==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE(OXO-ACID) 25-MAY-93 1RZD . COMPND 2 MOLECULE: CARBONIC ANHYDRASE II; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR K.HAKANSSON,A.WEHNERT,A.LILJAS . 258 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11835.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 168 65.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 19 7.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 56 21.7 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 2 0.8 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 . 25 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 14.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 17 6.6 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 3 A H 0 0 225 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-138.5 13.7 -0.8 9.0 2 4 A H - 0 0 114 1,-0.1 0, 0.0 0, 0.0 0, 0.0 -0.387 360.0-100.9 -78.2 150.2 10.0 0.2 9.0 3 5 A W + 0 0 31 -2,-0.1 2,-0.2 1,-0.1 7,-0.2 -0.215 57.1 134.2 -62.0 155.7 7.7 -1.6 11.4 4 6 A G - 0 0 12 5,-2.4 10,-0.1 2,-0.2 -1,-0.1 -0.781 65.3 -79.9-173.4-150.9 5.4 -4.4 10.4 5 7 A Y S S+ 0 0 34 -2,-0.2 5,-0.2 5,-0.2 237,-0.1 0.170 84.1 109.9-122.7 19.2 4.5 -7.8 11.7 6 8 A G S > S- 0 0 36 4,-0.1 4,-1.5 1,-0.0 3,-0.2 -0.199 83.6 -95.0 -86.7-178.6 7.4 -9.9 10.4 7 9 A K T 4 S+ 0 0 139 1,-0.2 -1,-0.0 2,-0.2 5,-0.0 0.861 123.2 40.6 -66.1 -35.5 10.3 -11.6 12.3 8 10 A H T 4 S+ 0 0 158 1,-0.1 -1,-0.2 4,-0.0 -5,-0.0 0.696 130.6 22.5 -93.8 -10.0 12.6 -8.7 11.7 9 11 A N T 4 S+ 0 0 53 -3,-0.2 -5,-2.4 -6,-0.0 -2,-0.2 0.226 93.9 128.6-138.1 16.8 10.3 -5.7 12.2 10 12 A G S >X S- 0 0 0 -4,-1.5 3,-2.6 -7,-0.2 4,-0.7 0.173 78.6 -74.9 -73.6 179.5 7.5 -7.2 14.4 11 13 A P G >4 S+ 0 0 25 0, 0.0 3,-0.8 0, 0.0 4,-0.4 0.780 125.7 62.9 -50.8 -33.2 5.9 -6.2 17.6 12 14 A E G 34 S+ 0 0 99 1,-0.2 3,-0.1 2,-0.1 -5,-0.0 0.660 107.1 45.1 -68.5 -13.4 9.0 -7.3 19.7 13 15 A H G X> S+ 0 0 49 -3,-2.6 3,-1.4 1,-0.1 4,-0.5 0.552 85.3 91.9-102.1 -13.3 11.1 -4.8 17.9 14 16 A W H XX S+ 0 0 5 -3,-0.8 4,-2.4 -4,-0.7 3,-0.8 0.801 72.0 70.2 -58.2 -33.3 8.8 -1.7 18.0 15 17 A H H 34 S+ 0 0 63 -4,-0.4 -1,-0.2 1,-0.2 7,-0.1 0.796 87.3 67.3 -56.6 -27.5 10.2 -0.3 21.3 16 18 A