==== 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 HYDROLASE 22-AUG-02 1MI8 . COMPND 2 MOLECULE: DNAB INTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: SYNECHOCYSTIS SP.; . AUTHOR Y.DING,X.CHEN,S.FERRANDON,M.XU,Z.RAO . 141 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7006.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 95 67.4 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 . 64 45.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 1.4 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 . 10 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 4 2.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.7 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 0 0 0 0 0 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 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 1 0 4 1 1 0 0 0 0 0 0 0 1 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 1 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 -2 A S 0 0 72 0, 0.0 73,-0.1 0, 0.0 140,-0.1 0.000 360.0 360.0 360.0 -9.1 3.0 12.3 27.2 2 -1 A G - 0 0 10 138,-0.2 2,-0.2 72,-0.1 140,-0.1 0.002 360.0-167.8 -82.0-153.6 5.8 11.6 24.7 3 1 A A - 0 0 2 69,-0.2 69,-2.8 138,-0.1 2,-0.3 -0.779 6.7-148.6 173.5 150.9 9.4 12.6 24.9 4 2 A I E -AB 71 121A 0 117,-3.1 117,-3.2 67,-0.2 67,-0.3 -0.828 37.0 -77.3-127.7 165.4 12.5 12.7 22.7 5 3 A S E > - B 0 120A 0 65,-2.1 3,-2.0 -2,-0.3 16,-0.3 -0.266 37.5-122.6 -60.5 145.4 16.2 12.3 23.1 6 4 A G T 3 S+ 0 0 4 113,-1.0 16,-1.9 1,-0.3 17,-0.4 0.693 109.2 70.3 -61.3 -18.6 18.1 15.3 24.6 7 5 A D T 3 S+ 0 0 102 13,-0.2 -1,-0.3 14,-0.1 -2,-0.1 0.678 71.9 116.8 -70.6 -23.5 20.2 15.3 21.4 8 6 A S < - 0 0 1 -3,-2.0 13,-2.3 62,-0.2 2,-0.7 -0.227 66.5-129.8 -54.4 130.7 17.2 16.4 19.3 9 7 A L E -E 20 0B 75 11,-0.2 125,-2.7 12,-0.1 126,-0.5 -0.750 16.2-147.4 -90.8 117.3 17.8 19.8 17.8 10 8 A I E -EF 19 133B 0 9,-2.5 9,-1.4 -2,-0.7 2,-0.5 -0.701 13.2-129.9 -87.5 126.4 15.1 22.4 18.3 11 9 A S E -E 18 0B 7 121,-1.6 2,-0.7 -2,-0.5 22,-0.6 -0.642 16.9-146.9 -78.1 121.4 14.5 24.9 15.5 12 10 A L E >>> -EG 17 32B 24 5,-3.3 4,-3.1 -2,-0.5 3,-1.1 -0.820 4.1-154.9 -94.0 113.3 14.3 28.4 16.9 13 11 A A T 345S+ 0 0 18 18,-1.2 19,-0.1 -2,-0.7 -1,-0.1 0.819 86.9 55.2 -59.5 -37.8 11.9 30.5 14.9 14 12 A S T 345S+ 0 0 98 17,-0.4 -1,-0.2 1,-0.1 18,-0.1 0.754 126.7 15.3 -74.7 -12.6 13.3 33.9 15.5 15 13 A T T <45S- 0 0 87 -3,-1.1 -2,-0.2 2,-0.2 -1,-0.1 0.715 88.3-119.8-127.5 -36.0 16.8 33.0 14.3 16 14 A G T <5 + 0 0 44 -4,-3.1 2,-0.2 1,-0.4 -3,-0.1 0.560 69.8 135.3 98.2 7.8 17.0 29.8 12.3 17 15 A K E < -E 12 0B 140 -5,-0.6 -5,-3.3 -6,-0.0 -1,-0.4 -0.558 