==== 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 04-FEB-00 1DYP . COMPND 2 MOLECULE: KAPPA-CARRAGEENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOALTEROMONAS CARRAGEENOVORA; . AUTHOR G.MICHEL,L.CHANTALAT,O.DIDEBERG . 271 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12344.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 174 64.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 1.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 109 40.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 1.8 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 . 33 12.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 21 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 4 1.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 1 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 1 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 . 2 1 2 2 6 1 2 2 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 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 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 27 A S 0 0 154 0, 0.0 12,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -8.6 4.1 53.0 8.7 2 28 A X - 0 0 68 1,-0.1 13,-0.2 13,-0.0 11,-0.0 -0.216 360.0-159.7 -48.0 122.0 5.4 50.6 11.5 3 29 A Q - 0 0 77 11,-0.1 -1,-0.1 1,-0.0 11,-0.0 -0.827 17.6-104.5-113.8 149.7 9.1 51.2 11.8 4 30 A P > - 0 0 5 0, 0.0 3,-1.9 0, 0.0 -1,-0.0 -0.338 29.4-119.6 -68.4 148.4 12.0 49.1 13.2 5 31 A P T 3 S+ 0 0 83 0, 0.0 -2,-0.0 0, 0.0 0, 0.0 0.684 111.7 58.2 -60.8 -21.6 13.5 50.1 16.6 6 32 A I T 3 S+ 0 0 34 2,-0.1 2,-0.1 0, 0.0 192,-0.0 0.399 75.5 128.8 -91.0 2.7 16.9 50.7 15.1 7 33 A A < - 0 0 37 -3,-1.9 3,-0.1 1,-0.1 -4,-0.0 -0.394 51.0-144.8 -61.2 129.0 15.6 53.3 12.7 8 34 A K > - 0 0 135 1,-0.1 3,-2.1 -2,-0.1 -1,-0.1 -0.582 35.7 -74.9 -93.1 158.7 17.7 56.5 12.9 9 35 A P T 3 S+ 0 0 138 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.298 120.7 20.0 -55.4 126.9 16.2 60.0 12.6 10 36 A G T 3 S+ 0 0 87 1,-0.3 2,-0.2 -3,-0.1 -3,-0.0 0.417 97.6 122.0 95.1 -1.5 15.4 60.7 9.0 11 37 A E < - 0 0 41 -3,-2.1 2,-0.4 259,-0.0 -1,-0.3 -0.583 45.8-154.3 -96.3 159.1 15.3 57.1 7.8 12 38 A T - 0 0 84 259,-0.5 259,-2.8 -2,-0.2 2,-0.3 -0.994 10.5-174.3-134.5 125.6 12.5 55.2 6.1 13 39 A W E -A 270 0A 14 -2,-0.4 2,-0.5 257,-0.2 257,-0.2 -0.903 14.9-141.2-119.4 148.9 12.1 51.4 6.3 14 40 A I E -A 269 0A 97 255,-2.4 255,-1.9 -2,-0.3 2,-0.1 -0.942 17.6-127.0-116.1 124.6 9.5 49.2 