==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=23-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE(OXO-ACID) 09-JUL-91 9CA2 . COMPND 2 MOLECULE: CARBONIC ANHYDRASE II; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR R.S.ALEXANDER,D.W.CHRISTIANSON . 255 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11508.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 163 63.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 18 7.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 56 22.0 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 . 24 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 14.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 14 5.5 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 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 0 0 RESIDUES PER ALPHA HELIX . 1 2 1 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 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 5 A W 0 0 113 0, 0.0 2,-0.3 0, 0.0 7,-0.2 0.000 360.0 360.0 360.0 158.3 7.7 -1.6 11.4 2 6 A G - 0 0 13 5,-1.8 10,-0.1 2,-0.1 58,-0.1 -0.847 360.0 -82.9-173.0-149.9 5.5 -4.5 10.5 3 7 A Y S S+ 0 0 34 -2,-0.3 5,-0.2 5,-0.2 237,-0.1 0.128 85.1 109.0-124.8 10.6 4.5 -7.9 11.7 4 8 A G S > S- 0 0 22 4,-0.1 4,-0.8 1,-0.1 -2,-0.1 -0.102 84.0 -99.5 -82.1-178.0 7.4 -9.9 10.5 5 9 A K T 4 S+ 0 0 170 1,-0.2 -1,-0.1 2,-0.2 5,-0.1 0.798 121.8 41.2 -75.1 -30.9 10.2 -11.5 12.5 6 10 A H T 4 S+ 0 0 167 1,-0.1 -1,-0.2 -5,-0.0 0, 0.0 0.521 131.5 25.0 -92.5 -13.4 12.7 -8.7 11.8 7 11 A N T 4 S+ 0 0 66 -6,-0.0 -5,-1.8 5,-0.0 -2,-0.2 0.166 95.3 133.0-135.1 10.8 10.2 -5.8 12.2 8 12 A G S >< S- 0 0 0 -4,-0.8 3,-2.7 -5,-0.2 4,-0.5 0.085 77.1 -84.1 -61.3 168.8 7.6 -7.4 14.4 9 13 A P G > S+ 0 0 24 0, 0.0 3,-0.8 0, 0.0 4,-0.3 0.728 124.8 67.1 -45.1 -34.9 6.0 -6.1 17.6 10 14 A E G 3 S+ 0 0 108 1,-0.2 -2,-0.1 2,-0.1 -5,-0.0 0.448 103.8 44.3 -70.3 -0.9 9.0 -7.3 19.6 11 15 A H G X S+ 0 0 51 -3,-2.7 3,-1.6 -4,-0.1 4,-0.4 0.462 85.4 90.7-117.7 -8.8 11.1 -4.6 17.8 12 16 A W G X> S+ 0 0 4 -3,-0.8 4,-2.9 -4,-0.5 3,-1.0 0.721 72.9 72.6 -60.5 -28.7 8.8 -1.7 18.0 13 17 A H G 34 S+ 0 0 78 -4,-0.3 -1,-0.3 1,-0.2 7,-0.1 0.666 88.7 62.6 -60.2 -21.6 10.3 -0.6 