==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE(OXO-ACID) 02-JUL-92 1CAO . COMPND 2 MOLECULE: CARBONIC ANHYDRASE II; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.MANGANI,K.HAKANSSON . 259 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11831.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 164 63.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 19 7.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 56 21.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.8 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 . 2 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 22 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 13.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 16 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), 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 . 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 1 1 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 . 1 2 0 1 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 PARALLEL BRIDGES PER LADDER . 2 3 1 1 1 1 0 1 1 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 . 0 1 0 0 0 0 0 0 0 0 0 1 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 56 0, 0.0 2,-0.3 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0-174.3 13.1 -2.9 12.1 2 3 A H - 0 0 178 8,-0.1 2,-0.2 0, 0.0 0, 0.0 -0.749 360.0 -0.7 142.5-118.3 13.6 -0.5 9.2 3 4 A H S S- 0 0 115 -2,-0.3 0, 0.0 1,-0.1 0, 0.0 -0.588 98.7-109.3 -84.7 149.8 9.8 0.3 8.9 4 5 A W + 0 0 29 -2,-0.2 2,-0.2 -3,-0.1 7,-0.2 -0.269 54.8 138.2 -67.6 159.5 7.7 -1.6 11.5 5 6 A G - 0 0 13 5,-2.3 10,-0.1 2,-0.2 58,-0.1 -0.809 63.7 -80.6-172.3-150.9 5.4 -4.4 10.4 6 7 A Y S S+ 0 0 33 -2,-0.2 5,-0.2 5,-0.2 237,-0.1 0.246 83.4 112.2-122.6 15.2 4.4 -7.8 11.6 7 8 A G S > S- 0 0 38 4,-0.1 4,-1.6 1,-0.1 3,-0.4 -0.188 82.9 -97.0 -79.4 178.9 7.3 -9.9 10.3 8 9 A K T 4 S+ 0 0 160 1,-0.2 5,-0.1 2,-0.2 -1,-0.1 0.846 123.3 42.0 -61.9 -40.6 10.1 -11.7 12.2 9 10 A H T 4 S+ 0 0 151 1,-0.1 -1,-0.2 4,-0.0 -3,-0.0 0.632 130.4 20.7 -89.1 -12.2 12.5 -8.8 11.7 10 11 A N T 4 S+ 0 0 45 -3,-0.4 -5,-2.3 -6,-0.0 -2,-0.2 0.203 93.2 128.9-142.5 18.0 10.2 -5.7 12.3 11 12 A G S >< S- 0 0 0 -4,-1.6 3,-2.2 -7,-0.2 4,-0.4 0.139 78.6 -73.2 -73.0 177.9 7.4 -7.2 14.3 12 13 A P G > S+ 0 0 26 0, 0.0 3,-1.1 0, 0.0 