==== 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 1RZB . 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) . 11828.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 165 64.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 16 6.2 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 . 37 14.3 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 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 RESIDUES PER ALPHA HELIX . 0 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 3 A H 0 0 225 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-133.4 13.7 -0.8 8.9 2 4 A H - 0 0 115 1,-0.1 0, 0.0 0, 0.0 0, 0.0 -0.482 360.0 -98.5 -84.7 151.2 10.0 0.3 9.1 3 5 A W + 0 0 32 -2,-0.2 2,-0.3 11,-0.1 7,-0.2 -0.223 57.3 136.1 -61.7 152.0 7.7 -1.6 11.5 4 6 A G - 0 0 11 5,-2.4 10,-0.1 2,-0.2 58,-0.1 -0.788 63.9 -84.0-166.9-152.0 5.4 -4.4 10.4 5 7 A Y S S+ 0 0 34 -2,-0.3 5,-0.2 5,-0.2 237,-0.1 0.101 83.7 110.2-122.4 19.6 4.4 -7.8 11.6 6 8 A G S > S- 0 0 39 4,-0.1 4,-1.6 1,-0.1 3,-0.3 -0.287 84.4 -96.0 -86.4-178.5 7.3 -9.9 10.3 7 9 A K T 4 S+ 0 0 147 1,-0.2 -1,-0.1 2,-0.2 5,-0.0 0.819 122.3 42.6 -64.6 -34.0 10.1 -11.6 12.2 8 10 A H T 4 S+ 0 0 161 1,-0.1 -1,-0.2 4,-0.0 -5,-0.0 0.655 130.0 22.0 -94.1 -10.8 12.5 -8.8 11.7 9 11 A N T 4 S+ 0 0 51 -3,-0.3 -5,-2.4 -6,-0.1 -2,-0.2 0.284 93.6 128.6-137.1 15.3 10.2 -5.8 12.3 10 12 A G S >X S- 0 0 0 -4,-1.6 3,-2.8 -7,-0.2 4,-0.7 0.153 78.2 -74.3 -69.1 178.9 7.4 -7.3 14.4 11 13 A P G >4 S+ 0 0 27 0, 0.0 3,-0.7 0, 0.0 4,-0.4 0.765 125.7 64.1 -49.8 -32.3 5.9 -6.1 17.6 12 14 A E G 34 S+ 0 0 101 1,-0.3 3,-0.1 2,-0.1 -5,-0.0 0.695 106.7 44.4 -70.3 -11.5 8.9 -7.3 19.7 13 15 A H G X> S+ 0 0 48 -3,-2.8 3,-1.8 1,-0.1 4,-0.6 0.557 85.4 91.9-104.6 -13.6 11.1 -4.8 17.9 14 16 A W H XX S+ 0 0 4 -3,-0.7 4,-2.4 -4,-0.7 3,-0.8 0.790 72.3 70.7 -55.5 -32.0 8.8 -1.7 18.0 15 17 A H H 34 S+ 0 0 65 -4,-0.4 -1,-0.3 1,-0.2 7,-0.1 0.747 87.1 66.6 -57.7 -27.5 10.2 -0.4 21.3 16 18 A K H <4 S+ 0 0 136 -3,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.905 117.4 24.0 -65.4 -38.0 13.5 0.5 19.5 17 19 A D H << S+ 0 0 108 -3,-0.8 -2,-0.2 -4,-0.6 -1,-0.2 