K H <4 S+ 0 0 133 -3,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.906 118.1 22.4 -64.0 -39.7 13.5 0.6 19.5 17 19 A D H << S+ 0 0 110 -3,-0.8 -1,-0.2 -4,-0.5 -2,-0.2 0.735 136.4 36.4 -95.1 -26.7 11.7 3.3 17.4 18 20 A F >< - 0 0 60 -4,-2.4 3,-2.6 1,-0.1 -1,-0.2 -0.814 63.5-177.9-131.4 81.8 8.7 3.8 19.8 19 21 A P G > S+ 0 0 102 0, 0.0 3,-2.1 0, 0.0 -4,-0.1 0.710 77.5 76.4 -55.4 -23.4 9.9 3.6 23.4 20 22 A I G > S+ 0 0 56 1,-0.3 3,-2.6 2,-0.2 -5,-0.1 0.704 70.9 88.3 -63.9 -12.5 6.3 4.1 24.5 21 23 A A G < S+ 0 0 5 -3,-2.6 -1,-0.3 1,-0.3 -6,-0.1 0.733 91.3 44.1 -54.5 -23.9 5.9 0.5 23.5 22 24 A K G < S+ 0 0 140 -3,-2.1 -1,-0.3 -7,-0.1 -2,-0.2 0.044 93.2 131.0-112.2 26.8 6.9 -0.4 27.0 23 25 A G S < S- 0 0 16 -3,-2.6 3,-0.5 1,-0.1 -3,-0.0 -0.003 70.7-104.8 -69.1 178.4 4.7 2.2 28.6 24 26 A E S S+ 0 0 117 1,-0.2 226,-0.3 225,-0.1 -1,-0.1 0.394 112.1 42.2 -85.8 -11.5 2.3 1.8 31.5 25 27 A R S S+ 0 0 47 224,-0.1 -1,-0.2 2,-0.1 2,-0.1 -0.250 78.8 149.5-136.9 52.0 -0.9 1.9 29.6 26 28 A Q - 0 0 4 -3,-0.5 220,-0.1 221,-0.3 170,-0.1 -0.447 34.5-103.4 -85.8 150.7 -0.3 -0.2 26.5 27 29 A S S S+ 0 0 0 168,-0.4 2,-0.2 -2,-0.1 -2,-0.1 -0.887 75.4 44.1-126.7 160.6 -2.9 -2.2 24.6 28 30 A P + 0 0 0 0, 0.0 218,-2.9 0, 0.0 2,-0.3 0.672 64.3 179.2 -81.8 177.9 -4.1 -4.8 23.9 29 31 A V - 0 0 1 216,-0.3 77,-1.1 -2,-0.2 2,-0.5 -0.860 34.9-103.3-130.7 164.2 -4.6 -6.7 27.1 30 32 A D E -a 106 0A 35 216,-0.4 2,-0.8 -2,-0.3 77,-0.2 -0.782 34.4-137.0 -86.8 130.3 -6.1 -10.0 28.2 31 33 A I E -a 107 0A 0 75,-3.2 77,-3.0 -2,-0.5 2,-0.9 -0.845 12.4-159.3 -94.4 109.7 -9.5 -9.5 29.8 32 34 A D >> - 0 0 63 -2,-0.8 4,-1.1 75,-0.2 3,-0.9 -0.800 4.2-161.0 -87.9 106.8 -9.7 -11.7 32.9 33 35 A T T 34 S+ 0 0 47 -2,-0.9 -1,-0.1 1,-0.3 222,-0.0 0.775 85.1 55.8 -65.8 -24.6 -13.5 -11.9 33.4 34 36 A H T 34 S+ 0 0 161 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.0 0.742 113.0 41.8 -82.3 -18.8 -13.3 -13.0 37.0 35 37 A T T <4 S+ 0 0 99 -3,-0.9 218,-0.2 2,-0.1 2,-0.2 0.468 85.4 105.4-102.8 -12.3 -11.2 -9.9 38.0 36 38 A A S < S- 0 0 19 -4,-1.1 2,-0.5 216,-0.1 218,-0.2 -0.557 71.3-130.6 -66.4 137.3 -13.1 -7.2 35.9 37 39 A K E -c 254 0B 117 216,-2.2 218,-2.8 -2,-0.2 2,-0.3 -0.839 9.5-127.9 -97.9 127.0 -15.1 -5.1 38.4 38 40 A Y E -c 255 0B 82 -2,-0.5 218,-0.2 216,-0.2 220,-0.1 -0.593 24.5-162.4 -68.3 130.4 -18.8 -4.5 37.7 39 41 A D > - 0 0 29 216,-2.3 3,-1.9 -2,-0.3 -1,-0.0 -0.924 11.5-167.5-123.1 107.4 -19.3 -0.6 37.9 40 42 A P T 3 S+ 0 0 101 0, 0.0 -1,-0.1 0, 0.0 216,-0.0 0.605 85.1 66.4 -69.1 -12.8 -23.0 0.4 38.3 41 43 A S T 3 S+ 0 0 83 2,-0.1 2,-0.3 40,-0.0 215,-0.1 0.461 75.5 103.9 -87.7 -6.7 -22.2 4.0 37.6 42 44 A L < - 0 0 30 -3,-1.9 3,-0.1 213,-0.2 213,-0.0 -0.689 68.2-137.8 -77.2 141.3 -21.1 3.2 34.0 43 45 A K - 0 0 122 37,-1.0 39,-0.1 -2,-0.3 -2,-0.1 -0.440 24.8 -89.4 -95.4 161.8 -23.9 4.4 31.6 44 46 A P - 0 0 111 0, 0.0 36,-1.6 0, 0.0 2,-0.2 -0.374 50.5-104.7 -64.8 148.3 -25.2 2.5 28.5 45 47 A L E -D 79 0B 16 141,-0.3 2,-0.5 34,-0.3 34,-0.2 -0.555 26.4-147.7 -72.5 153.5 -23.3 3.3 25.4 46 48 A S E -D 78 0B 50 32,-2.5 32,-2.4 -2,-0.2 2,-0.5 -0.987 15.8-176.5-126.8 109.8 -24.9 5.6 22.9 47 49 A V E -D 77 0B 36 -2,-0.5 2,-0.6 30,-0.2 30,-0.2 -0.976 3.6-179.3-107.3 114.4 -24.0 4.8 19.3 48 50 A S E +D 76 0B 36 28,-2.9 28,-1.8 -2,-0.5 3,-0.1 -0.874 25.3 140.6-120.3 95.1 -25.5 7.3 16.6 49 51 A Y > + 0 0 3 -2,-0.6 3,-1.2 26,-0.2 130,-0.2 0.170 35.0 107.2-115.9 12.1 -24.4 6.1 13.2 50 52 A D T 3 S+ 0 0 105 1,-0.3 -1,-0.1 127,-0.1 25,-0.1 0.788 87.6 42.2 -65.6 -24.4 -27.7 6.8 11.3 51 53 A Q T 3 S+ 0 0 126 23,-0.8 -1,-0.3 -3,-0.1 24,-0.2 0.309 84.4 145.3-104.1 9.1 -26.1 9.8 9.6 52 54 A A < - 0 0 22 -3,-1.2 2,-0.5 22,-0.2 -3,-0.1 -0.052 33.4-159.7 -47.9 132.8 -22.7 8.1 8.9 53 55 A T - 0 0 48 16,-0.3 16,-2.9 122,-0.1 2,-0.2 -0.876 4.2-165.0-120.3 104.5 -20.9 9.1 5.7 54 56 A S E +E 68 0B 1 -2,-0.5 121,-0.6 122,-0.3 14,-0.3 -0.505 11.1 174.3 -83.4 150.4 -18.3 6.6 4.5 55 57 A L E - 0 0 77 12,-3.4 118,-2.1 1,-0.4 2,-0.3 0.681 50.2 -5.9-119.6 -40.5 -15.9 7.9 1.8 56 58 A R E -EF 67 172B 87 11,-1.2 11,-2.9 116,-0.3 -1,-0.4 -0.991 44.6-135.9-158.2 161.1 -13.2 5.6 1.0 57 59 A I E -EF 66 171B 0 114,-2.9 114,-2.3 -2,-0.3 2,-0.4 -0.981 28.2-174.3-126.4 139.7 -11.4 2.3 1.7 58 60 A L E -EF 65 170B 30 7,-2.2 7,-2.6 -2,-0.4 2,-0.7 -0.999 27.4-143.2-139.0 141.8 -7.6 2.2 1.7 59 61 A N E -E 64 0B 0 110,-2.8 109,-2.9 -2,-0.4 5,-0.2 -0.888 22.4-179.7 -97.5 110.8 -4.9 -0.5 2.0 60 62 A N - 0 0 32 3,-1.9 4,-0.1 -2,-0.7 -1,-0.1 0.222 53.8 -99.0 -98.8 11.5 -2.2 1.3 4.1 61 63 A G S S+ 0 0 12 2,-0.4 3,-0.1 166,-0.2 106,-0.1 0.317 117.7 53.1 91.6 -10.0 0.2 -1.6 4.2 62 64 A H S S- 0 0 45 1,-0.5 2,-0.3 -58,-0.1 166,-0.1 0.545 123.6 -25.8-128.5 -19.5 -0.8 -2.8 7.7 63 65 A A S S- 0 0 1 -5,-0.1 -3,-1.9 165,-0.1 -1,-0.5 -0.854 71.1 -90.7-166.1-166.2 -4.6 -3.2 7.4 64 66 A F E -E 59 0B 0 -2,-0.3 29,-0.5 29,-0.3 2,-0.4 -0.989 35.6-157.8-124.9 133.3 -7.5 -1.7 5.4 65 67 A N E -E 58 0B 19 -7,-2.6 -7,-2.2 -2,-0.4 2,-0.5 -0.943 10.3-153.6-111.1 136.0 -9.3 1.3 6.7 66 68 A V E -EG 57 91B 0 25,-2.3 25,-1.9 -2,-0.4 2,-0.3 -0.945 27.8-151.3 -97.9 128.1 -12.8 2.5 5.8 67 69 A E E -EG 56 90B 49 -11,-2.9 -12,-3.4 -2,-0.5 -11,-1.2 -0.793 9.2-157.7-108.0 148.1 -12.8 6.3 6.3 68 70 A F E -E 54 0B 8 21,-2.8 2,-0.7 -2,-0.3 -14,-0.2 -0.782 30.2-101.8-119.5 156.5 -15.7 8.5 7.2 69 71 A D + 0 0 40 -16,-2.9 -16,-0.3 -2,-0.3 5,-0.2 -0.725 39.1 174.6 -77.3 118.8 -16.4 12.2 6.9 70 72 A D + 0 0 42 -2,-0.7 -1,-0.1 1,-0.2 17,-0.1 -0.019 45.1 110.5-113.3 26.2 -15.7 13.6 10.4 71 73 A S S S+ 0 0 79 56,-0.0 2,-0.3 2,-0.0 -1,-0.2 0.608 88.4 17.0 -76.7 -8.3 -16.2 17.3 9.5 72 74 A Q S S- 0 0 113 -3,-0.2 2,-2.2 3,-0.1 3,-0.4 -0.943 100.4 -79.6-153.7 169.4 -19.4 17.3 11.6 73 75 A D S S+ 0 0 86 -2,-0.3 3,-0.2 1,-0.2 -22,-0.1 -0.317 77.0 128.5 -74.8 59.3 -21.2 15.3 14.2 74 76 A K S S+ 0 0 53 -2,-2.2 -23,-0.8 1,-0.3 2,-0.5 0.910 75.2 19.7 -81.6 -51.7 -22.6 12.7 11.8 75 77 A A S S+ 0 0 5 -3,-0.4 13,-2.7 13,-0.2 2,-0.3 -0.973 85.2 164.6-124.3 111.2 -21.6 9.3 13.4 76 78 A V E -DH 48 87B 7 -28,-1.8 -28,-2.9 -2,-0.5 2,-0.4 -0.886 30.2-150.6-129.4 161.3 -20.8 9.7 17.1 77 79 A L E +DH 47 86B 0 9,-2.8 9,-2.1 -2,-0.3 2,-0.3 -0.981 28.0 154.2-124.6 136.9 -20.3 7.7 20.2 78 80 A K E +D 46 0B 71 -32,-2.4 -32,-2.5 -2,-0.4 7,-0.1 -0.927 38.0 40.5-152.0 175.4 -21.1 9.1 23.7 79 81 A G E > S+D 45 0B 21 5,-0.4 3,-2.4 3,-0.3 -34,-0.3 -0.398 71.4 87.9 79.9-156.4 -22.1 7.7 27.1 80 82 A G T 3 S- 0 0 0 -36,-1.6 -37,-1.0 1,-0.3 -1,-0.1 -0.421 121.6 -27.1 61.7-138.2 -20.5 4.5 28.6 81 83 A P T 3 S+ 0 0 41 0, 0.0 -1,-0.3 0, 0.0 2,-0.2 0.319 116.8 112.1 -87.9 7.2 -17.4 