21.3 14 18 A K G <4 S+ 0 0 130 -3,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.821 118.4 23.7 -76.0 -28.8 13.4 0.6 19.5 15 19 A D T <4 S+ 0 0 125 -3,-1.0 -2,-0.2 -4,-0.4 -1,-0.2 0.650 134.9 38.4-104.1 -27.0 11.6 3.3 17.4 16 20 A F >< - 0 0 56 -4,-2.9 3,-2.9 -5,-0.1 -1,-0.2 -0.729 63.2-179.6-131.0 76.6 8.7 3.7 19.9 17 21 A P G > S+ 0 0 99 0, 0.0 3,-1.3 0, 0.0 -4,-0.1 0.592 77.7 75.5 -45.3 -24.7 10.0 3.5 23.5 18 22 A I G > S+ 0 0 57 1,-0.3 3,-3.1 179,-0.2 -5,-0.1 0.656 70.3 86.1 -68.2 -14.7 6.4 4.0 24.6 19 23 A A G < S+ 0 0 9 -3,-2.9 -1,-0.3 1,-0.3 -6,-0.1 0.628 90.2 50.0 -59.2 -15.3 5.8 0.3 23.6 20 24 A K G < S+ 0 0 140 -3,-1.3 -1,-0.3 -4,-0.1 -2,-0.1 0.044 93.1 133.9-111.6 16.8 7.0 -0.5 27.1 21 25 A G < - 0 0 15 -3,-3.1 3,-0.4 1,-0.1 -3,-0.0 0.092 69.1-108.0 -62.0 179.6 4.6 2.1 28.6 22 26 A E S S+ 0 0 122 1,-0.2 227,-0.3 169,-0.0 -1,-0.1 0.542 111.6 38.1 -88.4 -15.3 2.4 1.9 31.6 23 27 A R S S+ 0 0 49 2,-0.0 -1,-0.2 168,-0.0 2,-0.2 -0.493 80.0 157.8-139.2 63.1 -0.9 1.8 29.7 24 28 A Q - 0 0 2 221,-0.4 220,-0.2 -3,-0.4 170,-0.1 -0.527 32.6-101.8 -88.9 152.0 -0.3 -0.3 26.6 25 29 A S S S+ 0 0 0 168,-0.4 2,-0.1 -2,-0.2 78,-0.1 -0.946 80.2 42.3-128.7 146.1 -2.9 -2.1 24.4 26 30 A P + 0 0 0 0, 0.0 218,-4.0 0, 0.0 2,-0.3 0.497 64.8 174.1 -82.8 175.3 -4.0 -4.8 23.9 27 31 A V - 0 0 1 216,-0.3 77,-0.9 -2,-0.1 2,-0.4 -0.872 35.8-102.4-137.3 166.4 -4.5 -6.6 27.2 28 32 A D E -a 104 0A 41 216,-0.5 2,-0.7 -2,-0.3 77,-0.2 -0.765 32.3-138.7 -93.2 136.6 -6.1 -9.9 28.3 29 33 A I E -a 105 0A 0 75,-2.7 77,-3.0 -2,-0.4 2,-0.9 -0.899 11.0-161.6-104.8 108.7 -9.5 -9.5 29.9 30 34 A D >> - 0 0 67 -2,-0.7 4,-2.1 75,-0.2 3,-0.8 -0.866 4.4-159.5 -89.6 104.0 -9.9 -11.7 32.9 31 35 A T T 34 S+ 0 0 47 -2,-0.9 -1,-0.1 1,-0.2 222,-0.0 0.553 89.2 52.6 -62.6 -15.8 -13.6 -11.8 33.3 32 36 A H T 34 S+ 0 0 165 1,-0.1 -1,-0.2 3,-0.0 -2,-0.0 0.675 113.6 41.2 -94.1 -24.5 -13.3 -12.9 37.0 33 37 A T T <4 S+ 0 0 102 -3,-0.8 -2,-0.2 2,-0.1 218,-0.1 0.684 90.4 106.0 -90.9 -28.2 -10.9 -10.0 37.9 34 38 A A S < S- 0 0 19 -4,-2.1 2,-0.6 1,-0.1 218,-0.2 -0.283 70.9-132.9 -54.5 140.9 -12.9 -7.5 35.9 35 39 A K E -c 252 0B 109 216,-2.6 218,-2.3 2,-0.0 2,-0.4 -0.921 6.9-131.9-107.8 119.6 -14.9 -5.3 38.3 36 40 A Y E -c 253 0B 121 -2,-0.6 218,-0.2 216,-0.2 151,-0.0 -0.601 21.5-159.9 -69.2 119.3 -18.6 -4.5 37.7 37 41 A D > - 0 0 26 216,-2.6 3,-1.2 -2,-0.4 -1,-0.0 -0.948 10.7-167.0-110.1 111.4 -19.1 -0.8 38.0 38 42 A P T 3 S+ 0 0 90 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.748 84.8 67.0 -63.3 -32.5 -22.7 0.1 38.6 39 43 A S T 3 S+ 0 0 83 2,-0.0 2,-0.6 0, 0.0 215,-0.1 0.273 75.8 115.3 -75.3 8.2 -22.1 3.8 37.9 40 44 A L < - 0 0 33 -3,-1.2 38,-0.0 213,-0.2 213,-0.0 -0.721 58.7-145.3 -89.1 123.8 -21.4 2.9 34.3 41 45 A K - 0 0 121 37,-0.7 39,-0.1 -2,-0.6 2,-0.1 -0.464 27.4 -88.6 -84.1 155.6 -23.9 4.4 31.9 42 46 A P - 0 0 113 0, 0.0 36,-1.5 0, 0.0 -1,-0.1 -0.302 46.8 -99.8 -66.8 145.9 -25.1 2.7 28.7 43 47 A L E -D 77 0B 17 141,-0.4 2,-0.5 34,-0.3 34,-0.2 -0.383 27.8-151.6 -67.3 144.3 -23.3 3.2 25.4 44 48 A S E +D 76 0B 33 32,-2.6 32,-2.5 -2,-0.1 2,-0.6 -0.918 17.5 176.3-125.0 96.2 -24.7 5.7 23.0 45 49 A V E +D 75 0B 37 -2,-0.5 2,-0.5 30,-0.2 30,-0.2 -0.933 2.9 178.1-104.5 119.0 -23.9 4.8 19.3 46 50 A S E +D 74 0B 38 28,-3.1 28,-1.8 -2,-0.6 3,-0.2 -0.776 23.4 140.7-124.8 83.5 -25.4 7.1 16.7 47 51 A Y > + 0 0 2 -2,-0.5 3,-1.4 26,-0.2 130,-0.2 0.127 35.7 108.8-108.6 16.7 -24.3 6.1 13.2 48 52 A D T 3 S+ 0 0 93 1,-0.3 -1,-0.1 24,-0.1 25,-0.1 0.802 87.4 40.7 -61.7 -33.8 -27.6 6.7 11.4 49 53 A Q T 3 S+ 0 0 126 23,-0.7 -1,-0.3 -3,-0.2 24,-0.2 0.263 87.0 142.3 -98.9 11.6 -26.1 9.7 9.6 50 54 A A < - 0 0 23 -3,-1.4 2,-0.3 22,-0.2 18,-0.1 -0.039 34.5-159.6 -54.7 149.6 -22.7 8.1 9.0 51 55 A T - 0 0 46 16,-0.3 16,-2.5 122,-0.1 2,-0.2 -0.851 1.5-163.7-140.3 98.6 -20.9 8.9 5.7 52 56 A S E +E 66 0B 0 122,-0.4 121,-0.6 -2,-0.3 14,-0.3 -0.552 9.2 178.4 -79.8 148.1 -18.2 6.5 4.5 53 57 A L E - 0 0 73 12,-2.9 118,-2.2 1,-0.4 2,-0.3 0.722 53.2 -16.3-117.7 -46.8 -15.9 8.0 1.7 54 58 A R E -EF 65 170B 84 11,-1.1 11,-2.7 116,-0.3 2,-0.4 -0.982 45.4-125.6-161.8 169.9 -13.3 5.4 0.8 55 59 A I E -EF 64 169B 0 114,-2.3 114,-2.1 -2,-0.3 2,-0.3 -0.953 30.8-172.1-123.4 134.6 -11.4 2.2 1.6 56 60 A L E -EF 63 168B 31 7,-1.9 7,-2.7 -2,-0.4 2,-0.8 -0.998 26.6-141.6-138.1 142.9 -7.6 2.2 1.7 57 61 A N E +E 62 0B 0 110,-2.7 109,-2.8 -2,-0.3 5,-0.2 -0.914 22.1 176.4-100.7 