==== 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 8CA2 . 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) . 11561.0 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 . 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 . 23 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 35 13.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 16 6.3 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 0 117 0, 0.0 2,-0.2 0, 0.0 7,-0.2 0.000 360.0 360.0 360.0 136.3 7.7 -1.5 11.4 2 6 A G - 0 0 11 5,-2.7 10,-0.1 2,-0.1 58,-0.1 -0.700 360.0 -88.0-157.8-152.0 5.6 -4.5 10.5 3 7 A Y S S+ 0 0 36 -2,-0.2 5,-0.2 5,-0.2 237,-0.1 0.089 81.7 113.4-124.4 14.7 4.6 -7.9 11.8 4 8 A G S > S- 0 0 22 1,-0.1 4,-1.4 4,-0.1 3,-0.1 -0.149 85.1 -95.6 -77.6 177.5 7.5 -9.9 10.4 5 9 A K T 4 S+ 0 0 172 1,-0.2 -1,-0.1 2,-0.2 5,-0.0 0.723 124.4 37.7 -65.9 -29.1 10.3 -11.7 12.2 6 10 A H T 4 S+ 0 0 161 1,-0.1 -1,-0.2 4,-0.0 -3,-0.0 0.529 129.8 24.9-102.4 -12.8 12.5 -8.7 11.8 7 11 A N T 4 S+ 0 0 67 -3,-0.1 -5,-2.7 -6,-0.0 -2,-0.2 0.220 93.3 122.0-137.9 13.1 10.2 -5.7 12.2 8 12 A G S >X S- 0 0 0 -4,-1.4 3,-2.7 -7,-0.2 4,-0.5 0.089 82.0 -69.9 -71.9 180.0 7.4 -7.2 14.3 9 13 A P G >4 S+ 0 0 27 0, 0.0 3,-0.5 0, 0.0 4,-0.3 0.652 125.3 64.6 -43.1 -30.2 6.0 -6.2 17.7 10 14 A E G 34 S+ 0 0 110 1,-0.2 3,-0.1 2,-0.1 -5,-0.0 0.551 106.9 43.9 -73.6 -13.2 9.1 -7.3 19.6 11 15 A H G X4 S+ 0 0 55 -3,-2.7 3,-1.4 1,-0.1 4,-0.5 0.513 84.6 92.5-111.3 -7.9 11.1 -4.6 17.9 12 16 A W G XX S+ 0 0 4 -3,-0.5 4,-2.6 -4,-0.5 3,-0.5 0.689 72.2 72.0 -60.2 -29.9 8.7 -1.7 18.1 13 17 A H G 34 S+ 0 0 71 -4,-0.3 -1,-0.3 1,-0.2 7,-0.1 0.657 89.0 62.8 -59.6 -22.7 10.3 -0.4 21.3 14 18 A K G <4 S+ 0 0 128 -3,-1.4 -1,-0.2 2,-0.2 -2,-0.2 0.880 117.7 24.4 -68.3 -46.5 13.4 0.7 19.5 15 19 A D T <4 S+ 0 0 139 -3,-0.5 -2,-0.2 -4,-0.5 -1,-0.2 0.714 138.1 33.7 -91.4 -28.0 11.7 3.3 17.3 16 20 A F >< - 0 0 56 -4,-2.6 3,-2.1 -5,-0.2 -1,-0.2 -0.698 63.7-179.1-132.2 80.9 8.8 3.8 19.8 17 21 A P G > S+ 0 0 98 0, 0.0 3,-1.3 0, 0.0 -4,-0.1 0.468 75.1 78.4 -56.9 -11.9 9.9 3.4 23.4 18 22 A I G > S+ 0 0 59 