4.5 15 41 A L E -A 268 0A 63 -2,-0.5 2,-1.1 253,-0.2 253,-0.3 -0.419 16.9-135.5 -66.4 135.0 7.8 46.2 6.1 16 42 A Q > - 0 0 57 251,-3.6 3,-2.1 1,-0.2 251,-0.3 -0.809 15.8-163.3 -95.7 97.3 8.1 43.0 4.1 17 43 A A G > S+ 0 0 67 -2,-1.1 3,-1.5 1,-0.3 -1,-0.2 0.833 83.7 59.0 -48.5 -42.5 4.6 41.6 4.3 18 44 A K G 3 S+ 0 0 150 1,-0.3 75,-0.5 -3,-0.1 -1,-0.3 0.593 113.9 36.7 -68.9 -11.8 5.6 38.1 3.2 19 45 A R G < S+ 0 0 15 -3,-2.1 2,-0.4 248,-0.2 -1,-0.3 -0.005 106.6 80.4-128.4 28.7 8.0 37.8 6.1 20 46 A S < + 0 0 6 -3,-1.5 2,-0.3 246,-0.2 246,-0.2 -0.994 47.3 163.6-136.0 140.5 6.0 39.6 8.8 21 47 A D B -B 265 0A 18 244,-2.8 244,-2.4 -2,-0.4 -3,-0.0 -0.944 31.1-161.2-159.2 134.6 3.0 38.4 10.8 22 48 A E - 0 0 61 -2,-0.3 244,-0.1 242,-0.2 -1,-0.1 0.417 48.6-126.2 -93.8 -1.1 1.3 39.6 14.0 23 49 A F + 0 0 1 2,-0.1 30,-0.2 242,-0.1 28,-0.1 0.901 65.1 138.1 56.1 53.6 -0.2 36.1 14.3 24 50 A N S S+ 0 0 122 1,-0.2 2,-0.3 29,-0.1 29,-0.2 0.699 79.5 17.5 -90.6 -25.9 -3.9 36.9 14.6 25 51 A V S S- 0 0 94 28,-0.1 2,-0.9 26,-0.1 -1,-0.2 -0.933 86.9-104.2-140.6 162.0 -4.5 33.9 12.3 26 52 A K - 0 0 77 -2,-0.3 2,-0.9 24,-0.2 24,-0.1 -0.815 38.8-162.4 -91.3 105.6 -2.6 30.9 11.1 27 53 A D > + 0 0 48 -2,-0.9 4,-2.6 1,-0.1 3,-0.3 -0.767 19.3 174.8 -97.6 96.3 -1.6 31.9 7.6 28 54 A A T 4 S+ 0 0 57 -2,-0.9 -1,-0.1 1,-0.2 5,-0.1 0.527 79.3 63.2 -76.3 -7.2 -0.6 28.8 5.5 29 55 A T T 4 S+ 0 0 121 1,-0.1 -1,-0.2 3,-0.1 63,-0.1 0.859 114.5 32.3 -81.6 -36.3 -0.2 30.9 2.4 30 56 A K T 4 S+ 0 0 48 -3,-0.3 62,-2.2 1,-0.1 63,-0.4 0.857 123.6 44.4 -86.3 -40.1 2.6 32.9 4.0 31 57 A W E < -I 91 0B 0 -4,-2.6 2,-0.8 60,-0.2 60,-0.2 -0.860 65.3-141.6-116.0 145.9 4.1 30.1 6.2 32 58 A N E -I 90 0B 45 58,-2.9 58,-2.2 -2,-0.4 3,-0.3 -0.905 19.4-174.6 -99.1 111.1 5.0 26.5 5.7 33 59 A F S S+ 0 0 6 -2,-0.8 55,-0.5 1,-0.2 14,-0.2 0.259 76.3 41.9 -92.9 11.3 4.0 24.9 9.0 34 60 A Q S S+ 0 0 104 56,-0.1 -1,-0.2 53,-0.1 3,-0.1 -0.500 78.8 169.7-156.8 76.9 5.4 21.4 8.1 35 61 A T - 0 0 8 -3,-0.3 8,-0.3 1,-0.2 10,-0.0 -0.022 47.7 -54.5 -80.5-174.5 8.7 21.7 6.4 36 62 A E - 0 0 89 1,-0.1 -1,-0.2 6,-0.1 2,-0.2 -0.314 66.1-113.6 -61.4 146.6 11.3 19.1 5.5 37 63 A N + 0 0 71 -3,-0.1 2,-0.3 6,-0.1 5,-0.1 -0.533 45.6 146.9 -89.0 153.8 12.4 17.1 8.5 38 64 A Y > + 0 0 69 3,-0.4 3,-1.0 -2,-0.2 206,-0.0 -0.921 42.7 42.4-164.4-180.0 15.8 17.0 10.2 39 65 A G T 3 S- 0 0 20 -2,-0.3 -2,-0.0 1,-0.2 193,-0.0 -0.346 110.1 -56.0 67.0-152.4 17.3 16.6 13.6 40 66 A V T 3 