4,-0.4 0.722 125.5 63.5 -51.0 -31.8 5.9 -6.2 17.6 13 14 A E G 3 S+ 0 0 112 1,-0.3 3,-0.2 2,-0.1 -5,-0.0 0.694 106.7 46.6 -70.9 -10.7 8.9 -7.3 19.7 14 15 A H G X> S+ 0 0 39 -3,-2.2 3,-1.5 1,-0.1 4,-0.5 0.576 84.1 92.6-100.5 -13.6 11.0 -4.8 17.9 15 16 A W H X> S+ 0 0 5 -3,-1.1 4,-2.7 -4,-0.4 3,-0.9 0.767 72.1 69.8 -56.2 -36.2 8.7 -1.7 18.1 16 17 A H H 34 S+ 0 0 65 -4,-0.4 -1,-0.3 1,-0.2 7,-0.1 0.751 87.6 66.4 -53.4 -29.7 10.2 -0.4 21.3 17 18 A K H <4 S+ 0 0 120 -3,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.891 118.2 22.7 -63.4 -39.5 13.5 0.6 19.5 18 19 A D H << S+ 0 0 90 -3,-0.9 -2,-0.2 -4,-0.5 -1,-0.2 0.760 136.1 36.8 -93.6 -29.9 11.7 3.2 17.4 19 20 A F >< - 0 0 59 -4,-2.7 3,-2.6 1,-0.1 -1,-0.2 -0.806 63.7-178.0-128.5 81.1 8.7 3.8 19.8 20 21 A P G > S+ 0 0 97 0, 0.0 3,-2.0 0, 0.0 -4,-0.1 0.720 77.4 75.0 -52.6 -27.5 9.9 3.5 23.4 21 22 A I G > S+ 0 0 57 1,-0.3 3,-2.3 179,-0.2 5,-0.2 0.642 72.0 87.8 -63.2 -10.6 6.3 4.1 24.6 22 23 A A G < S+ 0 0 6 -3,-2.6 -1,-0.3 1,-0.3 -6,-0.1 0.742 90.8 45.3 -56.1 -26.0 5.8 0.5 23.5 23 24 A K G < S+ 0 0 142 -3,-2.0 -1,-0.3 -4,-0.1 -2,-0.2 0.077 94.2 132.2-106.4 24.6 7.0 -0.5 27.0 24 25 A G S < S- 0 0 18 -3,-2.3 3,-0.5 1,-0.1 -3,-0.0 0.017 70.6-106.6 -68.2 179.1 4.7 2.2 28.6 25 26 A E S S+ 0 0 123 1,-0.2 226,-0.3 225,-0.1 -1,-0.1 0.411 112.2 41.9 -88.0 -9.6 2.3 1.8 31.6 26 27 A R S S+ 0 0 51 -5,-0.2 -1,-0.2 224,-0.1 2,-0.2 -0.216 78.9 150.7-135.3 50.0 -0.9 1.9 29.6 27 28 A Q - 0 0 5 -3,-0.5 220,-0.1 221,-0.3 170,-0.1 -0.465 34.1-103.2 -86.3 153.0 -0.3 -0.2 26.5 28 29 A S S S+ 0 0 0 168,-0.4 2,-0.1 -2,-0.2 -2,-0.0 -0.875 76.1 41.6-124.7 158.6 -2.9 -2.2 24.5 29 30 A P + 0 0 0 0, 0.0 218,-3.0 0, 0.0 2,-0.3 0.628 65.0 176.6 -80.2-179.6 -4.2 -4.7 23.8 30 31 A V - 0 0 1 216,-0.3 77,-1.1 -2,-0.1 2,-0.4 -0.910 36.5-100.0-134.9 166.9 -4.6 -6.7 27.1 31 32 A D E -a 107 0A 36 216,-0.4 2,-0.8 -2,-0.3 77,-0.2 -0.747 34.6-135.8 -88.3 133.1 -6.1 -10.0 28.2 32 33 A I E -a 108 0A 0 75,-3.1 77,-2.9 -2,-0.4 2,-0.9 -0.869 13.0-159.1 -94.8 106.7 -9.5 -9.5 29.8 33 34 A D >> - 0 0 63 -2,-0.8 4,-1.0 75,-0.2 3,-0.8 -0.817 4.3-160.9 -86.3 105.5 -9.7 -11.6 32.9 34 35 A T T 34 S+ 0 0 47 -2,-0.9 -1,-0.1 1,-0.2 222,-0.0 0.733 85.0 53.8 -64.5 -26.9 -13.4 -11.9 33.4 35 36 A H T 34 S+ 0 0 162 1,-0.2 -1,-0.2 -3,-0.0 -2,-0.0 0.710 113.6 