1,-0.3 3,-2.8 2,-0.1 -5,-0.1 0.551 70.2 89.8 -73.9 -11.4 6.3 4.0 24.7 19 23 A A G < S+ 0 0 8 -3,-2.1 -1,-0.3 1,-0.3 -6,-0.1 0.786 90.0 44.5 -49.8 -29.8 5.9 0.3 23.6 20 24 A K G < S+ 0 0 142 -3,-1.3 -1,-0.3 -7,-0.1 -2,-0.1 0.051 95.3 129.1-105.3 19.7 7.0 -0.5 27.1 21 25 A G S < S- 0 0 14 -3,-2.8 3,-0.3 1,-0.1 -3,-0.0 0.233 70.9-100.1 -64.2-174.3 4.8 2.2 28.8 22 26 A E S S+ 0 0 116 1,-0.2 227,-0.3 169,-0.1 -3,-0.1 0.495 112.0 35.2 -89.7 -12.4 2.3 2.0 31.6 23 27 A R S S+ 0 0 46 2,-0.0 -1,-0.2 168,-0.0 2,-0.1 -0.244 80.0 154.3-140.3 45.4 -1.0 1.9 29.7 24 28 A Q - 0 0 3 -3,-0.3 220,-0.1 221,-0.3 170,-0.1 -0.446 32.5 -95.8 -76.6 151.6 -0.3 -0.2 26.6 25 29 A S S S+ 0 0 0 168,-0.5 2,-0.2 -2,-0.1 78,-0.1 -0.874 77.2 36.2-126.0 160.8 -2.8 -2.3 24.6 26 30 A P + 0 0 0 0, 0.0 218,-2.7 0, 0.0 2,-0.3 0.532 65.3 179.3 -79.3-179.7 -4.1 -4.7 23.9 27 31 A V - 0 0 0 216,-0.3 77,-1.4 -2,-0.2 2,-0.5 -0.807 34.2 -99.1-133.8 177.0 -4.6 -6.7 27.2 28 32 A D E -a 104 0A 38 216,-0.5 2,-0.8 -2,-0.3 77,-0.2 -0.899 32.8-139.9-100.8 131.0 -6.1 -9.9 28.4 29 33 A I E -a 105 0A 0 75,-2.7 77,-2.6 -2,-0.5 2,-0.7 -0.865 10.3-158.8 -98.9 105.8 -9.5 -9.5 29.9 30 34 A D > - 0 0 62 -2,-0.8 4,-1.7 75,-0.2 3,-0.1 -0.817 5.1-157.4 -84.8 110.6 -9.8 -11.7 33.0 31 35 A T T 4 S+ 0 0 48 -2,-0.7 -1,-0.2 1,-0.2 222,-0.0 0.773 90.6 48.5 -62.8 -29.3 -13.6 -12.0 33.3 32 36 A H T 4 S+ 0 0 168 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.1 0.730 113.3 46.9 -84.5 -22.7 -13.3 -12.9 37.0 33 37 A T T 4 S+ 0 0 94 -3,-0.1 -2,-0.2 2,-0.1 -1,-0.2 0.728 88.3 101.3 -88.2 -26.9 -11.0 -10.0 37.8 34 38 A A S < S- 0 0 18 -4,-1.7 2,-0.6 1,-0.1 218,-0.2 -0.248 74.7-119.9 -59.5 147.7 -12.9 -7.3 36.0 35 39 A K E -c 252 0B 113 216,-2.9 218,-2.5 2,-0.0 2,-0.5 -0.857 7.8-136.5-101.4 112.4 -15.0 -5.0 38.1 36 40 A Y E -c 253 0B 131 -2,-0.6 218,-0.2 216,-0.2 216,-0.1 -0.551 27.2-165.2 -64.6 111.1 -18.7 -4.7 37.7 37 41 A D > - 0 0 23 216,-2.7 3,-0.9 -2,-0.5 -1,-0.0 -0.953 14.6-167.8-109.3 116.8 -19.1 -0.9 38.0 38 42 A P T 3 S+ 0 0 94 0, 0.0 -1,-0.1 0, 0.0 216,-0.0 0.581 82.8 70.1 -77.0 -15.3 -22.7 