0.710 135.2 36.0 -95.8 -26.7 11.8 3.2 17.4 18 20 A F >< - 0 0 59 -4,-2.4 3,-2.4 1,-0.1 -1,-0.2 -0.795 63.9-176.2-130.7 85.7 8.8 3.8 19.8 19 21 A P G > S+ 0 0 100 0, 0.0 3,-2.2 0, 0.0 -4,-0.1 0.721 77.8 75.6 -57.1 -25.2 9.9 3.6 23.4 20 22 A I G > S+ 0 0 59 1,-0.3 3,-2.5 2,-0.2 -5,-0.1 0.627 71.5 88.7 -63.4 -10.8 6.4 4.1 24.6 21 23 A A G < S+ 0 0 6 -3,-2.4 -1,-0.3 1,-0.3 -6,-0.1 0.708 90.6 45.0 -56.3 -24.0 5.9 0.5 23.5 22 24 A K G < S+ 0 0 136 -3,-2.2 -1,-0.3 -7,-0.1 -2,-0.2 0.018 94.5 133.9-108.3 25.6 7.0 -0.5 27.0 23 25 A G X - 0 0 16 -3,-2.5 3,-0.5 1,-0.1 -3,-0.0 0.044 69.7-106.5 -67.2 175.5 4.7 2.2 28.6 24 26 A E T 3 S+ 0 0 118 1,-0.2 226,-0.3 225,-0.1 -1,-0.1 0.524 112.3 41.1 -83.1 -12.1 2.4 1.9 31.6 25 27 A R T 3 S+ 0 0 46 224,-0.1 -1,-0.2 2,-0.0 2,-0.2 -0.250 79.1 151.2-136.5 54.4 -0.9 1.9 29.6 26 28 A Q < - 0 0 3 -3,-0.5 220,-0.1 221,-0.3 170,-0.1 -0.453 33.1-103.3 -87.4 150.9 -0.2 -0.2 26.5 27 29 A S S S+ 0 0 0 168,-0.5 2,-0.2 -2,-0.2 -2,-0.0 -0.878 75.3 41.8-125.7 161.5 -2.8 -2.2 24.6 28 30 A P + 0 0 0 0, 0.0 218,-2.9 0, 0.0 2,-0.3 0.632 65.2 177.6 -77.2-177.1 -4.1 -4.7 23.8 29 31 A V - 0 0 1 216,-0.3 77,-1.2 -2,-0.2 2,-0.4 -0.904 35.4 -99.9-139.9 163.8 -4.5 -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 -0.766 34.4-136.9 -83.5 135.4 -6.0 -10.0 28.2 31 33 A I E -a 107 0A 0 75,-3.1 77,-3.0 -2,-0.4 2,-0.8 -0.877 12.2-158.9 -98.2 109.1 -9.5 -9.5 29.8 32 34 A D >> - 0 0 63 -2,-0.8 3,-1.1 75,-0.2 4,-1.1 -0.860 4.6-159.6 -86.7 109.2 -9.7 -11.7 32.9 33 35 A T T 34 S+ 0 0 48 -2,-0.8 -1,-0.1 1,-0.3 222,-0.0 0.715 86.3 52.7 -66.4 -24.0 -13.4 -11.9 33.4 34 36 A H T 34 S+ 0 0 162 1,-0.2 -1,-0.3 -3,-0.0 -2,-0.0 0.508 112.6 43.8 -90.3 -6.9 -13.3 -12.9 37.0 35 37 A T T <4 S+ 0 0 106 -3,-1.1 -2,-0.2 2,-0.1 218,-0.2 0.530 86.6 105.7-111.4 -13.0 -11.1 -9.9 38.0 36 38 A A S < S- 0 0 19 -4,-1.1 2,-0.6 216,-0.1 218,-0.2 -0.535 71.7-129.1 -67.1 139.6 -13.0 -7.3 36.0 37 39 A K E -c 254 0B 119 216,-2.1 218,-2.7 -2,-0.2 2,-0.3 -0.828 8.8-132.7 -97.8 118.0 -15.0 -5.1 38.3 38 40 A Y E -c 255 0B 78 -2,-0.6 218,-0.2 216,-0.2 220,-0.1 -0.578 24.6-162.8 -63.4 130.4 -18.7 -4.6 37.6 39 41 A D > - 0 0 26 216,-2.6 3,-1.7 -2,-0.3 -1,-0.1 -0.940 13.6-166.6-125.2 108.5 -19.2 -0.8 37.9 40 42 A P T 3 S+ 0 0 100 0, 0.0 -1,-0.1 0, 0.0 216,-0.1 0.590 84.3 68.9 -68.6 -11.6 -22.9 0.3 38.3 41 43 A S T 3 S+ 0 0 82 2,-0.1 2,-0.4 40,-0.0 215,-0.1 0.546 74.5 102.4 -83.8 -11.7 -22.0 3.9 37.6 42 44 A L < - 0 0 28 -3,-1.7 3,-0.1 213,-0.2 -3,-0.0 -0.686 67.7-139.9 -77.3 133.2 -21.1 3.2 34.0 43 45 A K - 0 0 116 37,-0.9 39,-0.1 -2,-0.4 -2,-0.1 -0.340 26.9 -89.5 -86.3 161.3 -23.8 4.3 31.6 44 46 A P - 0 0 109 0, 0.0 36,-1.8 0, 0.0 2,-0.2 -0.391 50.6-102.6 -65.4 150.1 -25.0 2.4 28.5 45 47 A L E -D 79 0B 17 141,-0.3 2,-0.5 34,-0.3 34,-0.2 -0.535 26.7-147.0 -72.8 154.7 -23.2 3.3 25.3 46 48 A S E -D 78 0B 51 32,-2.7 32,-2.3 -2,-0.2 2,-0.6 -0.983 15.8-175.6-126.7 108.0 -24.9 5.6 22.9 47 49 A V E -D 77 0B 35 -2,-0.5 2,-0.7 30,-0.2 30,-0.2 -0.962 3.8-179.2-105.6 110.1 -24.0 4.8 19.2 48 50 A S E +D 76 0B 35 28,-3.0 28,-2.2 -2,-0.6 3,-0.2 -0.855 25.1 141.2-114.4 94.7 -25.5 7.3 16.7 49 51 A Y > + 0 0 3 -2,-0.7 3,-1.4 26,-0.2 130,-0.2 0.156 34.7 106.8-113.4 13.2 -24.4 6.1 13.3 50 52 A D T 3 S+ 0 0 105 1,-0.3 -1,-0.1 -3,-0.1 25,-0.1 0.805 87.1 43.0 -66.7 -25.1 -27.6 6.8 11.3 51 53 A Q T 3 S+ 0 0 128 23,-0.8 -1,-0.3 -3,-0.2 24,-0.2 0.261 84.1 145.2-102.0 10.0 -26.0 9.9 9.6 52 54 A A < - 0 0 24 -3,-1.4 2,-0.5 22,-0.2 123,-0.1 -0.081 33.4-160.2 -49.6 133.7 -22.7 8.1 8.9 53 55 A T - 0 0 48 16,-0.3 16,-2.8 122,-0.1 2,-0.2 -0.874 3.4-163.6-121.2 103.4 -21.0 9.1 5.7 54 56 A S E +E 68 0B 0 -2,-0.5 121,-0.6 122,-0.3 14,-0.3 -0.478 11.9 174.3 -82.8 151.3 -18.3 6.6 4.4 55 57 A L E - 0 0 79 12,-3.3 118,-2.0 1,-0.4 2,-0.3 0.674 50.6 -10.1-122.9 -41.2 -16.0 8.0 1.8 56 58 A R E -EF 67 172B 88 11,-1.1 11,-2.8 116,-0.3 -1,-0.4 -0.995 45.0-133.7-159.8 160.9 -13.2 5.5 0.9 57 59 A I E -EF 66 171B 0 114,-2.9 114,-2.6 -2,-0.3 2,-0.4 -0.981 28.6-172.8-124.4 138.4 -11.4 2.3 1.6 58 60 A L E -EF 65 170B 30 7,-2.2 7,-2.5 -2,-0.4 2,-0.8 -0.995 27.3-141.5-135.4 139.2 -7.6 2.2 1.7 59 61 A N E +E 64 0B 0 110,-3.0 109,-2.9 -2,-0.4 5,-0.2 -0.837 23.1 179.9 -92.5 111.5 -4.9 -0.4 2.0 60 62 A N - 0 0 32 3,-2.0 -1,-0.1 -2,-0.8 4,-0.1 0.299 