S+ 0 0 2 206,-0.1 43,-0.6 193,-0.1 44,-0.5 -0.164 116.4 60.8-119.9 38.8 15.7 13.9 15.7 41 67 A W E < S-q 84 0C 9 -3,-1.0 -3,-0.4 41,-0.1 2,-0.4 -0.889 73.7-124.2-148.1 173.8 12.1 15.0 15.6 42 68 A S E -q 85 0C 2 42,-1.0 44,-2.3 -2,-0.3 2,-0.3 -0.972 21.4-120.0-128.9 145.3 9.5 15.6 13.0 43 69 A W E -q 86 0C 2 -2,-0.4 2,-0.4 -8,-0.3 44,-0.2 -0.606 27.3-169.1 -81.7 142.8 7.5 18.7 12.2 44 70 A K > - 0 0 75 42,-2.0 3,-2.2 -2,-0.3 4,-0.2 -0.995 25.2-140.0-136.2 128.5 3.7 18.5 12.4 45 71 A N G > S+ 0 0 77 -2,-0.4 3,-1.7 1,-0.3 -1,-0.1 0.846 104.6 60.4 -52.1 -37.2 1.3 21.1 11.2 46 72 A E G 3 S+ 0 0 122 1,-0.3 -1,-0.3 -3,-0.1 41,-0.1 0.662 92.1 67.2 -68.7 -14.2 -0.9 20.5 14.2 47 73 A N G < S+ 0 0 1 -3,-2.2 11,-2.8 39,-0.3 2,-0.6 0.487 90.3 73.7 -83.4 -2.6 2.1 21.5 16.5 48 74 A A E < +C 57 0A 0 -3,-1.7 2,-0.3 -4,-0.2 9,-0.2 -0.951 65.8 167.0-113.2 113.2 1.7 25.0 15.1 49 75 A T E -C 56 0A 60 7,-2.6 7,-3.7 -2,-0.6 2,-0.5 -0.946 26.6-150.8-129.3 150.0 -1.3 26.9 16.5 50 76 A V E +C 55 0A 32 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.977 28.7 156.4-121.7 118.7 -2.4 30.5 16.5 51 77 A S E > -C 54 0A 78 3,-2.2 3,-1.5 -2,-0.5 -26,-0.1 -0.994 61.1 -7.9-145.9 136.5 -4.5 31.6 19.4 52 78 A K T 3 S- 0 0 154 -2,-0.3 -28,-0.1 1,-0.3 -1,-0.1 0.863 128.9 -45.1 44.6 53.8 -5.2 35.0 21.0 53 79 A G T 3 S+ 0 0 19 -29,-0.2 2,-0.4 -30,-0.2 -1,-0.3 0.502 118.2 95.9 78.0 3.7 -2.6 37.0 19.0 54 80 A K E < -C 51 0A 42 -3,-1.5 -3,-2.2 -30,-0.1 2,-0.5 -0.975 65.2-134.8-133.6 146.2 0.3 34.5 19.3 55 81 A L E -CD 50 262A 0 207,-2.8 207,-2.9 -2,-0.4 2,-0.5 -0.808 24.6-158.8 -91.0 130.5 1.8 31.7 17.3 56 82 A K E -CD 49 261A 77 -7,-3.7 -7,-2.6 -2,-0.5 2,-0.6 -0.967 7.0-166.6-115.8 122.9 2.5 28.7 19.6 57 83 A L E -CD 48 260A 0 203,-2.3 203,-2.0 -2,-0.5 2,-0.4 -0.950 17.5-161.4-110.7 114.2 5.0 26.1 18.4 58 84 A T E - D 0 259A 18 -11,-2.8 2,-0.5 -2,-0.6 201,-0.2 -0.795 17.3-155.5-106.2 137.8 4.7 23.0 20.5 59 85 A T E - D 0 258A 1 199,-2.9 199,-1.8 -2,-0.4 2,-0.3 -0.937 24.0-173.6-105.7 126.7 7.1 20.1 21.1 60 86 A K E -R 85 0C 59 25,-2.5 25,-1.9 -2,-0.5 2,-0.8 -0.895 34.7-113.4-122.2 151.4 5.3 16.9 22.2 61 87 A R E +R 84 0C 74 -2,-0.3 2,-0.3 23,-0.2 23,-0.3 -0.761 57.5 154.4 -78.8 114.4 6.4 13.5 23.3 62 88 A E E - 0 0 68 21,-2.2 2,-0.1 -2,-0.8 -2,-0.1 -0.789 36.6-143.1-152.2 103.7 5.2 11.6 20.3 63 89 A S E + 0 0 76 -2,-0.3 2,-0.3 20,-0.1 20,-0.2 -0.396 41.4 132.2 -66.8 140.5 6.6 8.3 19.2 64 90 A H E -R 82 0C 41 18,-2.0 