42.9 -82.0 -17.0 -13.3 -13.0 37.0 36 37 A T T <4 S+ 0 0 102 -3,-0.8 218,-0.2 2,-0.1 -2,-0.2 0.513 86.4 105.3-103.8 -13.1 -11.2 -9.9 38.0 37 38 A A S < S- 0 0 18 -4,-1.0 2,-0.5 216,-0.1 218,-0.2 -0.540 71.8-130.2 -67.7 136.3 -13.0 -7.3 35.9 38 39 A K E -c 255 0B 115 216,-2.4 218,-2.6 -2,-0.2 2,-0.3 -0.855 9.0-127.9 -97.3 124.7 -15.1 -5.2 38.3 39 40 A Y E -c 256 0B 77 -2,-0.5 218,-0.2 216,-0.2 220,-0.1 -0.542 25.3-163.1 -65.8 131.1 -18.7 -4.5 37.6 40 41 A D > - 0 0 25 216,-2.6 3,-1.8 -2,-0.3 -1,-0.1 -0.916 14.5-171.6-124.9 105.0 -19.3 -0.8 37.8 41 42 A P T 3 S+ 0 0 99 0, 0.0 -1,-0.1 0, 0.0 216,-0.1 0.515 82.6 71.0 -69.9 -7.9 -22.9 0.3 38.2 42 43 A S T 3 S+ 0 0 81 2,-0.1 2,-0.5 40,-0.0 215,-0.1 0.574 76.3 102.2 -85.6 -7.4 -22.0 3.9 37.7 43 44 A L < - 0 0 30 -3,-1.8 3,-0.1 213,-0.2 -3,-0.0 -0.674 66.5-142.9 -81.8 132.9 -21.3 3.2 34.1 44 45 A K - 0 0 124 37,-0.8 39,-0.1 -2,-0.5 -2,-0.1 -0.307 28.5 -88.7 -84.5 162.5 -24.0 4.3 31.7 45 46 A P - 0 0 112 0, 0.0 36,-1.6 0, 0.0 -1,-0.2 -0.324 49.6-104.7 -67.5 148.4 -25.1 2.5 28.6 46 47 A L E -D 80 0B 15 141,-0.3 2,-0.5 34,-0.3 34,-0.2 -0.566 27.0-146.6 -70.8 157.1 -23.2 3.3 25.4 47 48 A S E -D 79 0B 48 32,-2.8 32,-2.2 -2,-0.2 2,-0.6 -0.983 15.1-175.2-130.1 111.5 -25.0 5.6 22.9 48 49 A V E -D 78 0B 33 -2,-0.5 2,-0.6 30,-0.2 30,-0.2 -0.962 3.8-177.7-108.1 117.9 -24.1 4.9 19.3 49 50 A S E +D 77 0B 37 28,-3.0 28,-2.0 -2,-0.6 3,-0.1 -0.859 25.5 142.0-121.0 92.2 -25.6 7.3 16.7 50 51 A Y > + 0 0 3 -2,-0.6 3,-1.3 26,-0.2 130,-0.2 0.148 34.4 105.8-113.5 12.5 -24.5 6.1 13.3 51 52 A D T 3 S+ 0 0 98 1,-0.2 -1,-0.1 -3,-0.1 25,-0.1 0.799 87.5 42.4 -67.7 -24.4 -27.7 6.8 11.3 52 53 A Q T 3 S+ 0 0 120 23,-0.7 -1,-0.2 -3,-0.1 24,-0.2 0.269 82.8 144.0-102.4 12.8 -26.1 9.8 9.5 53 54 A A < - 0 0 22 -3,-1.3 2,-0.5 22,-0.2 18,-0.1 -0.173 34.7-158.7 -52.5 137.2 -22.7 8.1 8.9 54 55 A T - 0 0 50 16,-0.3 16,-2.6 122,-0.1 2,-0.2 -0.881 3.8-161.6-123.2 103.4 -21.0 9.1 5.7 55 56 A S E +E 69 0B 0 -2,-0.5 121,-0.6 122,-0.3 14,-0.3 -0.471 12.4 175.5 -79.9 151.0 -18.4 6.6 4.4 56 57 A L E - 0 0 79 12,-3.0 118,-2.2 1,-0.4 2,-0.3 0.700 50.4 -12.7-119.1 -44.9 -15.9 8.0 1.9 57 58 A R E -EF 68 173B 85 11,-1.1 11,-3.0 116,-0.3 2,-0.4 -0.985 43.9-133.7-162.8 159.8 -13.2 5.5 0.9 58 59 A I E -EF 67 172B 0 114,-2.8 114,-2.2 -2,-0.3 2,-0.4 -0.977 