103.9 -4.7 -0.3 2.0 58 62 A N - 0 0 36 3,-1.6 4,-0.1 -2,-0.8 -1,-0.1 0.253 56.4 -98.8 -93.3 10.5 -2.2 1.4 4.2 59 63 A G S S+ 0 0 10 2,-0.5 3,-0.1 166,-0.3 106,-0.1 0.259 117.1 50.5 89.5 -4.0 0.2 -1.6 4.2 60 64 A H S S- 0 0 50 1,-0.4 2,-0.3 -58,-0.1 166,-0.1 0.277 124.2 -18.3-137.9 -6.3 -0.8 -3.0 7.6 61 65 A A S S- 0 0 3 164,-0.1 -3,-1.6 165,-0.1 -2,-0.5 -0.960 70.3 -92.6-177.6-172.8 -4.6 -3.1 7.2 62 66 A F E -E 57 0B 0 -2,-0.3 29,-0.5 -5,-0.2 2,-0.4 -0.988 37.2-152.2-125.4 131.5 -7.4 -1.7 5.2 63 67 A N E -E 56 0B 19 -7,-2.7 -7,-1.9 -2,-0.4 2,-0.7 -0.909 11.4-155.1-112.6 133.7 -9.2 1.4 6.4 64 68 A V E -EG 55 89B 0 25,-2.4 25,-1.9 -2,-0.4 2,-0.4 -0.964 25.5-156.5-104.8 114.1 -12.8 2.5 5.9 65 69 A E E -EG 54 88B 49 -11,-2.7 -12,-2.9 -2,-0.7 -11,-1.1 -0.784 7.0-161.1 -97.8 142.5 -12.7 6.3 6.3 66 70 A F E -E 52 0B 9 21,-2.6 2,-0.7 -2,-0.4 -14,-0.2 -0.718 30.3 -99.1-120.4 159.3 -15.7 8.4 7.2 67 71 A D + 0 0 44 -16,-2.5 6,-0.3 -2,-0.3 -16,-0.3 -0.795 41.2 170.5 -77.9 110.9 -16.5 12.1 6.9 68 72 A D + 0 0 38 -2,-0.7 -1,-0.1 1,-0.1 17,-0.1 -0.199 45.1 107.4-119.1 34.9 -15.9 13.6 10.4 69 73 A S S S+ 0 0 79 1,-0.1 2,-0.3 56,-0.0 -1,-0.1 0.475 91.4 26.3 -85.4 -7.4 -16.2 17.3 9.5 70 74 A Q S S- 0 0 123 -3,-0.2 2,-2.9 3,-0.1 3,-0.4 -0.977 98.7 -90.5-149.7 161.0 -19.5 17.1 11.4 71 75 A D S S+ 0 0 87 -2,-0.3 3,-0.2 1,-0.2 -3,-0.1 -0.332 74.0 132.1 -74.1 60.8 -21.1 15.1 14.2 72 76 A K S S+ 0 0 49 -2,-2.9 -23,-0.7 1,-0.3 2,-0.6 0.980 74.5 22.0 -74.1 -68.0 -22.6 12.6 11.7 73 77 A A S S+ 0 0 6 -3,-0.4 13,-2.1 -6,-0.3 -1,-0.3 -0.971 85.0 177.2-106.4 114.0 -21.6 9.3 13.4 74 78 A V E -DH 46 85B 14 -28,-1.8 -28,-3.1 -2,-0.6 2,-0.4 -0.851 25.6-156.7-124.1 156.4 -21.0 9.8 17.2 75 79 A L E +DH 45 84B 0 9,-3.0 9,-1.4 -2,-0.3 2,-0.2 -0.993 34.2 138.7-127.2 121.5 -20.1 7.7 20.2 76 80 A K E +D 44 0B 87 -32,-2.5 -32,-2.6 -2,-0.4 7,-0.1 -0.776 33.8 53.6-147.1-173.6 -21.0 9.0 23.7 77 81 A G E > S+D 43 0B 26 5,-0.3 3,-1.5 -2,-0.2 -34,-0.3 -0.285 77.1 72.0 71.5-166.3 -22.4 7.7 27.0 78 82 A G T 3 S- 0 0 2 -36,-1.5 -37,-0.7 1,-0.3 -1,-0.2 -0.315 122.0 -21.5 66.9-135.3 -20.8 4.8 28.7 79 83 A P T 3 S+ 0 0 39 0, 0.0 -1,-0.3 0, 0.0 2,-0.1 0.551 115.9 105.3 -80.5 -12.9 -17.4 5.5 