0, 0.0 19,-1.8 0, 0.0 20,-0.2 0.783 117.0 43.1 -55.1 -36.5 36.5 21.0 59.2 98 98 A W T 3 S+ 0 0 112 16,-0.2 19,-0.0 17,-0.2 0, 0.0 0.583 81.9 119.2 -90.7 -10.9 35.9 17.5 60.5 99 99 A H < - 0 0 0 -3,-0.9 16,-2.0 -98,-0.1 2,-0.2 -0.383 58.0-142.1 -59.4 118.6 33.8 16.3 57.5 100 100 A P E -M 114 0B 21 0, 0.0 353,-1.7 0, 0.0 2,-0.3 -0.577 13.8-161.0 -89.2 148.6 35.7 13.4 55.9 101 101 A F E -MN 113 452B 1 12,-2.9 12,-1.9 -2,-0.2 2,-0.6 -0.853 28.9-105.4-121.1 157.6 36.0 12.6 52.2 102 102 A F E -M 112 0B 3 349,-0.7 23,-2.1 -2,-0.3 2,-0.4 -0.743 42.0-170.0 -84.9 123.3 36.9 9.4 50.4 103 103 A V E -MO 111 124B 5 8,-3.1 8,-2.4 -2,-0.6 2,-0.6 -0.936 18.4-143.2-118.7 137.0 40.5 9.8 49.0 104 104 A L E -MO 110 123B 5 19,-2.1 19,-0.5 -2,-0.4 6,-0.2 -0.897 23.6-149.2 -98.3 121.1 42.3 7.5 46.6 105 105 A T > - 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