52.8-101.5 -98.9 7.4 -2.3 1.4 4.2 61 63 A G S S+ 0 0 14 2,-0.5 3,-0.1 166,-0.2 106,-0.1 0.319 116.6 55.0 92.8 -11.1 0.1 -1.5 4.2 62 64 A H S S- 0 0 46 1,-0.6 2,-0.3 -58,-0.1 -1,-0.1 0.522 124.1 -29.3-124.9 -19.4 -0.8 -2.7 7.7 63 65 A A S S- 0 0 2 -5,-0.1 -3,-2.0 164,-0.1 -1,-0.6 -0.884 71.9 -87.4-167.9-168.2 -4.6 -3.2 7.4 64 66 A F E -E 59 0B 0 -2,-0.3 2,-0.4 -5,-0.2 29,-0.4 -0.973 36.4-156.6-118.8 131.3 -7.5 -1.7 5.4 65 67 A N E -E 58 0B 18 -7,-2.5 -7,-2.2 -2,-0.4 2,-0.6 -0.951 9.4-153.8-108.6 137.2 -9.3 1.4 6.7 66 68 A V E -EG 57 91B 0 25,-2.7 25,-1.8 -2,-0.4 2,-0.3 -0.945 27.3-152.8-100.0 127.8 -12.8 2.5 5.8 67 69 A E E -EG 56 90B 48 -11,-2.8 -12,-3.3 -2,-0.6 -11,-1.1 -0.764 9.6-160.0-109.4 147.9 -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 -0.825 32.5 -98.0-120.3 158.6 -15.8 8.5 7.1 69 71 A D + 0 0 40 -16,-2.8 -16,-0.3 -2,-0.3 5,-0.2 -0.702 40.5 175.1 -76.2 120.1 -16.4 12.2 6.8 70 72 A D + 0 0 42 -2,-0.7 -1,-0.1 1,-0.1 17,-0.1 -0.068 46.2 108.4-114.4 26.2 -15.7 13.6 10.3 71 73 A S S S+ 0 0 77 56,-0.0 2,-0.3 2,-0.0 -1,-0.1 0.542 88.4 18.0 -79.7 -8.7 -16.1 17.3 9.5 72 74 A Q S S- 0 0 116 -3,-0.2 2,-2.2 3,-0.1 3,-0.4 -0.937 100.0 -80.2-153.1 167.2 -19.4 17.3 11.6 73 75 A D S S+ 0 0 88 -2,-0.3 3,-0.2 1,-0.2 -3,-0.1 -0.402 77.8 127.1 -74.7 68.6 -21.2 15.3 14.2 74 76 A K S S+ 0 0 51 -2,-2.2 -23,-0.8 1,-0.3 2,-0.5 0.881 74.5 23.0 -91.7 -51.5 -22.6 12.7 11.8 75 77 A A S S+ 0 0 5 -3,-0.4 13,-2.8 13,-0.2 2,-0.3 -0.978 85.2 165.8-122.0 112.0 -21.5 9.3 13.4 76 78 A V E -DH 48 87B 8 -28,-2.2 -28,-3.0 -2,-0.5 2,-0.4 -0.910 30.1-153.0-133.3 159.9 -20.8 9.7 17.1 77 79 A L E +DH 47 86B 0 9,-2.5 9,-2.2 -2,-0.3 2,-0.3 -0.982 28.4 150.0-124.2 137.7 -20.2 7.7 20.2 78 80 A K E +D 46 0B 68 -32,-2.3 -32,-2.7 -2,-0.4 2,-0.1 -0.925 36.9 45.8-154.1 179.2 -21.1 9.0 23.7 79 81 A G E > S+D 45 0B 21 3,-0.4 3,-2.5 5,-0.4 -34,-0.3 -0.426 71.8 84.4 80.2-158.5 -22.1 7.7 27.1 80 82 A G T 3 S- 0 0 0 -36,-1.8 -37,-0.9 1,-0.3 -1,-0.1 -0.350 121.2 -26.2 59.0-138.5 -20.5 4.6 28.6 81 83 A P T 3 S+ 0 0 39 0, 0.0 -1,-0.3 0, 0.0 2,-0.2 0.352 115.7 111.3 -86.0 5.0 -17.3 5.8 30.4 82 84 A L < - 0 0 12 -3,-2.5 