30.2 80 84 A L < - 0 0 10 -3,-1.5 2,-0.5 -39,-0.1 -3,-0.2 -0.270 58.8-151.1 -77.1 150.3 -17.0 8.5 28.0 81 85 A D - 0 0 123 53,-0.1 2,-0.1 -5,-0.1 -3,-0.0 -0.990 68.7 -10.6-121.9 109.2 -17.3 12.3 28.8 82 86 A G S S- 0 0 48 -2,-0.5 2,-0.3 38,-0.0 -5,-0.3 -0.328 100.1 -40.0 91.9-175.9 -18.5 14.3 25.7 83 87 A T - 0 0 36 -7,-0.1 38,-1.7 -2,-0.1 2,-0.4 -0.695 44.3-164.3 -91.3 139.4 -18.9 13.4 22.0 84 88 A Y E -HI 75 120B 5 -9,-1.4 -9,-3.0 -2,-0.3 2,-0.4 -0.993 14.3-139.7-125.0 128.6 -16.5 11.3 20.0 85 89 A R E -HI 74 119B 43 34,-2.0 34,-1.2 -2,-0.4 2,-0.4 -0.807 15.0-120.6 -98.5 136.0 -16.6 11.2 16.2 86 90 A L E + I 0 118B 3 -13,-2.1 -13,-0.2 -2,-0.4 32,-0.2 -0.475 39.3 160.7 -72.6 117.7 -16.1 8.2 13.9 87 91 A I E - 0 0 36 30,-2.4 -21,-2.6 1,-0.4 2,-0.3 0.745 61.1 -22.2-106.7 -40.7 -13.2 8.8 11.7 88 92 A Q E -GI 65 117B 32 29,-1.0 29,-3.1 -23,-0.3 -1,-0.4 -0.978 47.1-146.0-166.4 164.0 -12.3 5.2 10.5 89 93 A F E +GI 64 116B 0 -25,-1.9 -25,-2.4 -2,-0.3 2,-0.3 -0.947 20.2 165.6-136.3 151.2 -12.6 1.5 11.2 90 94 A H E - I 0 115B 16 25,-1.7 25,-3.2 -2,-0.3 2,-0.3 -0.925 21.7-126.9-154.5 171.9 -10.2 -1.4 10.5 91 95 A F E - I 0 114B 0 -29,-0.5 2,-0.4 -2,-0.3 23,-0.2 -0.773 1.0-148.9-125.8 171.7 -9.7 -5.0 11.4 92 96 A H E + I 0 113B 5 21,-1.1 21,-1.9 -2,-0.3 2,-0.3 -0.966 29.2 172.5-140.1 116.1 -7.0 -7.4 12.7 93 97 A W E - I 0 112B 0 -2,-0.4 146,-1.3 19,-0.2 145,-0.6 -0.791 21.2-126.3-129.2 167.9 -7.2 -11.0 11.5 94 98 A G - 0 0 0 17,-1.2 6,-0.1 5,-0.7 3,-0.1 -0.450 24.7-115.8-105.1-180.0 -5.1 -14.2 11.7 95 99 A S S S+ 0 0 38 -2,-0.2 2,-0.3 142,-0.1 5,-0.1 0.727 107.0 27.4 -85.6 -25.9 -3.6 -16.7 9.3 96 100 A L S > S- 0 0 105 3,-0.2 3,-1.0 15,-0.1 -2,-0.3 -0.807 91.1-107.7-128.4 167.2 -5.9 -19.3 10.9 97 101 A D T 3 S+ 0 0 74 -2,-0.3 48,-0.2 1,-0.2 15,-0.1 0.582 110.9 72.4 -74.7 -8.1 -9.3 -19.0 12.7 98 102 A G T 3 S+ 0 0 57 13,-0.1 2,-0.3 2,-0.1 11,-0.2 0.475 106.4 24.0 -85.4 -6.3 -7.5 -19.7 16.0 99 103 A Q < + 0 0 52 -3,-1.0 -5,-0.7 12,-0.1 -3,-0.2 -0.958 65.2 103.2-153.6 161.6 -5.9 -16.3 16.2 100 104 A G + 0 0 0 1,-0.6 13,-0.3 -2,-0.3 11,-0.2 -0.040 57.2 101.6 149.9 -34.0 -6.4 -12.7 14.8 101 105 A S - 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