5.7 30.4 82 84 A L < - 0 0 12 -3,-2.4 2,-0.4 -39,-0.1 -3,-0.3 -0.571 52.7-157.3 -89.9 151.1 -17.1 8.8 28.1 83 85 A D + 0 0 129 -2,-0.2 2,-0.0 53,-0.1 -3,-0.0 -0.965 69.5 1.8-111.9 131.3 -17.5 12.5 28.8 84 86 A G S S- 0 0 49 -2,-0.4 2,-0.4 38,-0.1 -5,-0.4 -0.293 98.6 -53.6 87.2 179.6 -18.3 14.5 25.6 85 87 A T - 0 0 31 -7,-0.1 38,-2.9 -9,-0.0 2,-0.5 -0.858 39.3-159.2-108.8 139.3 -18.8 13.4 22.1 86 88 A Y E -HI 77 122B 6 -9,-2.1 -9,-2.8 -2,-0.4 2,-0.4 -0.967 11.3-146.3-119.8 125.8 -16.5 11.3 20.0 87 89 A R E -HI 76 121B 44 34,-2.2 34,-2.0 -2,-0.5 2,-0.3 -0.794 19.8-118.3 -93.2 137.4 -16.8 11.3 16.2 88 90 A L E + I 0 120B 2 -13,-2.7 32,-0.3 -2,-0.4 -13,-0.2 -0.552 36.0 168.2 -74.3 132.9 -16.0 8.2 14.1 89 91 A I E - 0 0 34 30,-2.4 -21,-2.8 1,-0.4 2,-0.3 0.672 60.6 -20.4-111.1 -41.0 -13.1 8.8 11.7 90 92 A Q E -GI 67 119B 32 29,-1.2 29,-3.0 -23,-0.2 -1,-0.4 -0.991 47.6-144.2-162.6 160.9 -12.4 5.2 10.5 91 93 A F E +GI 66 118B 0 -25,-1.9 -25,-2.3 -2,-0.3 2,-0.3 -0.963 23.6 164.8-126.6 159.1 -12.8 1.5 11.2 92 94 A H E - I 0 117B 24 25,-2.1 25,-3.2 -2,-0.3 2,-0.3 -0.934 22.8-126.4-160.1 171.6 -10.3 -1.4 10.4 93 95 A F E - I 0 116B 0 -29,-0.5 2,-0.4 -2,-0.3 -29,-0.3 -0.874 2.0-152.6-126.2 161.8 -9.6 -5.0 11.4 94 96 A H E + I 0 115B 2 21,-1.9 21,-2.3 -2,-0.3 2,-0.3 -0.974 31.8 168.5-126.5 135.3 -6.8 -7.2 12.8 95 97 A W E - I 0 114B 0 -2,-0.4 146,-1.1 19,-0.2 145,-0.8 -0.914 24.1-117.1-147.3 173.6 -7.0 -10.9 11.7 96 98 A G - 0 0 0 17,-1.3 6,-0.1 5,-0.6 3,-0.1 -0.416 22.1-122.7-111.5 175.4 -5.1 -14.1 11.6 97 99 A S S S+ 0 0 44 142,-0.1 2,-0.3 -2,-0.1 5,-0.1 0.600 105.3 31.9 -87.4 -13.0 -3.6 -16.6 9.2 98 100 A L S > S- 0 0 107 3,-0.2 3,-2.0 15,-0.1 -2,-0.2 -0.961 90.0-110.8-134.1 156.1 -5.8 -19.3 10.9 99 101 A D T 3 S+ 0 0 70 -2,-0.3 48,-0.2 1,-0.3 15,-0.1 0.741 109.6 67.5 -66.1 -18.6 -9.2 -19.1 12.6 100 102 A G T 3 S+ 0 0 57 13,-0.1 2,-0.3 2,-0.1 -1,-0.3 0.418 107.1 32.0 -84.7 6.6 -7.7 -19.7 16.0 101 103 A Q < + 0 0 51 -3,-2.0 -5,-0.6 12,-0.2 -3,-0.2 -0.966 64.7 95.8-151.8 168.7 -5.9 -16.4 16.2 102 104 A G + 0 0 0 1,-0.5 13,-0.3 -2,-0.3 11,-0.2 0.065 55.9 104.8 140.2 -35.2 -6.3 -12.8 14.9 103 105 A S - 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