0.1 38.6 39 43 A S T 3 S+ 0 0 84 2,-0.1 2,-0.6 40,-0.0 215,-0.1 0.190 74.3 113.7 -88.0 9.3 -21.9 3.8 37.9 40 44 A L < - 0 0 32 -3,-0.9 3,-0.1 213,-0.2 213,-0.0 -0.808 58.2-148.5 -87.5 122.9 -21.3 2.9 34.2 41 45 A K - 0 0 123 37,-0.8 39,-0.1 -2,-0.6 3,-0.1 -0.466 30.2 -86.8 -83.2 157.7 -23.9 4.4 31.9 42 46 A P - 0 0 108 0, 0.0 36,-1.3 0, 0.0 2,-0.1 -0.282 46.1 -99.9 -66.7 148.8 -25.0 2.7 28.7 43 47 A L E -D 77 0B 16 141,-0.3 2,-0.5 34,-0.2 34,-0.2 -0.467 30.9-154.3 -69.3 145.6 -23.1 3.1 25.4 44 48 A S E +D 76 0B 40 32,-2.6 32,-2.8 -2,-0.1 2,-0.6 -0.944 16.2 176.1-128.4 102.5 -24.7 5.6 23.0 45 49 A V E -D 75 0B 35 -2,-0.5 2,-0.7 30,-0.2 30,-0.2 -0.952 7.3-177.6-113.0 117.3 -23.8 5.0 19.4 46 50 A S E +D 74 0B 42 28,-2.8 28,-1.9 -2,-0.6 3,-0.1 -0.872 26.2 141.8-115.6 88.7 -25.4 7.3 16.8 47 51 A Y > + 0 0 3 -2,-0.7 3,-1.2 26,-0.2 130,-0.3 0.166 36.7 107.1-114.1 13.5 -24.3 6.0 13.4 48 52 A D T 3 S+ 0 0 91 1,-0.3 -1,-0.1 128,-0.1 25,-0.1 0.863 86.6 39.1 -54.8 -44.9 -27.6 6.6 11.5 49 53 A Q T 3 S+ 0 0 143 23,-0.6 -1,-0.3 -3,-0.1 2,-0.2 -0.218 86.0 144.9-104.2 38.6 -26.3 9.6 9.6 50 54 A A < - 0 0 22 -3,-1.2 2,-0.6 24,-0.0 123,-0.1 -0.498 37.0-150.5 -83.0 140.4 -22.8 8.3 8.9 51 55 A T - 0 0 43 16,-0.4 16,-2.2 -2,-0.2 2,-0.3 -0.944 6.3-160.3-119.5 106.6 -21.0 9.1 5.7 52 56 A S E +E 66 0B 0 -2,-0.6 121,-0.6 14,-0.2 14,-0.2 -0.700 13.4 174.2 -84.9 143.8 -18.5 6.5 4.3 53 57 A L E - 0 0 75 12,-2.8 118,-1.9 -2,-0.3 2,-0.3 0.788 49.0 -23.6-117.9 -45.6 -16.0 7.9 1.8 54 58 A R E -EF 65 170B 86 11,-1.1 11,-2.8 116,-0.3 2,-0.4 -0.988 41.6-125.7-167.3 170.6 -13.4 5.3 0.8 55 59 A I E -EF 64 169B 0 114,-2.7 114,-2.9 -2,-0.3 2,-0.3 -0.981 29.3-177.3-130.5 134.6 -11.4 2.2 1.6 56 60 A L E -EF 63 168B 31 7,-2.0 7,-2.1 -2,-0.4 2,-0.7 -0.999 28.3-137.6-142.6 141.5 -7.6 2.1 1.5 57 61 A N E +E 62 0B 0 110,-3.0 109,-4.0 -2,-0.3 5,-0.2 -0.908 22.5 179.1 -96.4 109.8 -4.8 -0.5 1.9 58 62 A N - 0 0 42 3,-2.2 4,-0.1 -2,-0.7 -1,-0.1 0.151 55.3 -97.2 -95.6 6.8 -2.2 1.3 4.0 59 63 A G S S+ 0 0 10 2,-0.3 3,-0.1 166,-0.3 106,-0.1 0.326 119.3 49.1 92.7 -2.8 0.3 -1.6 4.2 60 