18,-3.1 -2,-0.1 2,-0.3 -0.950 41.8-122.0-170.2 178.6 6.7 7.8 15.4 65 91 A Q E +R 81 0C 101 -2,-0.3 2,-0.3 16,-0.2 14,-0.1 -0.955 27.8 156.9-137.5 156.6 9.1 6.7 12.7 66 92 A R E -R 80 0C 33 14,-1.3 14,-1.7 -2,-0.3 2,-0.1 -0.957 53.9 -71.1-166.7 163.8 10.5 8.2 9.5 67 93 A T E - 0 0 84 -2,-0.3 2,-0.4 12,-0.2 11,-0.2 -0.472 55.8-161.9 -64.1 136.8 13.4 7.8 7.2 68 94 A F E -R 77 0C 5 9,-2.6 9,-3.3 -2,-0.1 2,-0.7 -0.984 18.1-130.7-128.9 133.4 16.4 9.1 9.1 69 95 A W E -R 76 0C 102 -2,-0.4 2,-1.2 7,-0.2 7,-0.2 -0.750 15.8-161.5 -85.4 115.6 19.8 10.2 7.8 70 96 A D E >>> +R 75 0C 14 5,-3.2 5,-1.7 -2,-0.7 3,-0.9 -0.740 12.3 179.3 -96.7 82.0 22.5 8.4 9.8 71 97 A G G >45S+ 0 0 5 -2,-1.2 3,-1.0 1,-0.3 -1,-0.2 0.837 74.1 62.7 -53.9 -40.1 25.4 10.7 8.9 72 98 A a G 345S+ 0 0 44 1,-0.3 -1,-0.3 169,-0.2 170,-0.1 0.884 117.4 30.4 -55.3 -39.1 27.9 8.9 11.1 73 99 A N G <45S- 0 0 104 -3,-0.9 -1,-0.3 2,-0.2 -2,-0.2 0.329 106.9-125.8-102.0 6.6 27.4 5.8 8.9 74 100 A Q T <<5S+ 0 0 141 -3,-1.0 2,-0.3 -4,-0.5 -3,-0.2 0.923 70.1 119.3 48.5 52.6 26.6 7.7 5.7 75 101 A Q E < - R 0 70C 92 -5,-1.7 -5,-3.2 -7,-0.0 2,-0.4 -1.000 65.4-126.3-149.4 145.7 23.3 5.9 5.3 76 102 A Q E - R 0 69C 116 -2,-0.3 2,-0.5 -7,-0.2 -7,-0.2 -0.749 28.6-151.9 -87.5 135.5 19.6 6.5 5.2 77 103 A V E > - R 0 68C 39 -9,-3.3 -9,-2.6 -2,-0.4 3,-0.6 -0.953 6.6-140.1-116.0 122.6 17.7 4.4 7.7 78 104 A A E 3 S+ 0 0 69 -2,-0.5 -11,-0.1 1,-0.2 -12,-0.0 -0.416 80.1 9.2 -77.5 153.4 14.1 3.4 7.1 79 105 A N E 3 S- 0 0 117 1,-0.2 -1,-0.2 -2,-0.1 -12,-0.2 0.851 82.2-178.6 45.9 45.1 11.5 3.3 9.8 80 106 A Y E < - R 0 66C 49 -14,-1.7 -14,-1.3 -3,-0.6 2,-0.3 -0.614 25.8-123.3 -77.5 122.8 13.8 5.0 12.2 81 107 A P E + R 0 65C 64 0, 0.0 2,-0.3 0, 0.0 -16,-0.2 -0.494 34.1 176.4 -72.0 128.6 12.1 5.5 15.6 82 108 A L E - R 0 64C 1 -18,-3.1 -18,-2.0 -2,-0.3 -41,-0.1 -0.851 20.6-154.0-124.4 163.7 11.9 9.0 17.0 83 109 A Y E + 0 0 46 -43,-0.6 -21,-2.2 -2,-0.3 2,-0.3 0.540 65.9 48.5-121.2 -7.4 10.2 10.2 20.1 84 110 A Y E -qR 41 61C 2 -44,-0.5 -42,-1.0 -23,-0.3 2,-0.3 -0.977 51.6-162.6-137.7 149.2 9.2 13.9 19.7 85 111 A T E -qR 42 60C 0 -25,-1.9 -25,-2.5 -2,-0.3 2,-0.3 -0.879 19.5-176.8-122.0 156.3 7.4 16.0 17.2 86 112 A S E -q 43 0C 0 -44,-2.3 -42,-2.0 -2,-0.3 2,-0.3 -0.831 21.4 -97.2-144.4-175.2 7.6 19.8 17.1 87 113 A G + 0 0 0 -2,-0.3 144,-1.7 -44,-0.2 2,-0.3 -0.841 29.8 173.7-115.8 149.4 6.4 23.0 15.4 88 114 A V E - 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