2,-0.5 -39,-0.1 -3,-0.4 -0.620 52.7-157.4 -90.3 149.7 -17.0 8.8 28.1 83 85 A D + 0 0 131 -2,-0.2 2,-0.1 53,-0.1 -3,-0.0 -0.976 69.2 4.6-113.9 122.3 -17.4 12.5 28.7 84 86 A G S S- 0 0 46 -2,-0.5 2,-0.4 39,-0.1 -5,-0.4 -0.437 97.6 -55.5 96.9 177.4 -18.2 14.5 25.5 85 87 A T - 0 0 33 -2,-0.1 38,-2.5 -7,-0.1 2,-0.5 -0.903 39.9-159.3-106.5 138.3 -18.8 13.4 22.0 86 88 A Y E -HI 77 122B 5 -9,-2.2 -9,-2.5 -2,-0.4 2,-0.4 -0.971 11.5-146.2-119.7 120.3 -16.5 11.3 19.9 87 89 A R E -HI 76 121B 45 34,-2.2 34,-1.9 -2,-0.5 2,-0.3 -0.729 19.9-117.5 -88.7 138.6 -16.8 11.4 16.1 88 90 A L E + I 0 120B 2 -13,-2.8 32,-0.2 -2,-0.4 -13,-0.2 -0.564 36.9 167.7 -73.4 132.2 -16.1 8.2 14.0 89 91 A I E - 0 0 34 30,-2.4 -21,-2.8 1,-0.4 2,-0.3 0.674 60.8 -22.4-112.3 -43.3 -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 -0.990 46.6-145.1-159.7 165.4 -12.4 5.2 10.5 91 93 A F E +GI 66 118B 0 -25,-1.8 -25,-2.7 -2,-0.3 2,-0.3 -0.961 23.2 163.9-129.3 157.6 -12.7 1.4 11.2 92 94 A H E - I 0 117B 23 25,-1.8 25,-3.0 -2,-0.3 2,-0.3 -0.910 23.9-125.3-159.1 171.0 -10.3 -1.4 10.4 93 95 A F E - I 0 116B 0 -29,-0.4 2,-0.4 -2,-0.3 -29,-0.2 -0.788 0.8-149.1-124.5 163.9 -9.6 -5.0 11.4 94 96 A H E + I 0 115B 2 21,-1.6 21,-2.1 -2,-0.3 2,-0.3 -0.967 32.3 170.6-124.0 134.2 -6.8 -7.2 12.8 95 97 A W E - I 0 114B 0 -2,-0.4 146,-1.3 19,-0.2 145,-0.5 -0.921 23.3-120.7-148.2 171.6 -6.9 -10.9 11.6 96 98 A G - 0 0 0 17,-1.2 6,-0.1 5,-0.6 3,-0.1 -0.460 22.7-121.7-113.2 173.7 -5.0 -14.1 11.6 97 99 A S S S+ 0 0 44 -2,-0.2 2,-0.3 142,-0.2 5,-0.1 0.573 104.8 32.7 -83.3 -17.8 -3.5 -16.6 9.2 98 100 A L S > S- 0 0 110 3,-0.2 3,-1.7 15,-0.1 -2,-0.2 -0.961 90.9-109.9-131.8 159.7 -5.7 -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 0.708 109.8 66.3 -65.7 -21.2 -9.1 -19.2 12.5 100 102 A G T 3 S+ 0 0 57 13,-0.1 2,-0.3 2,-0.1 -1,-0.3 0.342 107.2 35.1 -84.1 9.3 -7.6 -19.7 16.1 101 103 A Q < + 0 0 51 -3,-1.7 -5,-0.6 12,-0.1 -3,-0.2 -0.963 63.6 95.5-153.1 166.1 -5.8 -16.3 16.1 102 104 A G + 0 0 0 1,-0.6 13,-0.3 -2,-0.3 11,-0.2 -0.008 56.8 104.5 143.0 -37.5 -6.3 -12.8 14.9 103 105 A S - 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