64 A H S S- 0 0 52 1,-0.5 2,-0.3 -58,-0.1 166,-0.1 0.287 123.6 -24.2-139.9 -7.5 -0.8 -3.0 7.6 61 65 A A - 0 0 2 164,-0.1 -3,-2.2 165,-0.1 -1,-0.5 -0.955 66.1 -88.7 174.7 178.7 -4.5 -3.1 7.1 62 66 A F E -E 57 0B 0 -2,-0.3 29,-0.4 -5,-0.2 2,-0.4 -0.923 36.2-163.5-115.1 131.0 -7.6 -1.7 5.2 63 67 A N E -E 56 0B 21 -7,-2.1 -7,-2.0 -2,-0.4 2,-0.6 -0.951 14.1-150.7-115.8 140.3 -9.4 1.3 6.6 64 68 A V E -EG 55 89B 0 25,-2.2 25,-1.6 -2,-0.4 2,-0.4 -0.957 25.9-150.6-110.6 120.3 -12.8 2.6 5.7 65 69 A E E -EG 54 88B 52 -11,-2.8 -12,-2.8 -2,-0.6 -11,-1.1 -0.804 8.7-159.1-100.9 145.8 -12.7 6.3 6.2 66 70 A F E -E 52 0B 8 21,-2.1 2,-0.6 -2,-0.4 -14,-0.2 -0.842 29.5-102.3-121.6 153.2 -15.7 8.5 7.2 67 71 A D + 0 0 41 -16,-2.2 -16,-0.4 -2,-0.3 5,-0.2 -0.728 40.0 174.2 -76.9 112.9 -16.4 12.2 6.9 68 72 A D + 0 0 40 -2,-0.6 -1,-0.1 1,-0.1 17,-0.1 -0.175 44.1 109.5-117.3 35.6 -15.8 13.6 10.3 69 73 A S S S+ 0 0 75 1,-0.1 2,-0.3 56,-0.0 -1,-0.1 0.610 89.1 22.2 -82.8 -13.6 -16.2 17.3 9.6 70 74 A Q S S- 0 0 127 -3,-0.2 2,-2.9 3,-0.0 3,-0.4 -0.933 101.6 -81.9-147.7 161.3 -19.4 17.2 11.6 71 75 A D S S+ 0 0 90 -2,-0.3 3,-0.2 1,-0.2 -22,-0.1 -0.399 75.8 133.6 -65.4 70.8 -21.1 15.1 14.3 72 76 A K S S+ 0 0 53 -2,-2.9 -23,-0.6 1,-0.3 2,-0.5 0.926 74.8 16.7 -87.7 -56.0 -22.4 12.6 11.7 73 77 A A S S+ 0 0 6 -3,-0.4 13,-2.5 13,-0.2 -1,-0.3 -0.983 85.6 175.1-125.4 108.3 -21.5 9.3 13.4 74 78 A V E -DH 46 85B 13 -28,-1.9 -28,-2.8 -2,-0.5 2,-0.4 -0.875 25.5-153.4-121.9 152.8 -20.8 9.8 17.2 75 79 A L E +DH 45 84B 0 9,-2.9 9,-2.4 -2,-0.3 2,-0.3 -0.981 31.7 147.6-120.8 132.0 -20.0 7.7 20.2 76 80 A K E +D 44 0B 84 -32,-2.8 -32,-2.6 -2,-0.4 7,-0.1 -0.870 33.0 44.3-153.7 176.4 -21.0 9.0 23.7 77 81 A G E > S+D 43 0B 24 5,-0.3 3,-1.4 -2,-0.3 -34,-0.2 -0.181 73.2 79.7 74.9-168.0 -22.1 7.7 27.1 78 82 A G T 3 S- 0 0 3 -36,-1.3 -37,-0.8 1,-0.2 -1,-0.2 -0.523 120.1 -21.9 72.1-134.8 -20.6 4.7 28.8 79 83 A P T 3 S+ 0 0 43 0, 0.0 -1,-0.2 0, 0.0 2,-0.1 0.491 117.6 105.5 -82.5 -9.2 -17.3 5.5 30.4 80 84 A L < - 0 0 10 -3,-1.4 2,-0.5 -39,-0.1 -3,-0.3 -0.383 56.8-154.8 -82.0 152.4 -16.9 8.6 