==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 15-MAY-01 1IPI . COMPND 2 MOLECULE: HOLLIDAY JUNCTION RESOLVASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS FURIOSUS; . AUTHOR T.NISHINO,K.KOMORI,Y.ISHINO,K.MORIKAWA . 228 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12148.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 158 69.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 18 7.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 48 21.1 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 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.9 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 . 18 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 15 6.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 53 23.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.8 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 1 0 0 0 0 0 0 0 2 2 0 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 2 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 . 3 0 2 4 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 ANTIPARALLEL BRIDGES PER LADDER . 2 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 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 M 0 0 135 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -15.2 42.2 23.5 -10.0 2 2 A Y - 0 0 159 1,-0.0 2,-0.1 114,-0.0 25,-0.0 -0.780 360.0-129.4 -97.1 136.8 44.4 20.8 -11.6 3 3 A R > - 0 0 46 -2,-0.4 3,-1.0 1,-0.1 2,-0.0 -0.456 20.9-103.4 -87.9 155.7 42.8 18.0 -13.6 4 4 A K T 3 S+ 0 0 207 1,-0.3 -1,-0.1 -2,-0.1 45,-0.0 -0.396 108.8 32.6 -66.4 150.2 43.1 14.3 -13.4 5 5 A G T 3> S+ 0 0 25 1,-0.1 4,-1.7 3,-0.1 -1,-0.3 0.747 70.2 136.5 73.6 20.6 45.4 13.0 -16.1 6 6 A A H <> S+ 0 0 18 -3,-1.0 4,-2.0 1,-0.2 5,-0.2 0.846 74.2 56.7 -66.5 -31.8 47.5 16.1 -16.2 7 7 A Q H > S+ 0 0 136 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.898 106.0 48.0 -64.5 -41.9 50.5 13.7 -16.5 8 8 A A H > S+ 0 0 3 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.856 109.5 54.5 -67.6 -34.5 49.0 12.1 -19.6 9 9 A E H X S+ 0 0 2 -4,-1.7 4,-1.9 2,-0.2 -2,-0.2 0.893 108.0 47.7 -66.0 -41.5 48.4 15.5 -21.1 10 10 A R H X S+ 0 0 131 -4,-2.0 4,-1.6 1,-0.2 -1,-0.2 0.903 111.3 53.3 -65.1 -39.9 52.1 16.5 -20.6 11 11 A E H X S+ 0 0 64 -4,-1.9 4,-1.8 1,-0.2 -2,-0.2 0.896 108.6 47.4 -62.0 -43.5 53.0 13.1 -22.2 12 12 A L H X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.868 105.6 60.5 -68.6 -34.1 50.9 13.7 -25.3 13 13 A I H X S+ 0 0 18 -4,-1.9 4,-2.2 1,-0.2 -1,-0.2 0.903 105.0 48.2 -59.3 -42.1 52.3 17.2 -25.6 14 14 A K H X S+ 0 0 136 -4,-1.6 4,-2.1 2,-0.2 -1,-0.2 0.951 109.6 52.4 -63.6 -48.9 55.8 15.7 -26.0 15 15 A L H X S+ 0 0 44 -4,-1.8 4,-0.7 1,-0.2 -2,-0.2 0.926 111.4 46.7 -51.9 -49.4 54.6 13.2 -28.6 16 16 A L H ><>S+ 0 0 2 -4,-2.5 5,-1.7 1,-0.2 3,-1.3 0.908 108.6 54.5 -60.7 -44.4 53.0 15.9 -30.7 17 17 A E H ><5S+ 0 0 55 -4,-2.2 3,-2.0 1,-0.3 -1,-0.2 0.857 98.4 64.1 -60.0 -33.6 56.1 18.1 -30.5 18 18 A K H 3<5S+ 0 0 176 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.825 103.0 50.6 -59.7 -28.3 58.1 15.2 -31.8 19 19 A H T <<5S- 0 0 73 -3,-1.3 -1,-0.3 -4,-0.7 -2,-0.2 0.263 129.5 -91.3 -94.8 11.6 56.1 15.6 -35.0 20 20 A G T < 5S+ 0 0 34 -3,-2.0 2,-0.2 1,-0.3 -3,-0.2 0.511 79.8 137.6 96.4 4.9 56.5 19.3 -35.5 21 21 A F < - 0 0 4 -5,-1.7 2,-0.4 -8,-0.1 -1,-0.3 -0.602 46.7-143.5 -90.0 146.7 53.5 20.7 -33.6 22 22 A A E -A 37 0A 5 15,-2.9 15,-1.8 -2,-0.2 2,-0.3 -0.884 32.9-176.5-101.0 135.9 53.5 23.6 -31.2 23 23 A V E -A 36 0A 0 -2,-0.4 2,-0.3 13,-0.2 13,-0.2 -0.997 20.4-168.4-143.9 143.4 51.1 22.9 -28.3 24 24 A V E -A 35 0A 3 11,-2.0 11,-1.7 -2,-0.3 2,-0.4 -0.928 18.9-134.4-126.9 153.3 49.6 24.4 -25.2 25 25 A R E -A 34 0A 46 -2,-0.3 117,-2.7 9,-0.2 118,-0.4 -0.891 31.2-113.8-105.4 136.9 47.6 23.0 -22.3 26 26 A S B -F 141 0B 4 7,-2.4 115,-0.2 -2,-0.4 113,-0.0 -0.505 13.7-155.8 -75.6 133.6 44.4 24.8 -21.2 27 27 A A S S+ 0 0 4 113,-3.0 -1,-0.1 -2,-0.2 114,-0.1 0.946 82.5 53.4 -71.3 -50.3 44.3 26.4 -17.7 28 28 A G S S- 0 0 36 112,-0.3 3,-0.2 1,-0.1 4,-0.1 -0.394 78.1-140.5 -79.1 164.8 40.5 26.4 -17.4 29 29 A S S S+ 0 0 68 1,-0.1 -1,-0.1 -2,-0.1 4,-0.1 0.132 82.2 86.5-113.4 20.4 38.7 23.1 -17.9 30 30 A K S S+ 0 0 178 2,-0.1 -1,-0.1 3,-0.0 3,-0.1 0.502 91.0 38.1 -97.1 -6.3 35.7 24.5 -19.9 31 31 A K S S- 0 0 47 1,-0.3 2,-0.3 -3,-0.2 37,-0.1 0.515 113.8 -48.0-106.3-110.8 37.2 24.4 -23.4 32 32 A V - 0 0 0 1,-0.1 -1,-0.3 -4,-0.1 -6,-0.2 -0.882 44.0-123.3-127.0 159.0 39.4 21.6 -24.7 33 33 A D S S+ 0 0 13 12,-1.2 -7,-2.4 -2,-0.3 2,-0.3 0.928 89.9 18.4 -72.6 -45.5 42.5 20.1 -22.9 34 34 A L E -AB 25 45A 1 11,-2.1 11,-3.0 -9,-0.2 2,-0.4 -0.928 57.5-163.7-128.7 151.9 45.1 20.7 -25.7 35 35 A V E +AB 24 44A 1 -11,-1.7 -11,-2.0 -2,-0.3 2,-0.3 -0.985 20.8 178.2-136.0 122.3 45.4 23.0 -28.7 36 36 A A E +AB 23 43A 0 7,-3.1 7,-2.0 -2,-0.4 2,-0.3 -0.847 11.7 175.5-126.5 160.6 48.0 22.2 -31.4 37 37 A G E -AB 22 42A 0 -15,-1.8 -15,-2.9 -2,-0.3 5,-0.2 -0.975 16.9-176.5-161.8 147.5 49.3 23.5 -34.8 38 38 A N - 0 0 40 3,-1.6 150,-0.2 -2,-0.3 149,-0.2 0.276 67.1 -85.6-130.9 8.5 52.1 22.8 -37.2 39 39 A G S S+ 0 0 45 148,-1.5 149,-0.1 2,-0.4 148,-0.1 0.236 123.5 32.5 105.1 -13.6 51.6 25.4 -39.9 40 40 A K S S+ 0 0 142 1,-0.4 2,-0.4 147,-0.1 148,-0.1 0.431 114.7 50.2-144.8 -19.5 49.0 23.6 -42.0 41 41 A K - 0 0 52 146,-0.1 -3,-1.6 2,-0.0 -2,-0.4 -0.976 60.3-163.2-128.9 140.2 47.0 21.5 -39.6 42 42 A Y E -B 37 0A 36 -2,-0.4 33,-3.4 -5,-0.2 2,-0.4 -0.992 6.6-166.3-127.1 130.5 45.3 22.6 -36.3 43 43 A L E -Bc 36 75A 3 -7,-2.0 -7,-3.1 -2,-0.4 2,-0.5 -0.944 13.2-166.8-120.9 136.9 44.1 20.2 -33.6 44 44 A C E -Bc 35 76A 0 31,-2.1 33,-2.6 -2,-0.4 2,-0.4 -0.989 29.0-159.1-117.5 117.7 41.8 20.8 -30.6 45 45 A I E -Bc 34 77A 2 -11,-3.0 -11,-2.1 -2,-0.5 -12,-1.2 -0.864 25.6-160.3-119.1 139.6 42.1 17.8 -28.2 46 46 A E E - c 0 78A 6 31,-2.5 33,-3.0 -2,-0.4 2,-0.4 -0.939 25.3-149.9-108.8 114.6 40.1 16.1 -25.4 47 47 A V E + c 0 79A 14 -2,-0.6 2,-0.3 31,-0.2 33,-0.2 -0.774 18.8 174.3 -97.0 131.3 42.4 13.9 -23.3 48 48 A K E - c 0 80A 38 31,-2.7 33,-2.8 -2,-0.4 2,-0.4 -0.948 12.3-163.6-132.9 150.3 41.2 10.7 -21.5 49 49 A V E + c 0 81A 66 -2,-0.3 2,-0.3 31,-0.2 33,-0.2 -0.999 13.8 171.1-137.0 133.8 42.9 8.0 -19.5 50 50 A T E - c 0 82A 13 31,-2.0 33,-2.3 -2,-0.4 5,-0.1 -0.992 35.3-153.4-145.6 151.2 41.6 4.5 -18.6 51 51 A K S S+ 0 0 173 -2,-0.3 2,-0.1 31,-0.2 -1,-0.1 0.462 81.0 82.4 -96.2 -7.0 42.7 1.2 -17.1 52 52 A K S S- 0 0 132 2,-0.2 31,-0.1 1,-0.1 -2,-0.1 -0.282 88.3-117.4 -89.5 178.9 40.0 -0.6 -19.0 53 53 A D S S+ 0 0 112 -2,-0.1 2,-0.3 29,-0.1 29,-0.1 0.188 96.9 33.3-102.2 14.1 40.0 -1.9 -22.6 54 54 A H - 0 0 79 48,-0.1 2,-0.3 49,-0.1 48,-0.2 -0.974 65.1-156.7-162.0 154.0 37.1 0.4 -23.5 55 55 A L E -G 101 0C 36 46,-1.7 46,-3.0 -2,-0.3 2,-0.4 -0.945 13.7-139.8-146.9 123.9 35.7 3.9 -22.6 56 56 A Y E -G 100 0C 132 -2,-0.3 2,-0.5 44,-0.3 44,-0.2 -0.627 21.0-158.8 -77.1 130.3 32.3 5.4 -22.8 57 57 A V E -G 99 0C 1 42,-2.8 42,-1.5 -2,-0.4 -2,-0.0 -0.972 15.8-131.0-116.8 122.3 32.5 9.0 -24.0 58 58 A G > - 0 0 15 -2,-0.5 4,-1.8 40,-0.2 5,-0.2 -0.169 13.9-117.3 -76.1 163.7 29.5 11.3 -23.2 59 59 A K H > S+ 0 0 101 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.859 109.8 57.3 -61.3 -41.9 27.4 13.7 -25.2 60 60 A R H > S+ 0 0 216 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.928 108.8 43.3 -59.2 -51.5 28.4 