28.6-176.6-125.7 138.6 -11.4 2.3 1.7 59 60 A L E -EF 66 171B 29 7,-2.2 7,-2.5 -2,-0.4 2,-0.7 -0.996 28.1-139.5-139.5 144.6 -7.6 2.2 1.6 60 61 A N E -E 65 0B 0 110,-2.6 109,-2.6 -2,-0.4 5,-0.2 -0.851 22.4-177.7 -99.6 112.4 -4.9 -0.5 2.1 61 62 A N - 0 0 31 3,-2.1 -1,-0.1 -2,-0.7 4,-0.1 0.310 53.3 -97.9 -98.7 11.0 -2.3 1.3 4.2 62 63 A G S S+ 0 0 12 2,-0.5 106,-0.1 166,-0.2 3,-0.1 0.278 118.1 52.2 96.6 -16.8 0.1 -1.5 4.2 63 64 A H S S- 0 0 45 1,-0.5 2,-0.3 -58,-0.1 166,-0.1 0.505 123.9 -25.7-124.9 -11.6 -0.9 -2.8 7.7 64 65 A A S S- 0 0 2 164,-0.1 -3,-2.1 -5,-0.1 -2,-0.5 -0.885 71.6 -92.0-172.1-170.4 -4.7 -3.2 7.4 65 66 A F E -E 60 0B 0 -2,-0.3 29,-0.5 29,-0.2 2,-0.4 -0.978 35.1-156.5-123.0 136.3 -7.5 -1.7 5.4 66 67 A N E -E 59 0B 18 -7,-2.5 -7,-2.2 -2,-0.4 2,-0.5 -0.944 10.9-153.3-111.0 137.1 -9.3 1.3 6.7 67 68 A V E -EG 58 92B 0 25,-2.5 25,-1.8 -2,-0.4 2,-0.3 -0.955 28.1-152.3-100.9 125.4 -12.8 2.5 5.7 68 69 A E E -EG 57 91B 50 -11,-3.0 -12,-3.0 -2,-0.5 -11,-1.1 -0.757 7.9-156.1-107.8 149.6 -12.8 6.3 6.3 69 70 A F E -E 55 0B 8 21,-2.5 2,-0.7 -2,-0.3 -14,-0.2 -0.781 30.2-101.1-121.0 153.7 -15.7 8.5 7.2 70 71 A D + 0 0 41 -16,-2.6 -16,-0.3 -2,-0.3 6,-0.3 -0.722 41.2 173.2 -74.7 119.5 -16.5 12.2 6.8 71 72 A D + 0 0 43 -2,-0.7 -1,-0.1 1,-0.1 17,-0.1 -0.019 45.2 108.6-116.6 26.4 -15.8 13.6 10.4 72 73 A S S S+ 0 0 79 56,-0.0 2,-0.3 1,-0.0 -1,-0.1 0.600 89.0 20.6 -77.6 -9.3 -16.1 17.3 9.6 73 74 A Q S S- 0 0 115 -3,-0.2 2,-2.2 3,-0.0 3,-0.4 -0.940 99.3 -83.1-151.3 166.6 -19.4 17.3 11.5 74 75 A D S S+ 0 0 90 -2,-0.3 3,-0.2 1,-0.2 -3,-0.1 -0.397 76.9 126.0 -73.9 64.2 -21.2 15.3 14.2 75 76 A K S S+ 0 0 53 -2,-2.2 -23,-0.7 1,-0.3 2,-0.6 0.922 74.5 23.8 -92.6 -52.8 -22.7 12.7 11.9 76 77 A A S S+ 0 0 6 -3,-0.4 13,-2.9 -6,-0.3 2,-0.3 -0.971 84.8 162.3-118.8 108.6 -21.6 9.4 13.4 77 78 A V E -DH 49 88B 9 -28,-2.0 -28,-3.0 -2,-0.6 2,-0.4 -0.911 30.8-151.5-128.6 160.7 -20.8 9.7 17.1 78 79 A L E +DH 48 87B 0 9,-2.8 9,-2.2 -2,-0.3 2,-0.3 -0.960 27.9 152.5-122.3 143.6 -20.4 7.7 20.2 79 80 A K E +D 47 0B 71 -32,-2.2 -32,-2.8 -2,-0.4 7,-0.1 -0.916 37.3 44.9-155.0 178.8 -21.1 9.0 23.7 80 81 A G E > S+D 46 0B 20 3,-0.4 3,-2.2 5,-0.3 -34,-0.3 -0.375 71.2 87.0 77.7-156.0 -22.2 7.7 27.1 81 82 A G T 3 S- 0 0 1 -36,-1.6 -37,-0.8 1,-0.3 -1,-0.2 -0.361 121.1 -28.2 59.3-136.5 -20.5 4.6 28.6 82 83 A P T 3 S+ 0 0 40 0, 0.0 -1,-0.3 0, 0.0 2,-0.2 0.350 115.9 112.5 -89.2 9.7 -17.4 5.7 30.4 83 84 A L < - 0 0 13 -3,-2.2 2,-0.5 -39,-0.1 -3,-0.4 -0.590 53.1-155.9 -91.3 151.5 -17.0 8.8 28.1 84 85 A D - 0 0 133 -2,-0.2 2,-0.1 53,-0.1 -3,-0.0 -0.982 68.3 -0.1-113.6 123.8 -17.4 12.5 28.8 85 86 A G S S- 0 0 47 -2,-0.5 2,-0.4 38,-0.1 -5,-0.3 -0.355 98.1 -47.2 97.2 178.8 -18.3 14.4 25.6 86 87 A T - 0 0 33 -7,-0.1 38,-2.7 -2,-0.1 2,-0.5 -0.858 41.6-162.4-105.6 133.0 -18.8 13.5 22.0 87 88 A Y E -HI 78 123B 4 -9,-2.2 -9,-2.8 -2,-0.4 2,-0.4 -0.967 11.6-147.0-118.3 124.4 -16.5 11.3 20.0 88 89 A R E -HI 77 122B 45 34,-2.6 34,-1.7 -2,-0.5 2,-0.3 -0.725 17.7-118.9 -95.1 137.3 -16.7 11.3 16.2 89 90 A L E + I 0 121B 2 -13,-2.9 32,-0.2 -2,-0.4 -13,-0.2 -0.504 37.1 165.0 -74.0 130.5 -16.1 8.3 14.1 90 91 A I E - 0 0 33 30,-2.6 -21,-2.5 1,-0.4 2,-0.3 0.705 60.7 -19.7-110.8 -39.1 -13.2 8.7 11.7 91 92 A Q E -GI 68 120B 33 29,-1.3 29,-3.2 -23,-0.2 -1,-0.4 -0.988 46.6-146.4-164.0 158.8 -12.4 5.2 10.5 92 93 A F E +GI 67 119B 0 -25,-1.8 -25,-2.5 -2,-0.3 2,-0.3 -0.977 22.8 163.1-127.6 159.0 -12.8 1.5 11.2 93 94 A H E - I 0 118B 23 25,-2.1 25,-3.2 -2,-0.3 2,-0.3 -0.932 23.5-127.2-161.4 169.1 -10.3 -1.4 10.4 94 95 A F E - I 0 117B 0 -29,-0.5 2,-0.4 -2,-0.3 -29,-0.2 -0.882 0.3-148.9-122.6 162.0 -9.7 -5.0 11.4 95 96 A H E + I 0 116B 3 21,-2.1 21,-2.3 -2,-0.3 2,-0.3 -0.976 31.1 170.7-123.5 137.0 -6.9 -7.2 12.7 96 97 A W E - I 0 115B 0 -2,-0.4 146,-1.2 19,-0.2 145,-0.9 -0.940 22.2-120.4-145.9 172.5 -7.0 -10.9 11.6 97 98 A G - 0 0 0 17,-1.3 6,-0.1 5,-0.6 3,-0.1 -0.409 24.0-119.1-113.1 177.1 -5.0 -14.1 11.6 98 99 A S S S+ 0 0 45 142,-0.2 2,-0.3 -2,-0.1 -1,-0.1 0.615 105.3 30.2 -85.1 -15.0 -3.5 -16.6 9.3 99 100 A L S > S- 0 0 108 3,-0.2 3,-2.0 15,-0.1 -2,-0.2 -0.959 89.3-109.6-136.5 158.3 -5.8 -19.3 10.9 100 101 A D T 3 S+ 0 0 70 -2,-0.3 48,-0.2 1,-0.3 15,-0.1 0.722 110.0 68.5 -63.5 -23.7 -9.2 -19.1 12.6 101 102 A G T 3 S+ 0 0 57 13,-0.1 2,-0.3 2,-0.1 -1,-0.3 0.416 107.5 28.5 -78.1 3.6 -7.7 -19.7 16.0 102 103 A Q < + 0 0 50 -3,-2.0 -5,-0.6 12,-0.1 -3,-0.2 -0.966 64.2 100.7-153.1 168.0 -5.9 -16.3 16.2 103 104 A G + 0 0 0 1,-0.6 13,-0.3 -2,-0.3 11,-0.2 0.097 55.5 104.9 145.7 -41.2 -6.3 -12.8 14.9 104 105 A S - 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