28.2 81 85 A D - 0 0 121 -2,-0.1 2,-0.1 -5,-0.1 39,-0.0 -0.998 70.0 -1.5-124.8 113.6 -17.3 12.3 28.9 82 86 A G S S- 0 0 45 -2,-0.5 2,-0.4 38,-0.1 -5,-0.3 -0.296 97.2 -51.5 98.3-174.1 -18.2 14.2 25.7 83 87 A T - 0 0 31 -7,-0.1 38,-2.3 -2,-0.1 2,-0.4 -0.820 39.0-160.6-105.8 139.5 -18.7 13.2 22.1 84 88 A Y E -HI 75 120B 4 -9,-2.4 -9,-2.9 -2,-0.4 2,-0.4 -0.979 13.2-142.1-120.1 127.4 -16.3 11.2 19.9 85 89 A R E -HI 74 119B 41 34,-2.3 34,-1.8 -2,-0.4 2,-0.2 -0.781 17.8-120.5 -97.0 134.5 -16.5 11.2 16.2 86 90 A L E + I 0 118B 3 -13,-2.5 32,-0.2 -2,-0.4 -13,-0.2 -0.490 36.0 166.5 -71.3 132.8 -15.9 8.1 14.1 87 91 A I E - 0 0 30 30,-2.2 -21,-2.1 1,-0.5 2,-0.3 0.619 61.2 -24.9-116.5 -30.6 -13.0 8.7 11.7 88 92 A Q E -GI 65 117B 34 29,-0.9 29,-3.1 -23,-0.2 -1,-0.5 -0.984 46.4-139.9-175.5 166.5 -12.4 5.1 10.5 89 93 A F E +GI 64 116B 0 -25,-1.6 -25,-2.2 -2,-0.3 2,-0.3 -0.965 22.4 165.0-136.7 153.3 -12.6 1.4 11.2 90 94 A H E - I 0 115B 22 25,-1.8 25,-2.6 -2,-0.3 2,-0.3 -0.882 21.5-130.2-156.4 175.2 -10.2 -1.4 10.5 91 95 A F E - I 0 114B 0 -29,-0.4 2,-0.4 -2,-0.3 23,-0.2 -0.892 2.4-145.3-134.4 162.2 -9.6 -5.0 11.4 92 96 A H E + I 0 113B 3 21,-1.6 21,-1.8 -2,-0.3 2,-0.3 -0.996 29.4 176.3-131.4 125.4 -6.9 -7.3 12.7 93 97 A W E - I 0 112B 0 -2,-0.4 146,-1.3 19,-0.2 145,-0.5 -0.882 19.4-132.4-132.3 161.7 -7.0 -11.0 11.4 94 98 A G - 0 0 0 17,-1.3 6,-0.1 5,-0.6 3,-0.1 -0.347 27.2-112.9-101.5-174.6 -4.9 -14.1 11.7 95 99 A S S S+ 0 0 37 142,-0.2 2,-0.2 -2,-0.1 -1,-0.1 0.703 106.9 28.2 -90.7 -26.0 -3.6 -16.7 9.3 96 100 A L S > S- 0 0 104 3,-0.0 3,-1.0 15,-0.0 -2,-0.3 -0.774 90.1-108.7-127.0 170.7 -5.9 -19.2 10.9 97 101 A D T 3 S+ 0 0 73 1,-0.2 48,-0.2 -2,-0.2 15,-0.1 0.530 109.6 71.5 -79.0 -6.6 -9.3 -18.9 12.7 98 102 A G T 3 S+ 0 0 56 13,-0.1 2,-0.3 2,-0.1 -1,-0.2 0.301 106.0 28.5 -92.4 8.6 -7.6 -19.7 16.0 99 103 A Q < + 0 0 56 -3,-1.0 -5,-0.6 12,-0.1 3,-0.1 -0.928 69.0 95.6-155.6 169.4 -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 -0.143 53.9 104.6 137.4 -43.4 -6.4 -12.8 15.0 101 105 A S - 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