16.7 -23.1 61 61 A D H > S+ 0 0 46 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.938 115.6 47.7 -62.7 -48.1 32.1 16.4 -23.6 62 62 A M H X S+ 0 0 0 -4,-1.8 4,-3.0 35,-0.3 5,-0.2 0.885 111.7 50.1 -62.3 -38.6 31.9 15.7 -27.4 63 63 A G H X S+ 0 0 39 -4,-2.4 4,-2.2 34,-0.2 -1,-0.2 0.895 112.1 48.4 -66.1 -38.5 29.4 18.6 -27.9 64 64 A R H X S+ 0 0 65 -4,-1.9 4,-2.2 -5,-0.2 5,-0.2 0.938 114.0 47.3 -64.5 -47.0 31.9 20.9 -26.0 65 65 A L H X S+ 0 0 0 -4,-2.9 4,-2.4 1,-0.2 5,-0.2 0.955 113.4 46.0 -58.9 -56.0 34.8 19.6 -28.1 66 66 A I H X S+ 0 0 34 -4,-3.0 4,-2.1 1,-0.2 -1,-0.2 0.900 113.2 49.4 -56.9 -45.8 33.0 19.9 -31.5 67 67 A E H X S+ 0 0 78 -4,-2.2 4,-2.1 -5,-0.2 5,-0.2 0.936 112.8 45.3 -62.4 -47.8 31.7 23.4 -30.8 68 68 A F H X S+ 0 0 16 -4,-2.2 4,-2.8 1,-0.2 5,-0.2 0.910 113.6 50.3 -63.2 -41.3 35.0 24.8 -29.7 69 69 A S H X>S+ 0 0 1 -4,-2.4 4,-2.5 -5,-0.2 5,-2.1 0.871 108.4 53.5 -64.2 -37.4 36.8 23.2 -32.6 70 70 A R H <5S+ 0 0 143 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.943 113.8 40.7 -64.0 -47.9 34.3 24.6 -35.0 71 71 A R H <5S+ 0 0 88 -4,-2.1 66,-0.2 1,-0.2 -2,-0.2 0.931 118.2 46.8 -67.2 -44.6 34.8 28.2 -33.8 72 72 A F H <5S- 0 0 0 -4,-2.8 82,-1.6 -5,-0.2 -2,-0.2 0.847 108.9-122.7 -66.9 -33.8 38.5 27.9 -33.4 73 73 A G T <5 + 0 0 22 -4,-2.5 2,-0.3 1,-0.3 -3,-0.2 0.909 66.5 120.9 88.8 51.2 39.0 26.3 -36.9 74 74 A G S > -cD 50 86A 0 4,-2.8 4,-2.8 -2,-0.9 3,-1.3 -0.824 23.4-127.2 -91.8 108.9 44.6 2.9 -22.8 83 83 A L T 34 S+ 0 0 67 -33,-2.3 -34,-0.0 -2,-0.9 -1,-0.0 -0.257 92.0 22.2 -56.5 140.9 47.0 1.7 -20.1 84 84 A N T 34 S+ 0 0 170 1,-0.1 -1,-0.3 -31,-0.0 -33,-0.0 0.681 131.0 44.4 74.2 19.6 48.9 -1.5 -21.2 85 85 A V T <4 S- 0 0 69 -3,-1.3 2,-0.2 18,-0.0 -2,-0.2 0.371 99.8-124.2-158.2 -32.4 48.3 -0.8 -24.9 86 86 A G E < -D 82 0A 28 -4,-2.8 -4,-2.8 2,-0.0 2,-0.2 -0.638 42.5 -24.3 115.4-172.4 49.0 2.9 -25.7 87 87 A W E -D 81 0A 23 -6,-0.2 2,-0.3 -2,-0.2 -6,-0.2 -0.560 48.3-174.7 -84.3 145.8 47.4 6.0 -27.2 88 88 A R E -D 80 0A 66 -8,-1.6 -8,-2.4 -2,-0.2 2,-0.3 -0.990 4.5-163.8-140.9 144.5 44.6 5.9 -29.7 89 89 A F E -DE 79 107A 4 18,-2.5 18,-3.4 -2,-0.3 2,-0.3 -0.921 10.9-177.7-132.9 156.7 43.0 8.8 -31.6 90 90 A I E -D 78 0A 50 -12,-1.3 -12,-2.0 -2,-0.3 2,-0.7 -0.948 28.1-130.2-154.0 128.2 39.9 9.5 -33.6 91 91 A E E -D 77 0A 113 -2,-0.3 2,-0.4 -14,-0.2 -14,-0.2 -0.720 36.7-134.6 -76.8 119.2 38.8 12.7 -35.5 92 92 A V - 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