44.4-147.6 -87.8 163.8 19.4 28.5 14.9 18 16 A R E +E 11 0B 117 -7,-0.2 2,-0.4 -2,-0.2 -7,-0.2 -0.994 17.8 173.6-130.7 132.0 19.1 25.0 16.4 19 17 A V E -E 10 0B 41 -9,-1.4 -9,-2.5 -2,-0.4 5,-0.1 -0.994 41.0 -97.2-138.8 143.2 20.1 24.0 19.9 20 18 A S E -E 9 0B 15 -2,-0.4 4,-0.4 -11,-0.3 -11,-0.2 -0.225 28.1-124.4 -55.6 148.9 19.5 20.6 21.5 21 19 A I S > S+ 0 0 0 -13,-2.3 3,-1.2 -16,-0.3 4,-0.3 0.850 114.2 59.3 -64.3 -34.2 16.4 20.4 23.6 22 20 A K G > S+ 0 0 112 -16,-1.9 3,-1.8 1,-0.3 4,-0.2 0.950 103.9 51.2 -56.2 -46.8 18.7 19.2 26.5 23 21 A D G 3 S+ 0 0 111 -17,-0.4 -1,-0.3 1,-0.3 -2,-0.2 0.588 107.2 55.2 -67.7 -8.8 20.5 22.6 26.1 24 22 A L G X S+ 0 0 11 -3,-1.2 3,-1.2 -4,-0.4 -1,-0.3 0.362 72.6 108.3-105.0 8.0 17.2 24.3 26.3 25 23 A L T < S+ 0 0 57 -3,-1.8 2,-0.5 1,-0.3 25,-0.5 0.871 82.6 43.5 -51.5 -44.1 16.1 22.9 29.7 26 24 A D T 3 S+ 0 0 147 -4,-0.2 2,-0.3 -3,-0.2 -1,-0.3 -0.316 101.5 92.4-100.2 52.4 16.6 26.1 31.6 27 25 A E < + 0 0 102 -3,-1.2 23,-0.5 -2,-0.5 2,-0.3 -0.984 46.8 173.3-142.1 150.0 15.0 28.3 29.0 28 26 A K + 0 0 140 -2,-0.3 20,-0.2 21,-0.1 21,-0.1 -0.994 50.2 32.9-156.4 159.7 11.5 29.6 28.3 29 27 A D S S+ 0 0 95 18,-2.3 2,-0.3 -2,-0.3 19,-0.1 0.887 74.7 132.3 62.8 44.8 9.3 31.8 26.2 30 28 A F - 0 0 29 17,-0.4 17,-2.1 -3,-0.1 2,-0.3 -0.868 58.4-106.5-118.4 153.6 11.2 31.5 23.0 31 29 A E E + H 0 46B 54 -2,-0.3 -18,-1.2 15,-0.2 -17,-0.4 -0.612 34.8 179.4 -88.3 145.1 9.6 30.8 19.8 32 30 A I E -GH 12 45B 0 13,-3.4 13,-2.2 -2,-0.3 2,-0.5 -0.667 36.8 -94.5-124.0 178.6 9.7 27.5 18.0 33 31 A W E + H 0 44B 92 -22,-0.6 99,-1.2 -2,-0.2 2,-0.3 -0.905 46.5 172.6-100.5 126.1 8.1 26.4 14.7 34 32 A A E - H 0 43B 0 9,-2.2 9,-3.0 -2,-0.5 2,-0.4 -0.917 30.1-123.1-127.7 155.7 4.7 24.6 15.0 35 33 A I E - H 0 42B 0 -2,-0.3 2,-0.8 7,-0.2 7,-0.2 -0.817 16.8-137.8 -97.9 141.2 2.2 23.5 12.4 36 34 A N E >> - H 0 41B 36 5,-2.7 4,-3.2 -2,-0.4 5,-0.7 -0.887 16.8-157.7 -96.3 107.2 -1.4 24.9 12.7 37 35 A E T 45S+ 0 0 87 -2,-0.8 -1,-0.1 1,-0.2 5,-0.0 0.795 86.6 55.1 -61.0 -32.0 -3.4 21.7 11.9 38 36 A Q T 45S+ 0 0 191 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.0 0.937 125.0 23.4 -66.1 -45.4 -6.6 23.4 10.9 39 37 A T T 45S- 0 0 74 -3,-0.2 -2,-0.2 2,-0.2 -1,-0.2 0.616 93.8-135.8 -93.7 -16.3 -4.7 25.5 8.2 40 38 A M T <5 + 0 0 65 -4,-3.2 63,-0.3 1,-0.2 2,-0.3 0.740 62.7 129.0 62.7 24.1 -1.7 23.2 7.7 41 39 A K E < -H 36 0B 107 -5,-0.7 -5,-2.7 62,-0.1 2,-0.3 -0.799 61.4-118.2-108.0 148.9 0.5 26.2 7.7 42 40 A L E +H 35 0B 37 -2,-0.3 2,-0.4 -7,-0.2 -7,-0.2 -0.632 36.7 178.5 -83.5 144.0 3.7 26.6 9.9 43 41 A E E -H 34 0B 77 -9,-3.0 -9,-2.2 -2,-0.3 -11,-0.1 -0.999 34.1-103.7-146.2 147.0 3.6 29.4 12.4 44 42 A S E -H 33 0B 50 -2,-0.4 2,-0.3 -11,-0.2 -11,-0.2 -0.389 45.4-179.5 -62.1 142.3 5.9 30.7 15.1 45 43 A A E -H 32 0B 10 -13,-2.2 -13,-3.4 -2,-0.1 2,-0.2 -0.994 26.4-109.3-150.4 146.2 4.8 29.7 18.6 46 44 A K E -H 31 0B 114 -2,-0.3 2,-0.6 -15,-0.2 -15,-0.2 -0.491 20.8-137.1 -78.3 141.9 6.0 30.2 22.1 47 45 A V - 0 0 0 -17,-2.1 -18,-2.3 -2,-0.2 -17,-0.4 -0.847 11.8-165.5 -96.2 125.0 7.5 27.5 24.3 48 46 A S - 0 0 38 76,-2.5 2,-0.3 -2,-0.6 -1,-0.2 0.944 65.4 -19.8 -76.8 -49.8 6.1 27.7 27.8 49 47 A R E -C 124 0A 139 75,-0.6 75,-2.2 -21,-0.1 2,-0.4 -0.988 51.2-140.9-159.2 155.1 8.7 25.4 29.4 50 48 A V E +C 123 0A 9 -23,-0.5 2,-0.3 -25,-0.5 73,-0.2 -0.923 30.1 164.8-116.4 142.0 11.3 22.6 28.7 51 49 A F E -C 122 0A 27 71,-2.0 71,-2.2 -2,-0.4 2,-0.3 -0.996 35.9-121.0-158.8 151.6 11.8 19.6 31.0 52 50 A M E -C 121 0A 81 -2,-0.3 69,-0.3 69,-0.2 3,-0.1 -0.719 15.4-163.9 -87.3 142.5 13.3 16.1 31.3 53 51 A T E - 0 0 54 67,-3.5 2,-0.3 1,-0.5 68,-0.1 0.235 48.2 -97.6-112.0 12.1 10.9 13.3 32.0 54 52 A G E -C 120 0A 21 66,-0.7 66,-3.0 2,-0.1 2,-0.5 -0.739 61.2 -32.0 112.4-163.5 13.5 10.8 33.1 55 53 A K E +C 119 0A 140 -2,-0.3 2,-0.3 64,-0.3 64,-0.3 -0.863 65.2 165.7-101.3 127.8 15.2 7.9 31.4 56 54 A K E -C 118 0A 90 62,-3.7 62,-1.9 -2,-0.5 2,-0.1 -0.993 43.1 -95.7-145.0 152.5 13.3 6.0 28.8 57 55 A L E -C 117 0A 60 -2,-0.3 16,-0.5 60,-0.3 2,-0.3 -0.392 47.6-156.5 -62.3 135.5 13.8 3.5 26.0 58 56 A V E -C 116 0A 0 58,-3.4 57,-2.9 14,-0.2 58,-1.2 -0.826 9.9-153.5-121.8 157.4 14.2 5.4 22.8 59 57 A Y E -CD 114 71A 51 12,-2.2 12,-2.5 -2,-0.3 2,-0.5 -0.987 16.9-127.7-133.3 136.8 13.7 4.5 19.1 60 58 A I E -CD 113 70A 52 53,-2.9 53,-2.1 -2,-0.4 2,-0.5 -0.729 22.8-169.6 -85.3 121.4 15.3 5.9 15.9 61 59 A L E -CD 112 69A 0 8,-3.0 8,-2.0 -2,-0.5 2,-0.4 -0.933 8.0-173.2-108.6 131.3 12.7 7.0 13.3 62 60 A K E -CD 111 68A 98 49,-3.0 48,-3.2 -2,-0.5 49,-1.8 -0.986 9.2-150.6-130.1 139.2 14.2 7.8 9.9 63 61 A T E > -C 109 0A 1 4,-3.1 3,-1.6 -2,-0.4 46,-0.2 -0.588 33.0-105.5-102.3 166.7 12.5 9.3 6.8 64 62 A R T 3 S+ 0 0 166 44,-2.4 45,-0.1 1,-0.3 -1,-0.1 0.859 121.2 57.2 -59.9 -36.9 13.3 8.8 3.1 65 63 A L T 3 S- 0 0 97 43,-0.2 -1,-0.3 1,-0.1 3,-0.1 0.721 123.8-106.7 -63.5 -19.6 14.9 12.3 3.0 66 64 A G < + 0 0 40 -3,-1.6 -2,-0.1 1,-0.4 2,-0.1 0.414 69.8 148.1 105.6 1.5 17.2 11.2 5.7 67 65 A R + 0 0 69 68,-0.1 -4,-3.1 -5,-0.1 -1,-0.4 -0.493 24.6 179.9 -70.8 141.6 15.6 13.1 8.5 68 66 A T E + D 0 62A 49 -6,-0.2 2,-0.3 66,-0.2 -6,-0.2 -0.997 16.6 173.8-146.2 151.3 15.9 11.2 11.8 69 67 A I E - 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