==== 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) 10-MAR-93 1DCB . COMPND 2 MOLECULE: CARBONIC ANHYDRASE II; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.A.IPPOLITO,D.W.CHRISTIANSON . 255 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11595.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 167 65.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 16 6.3 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 . 25 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 38 14.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 15 5.9 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 . 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 5 A W 0 0 112 0, 0.0 2,-0.2 0, 0.0 7,-0.2 0.000 360.0 360.0 360.0 141.4 7.7 -1.4 11.7 2 6 A G - 0 0 11 5,-2.6 10,-0.1 2,-0.2 58,-0.1 -0.665 360.0 -87.3-164.4-146.8 5.5 -4.3 10.5 3 7 A Y S S+ 0 0 34 -2,-0.2 5,-0.2 5,-0.2 237,-0.1 0.046 83.2 107.2-130.3 15.0 4.5 -7.8 11.8 4 8 A G S > S- 0 0 26 4,-0.1 4,-1.6 1,-0.1 -2,-0.2 -0.211 86.9 -92.0 -86.1-176.9 7.3 -9.9 10.4 5 9 A K T 4 S+ 0 0 163 1,-0.2 -1,-0.1 2,-0.2 5,-0.0 0.780 124.7 40.4 -67.4 -28.1 10.2 -11.6 12.2 6 10 A H T 4 S+ 0 0 162 1,-0.1 -1,-0.2 4,-0.0 0, 0.0 0.678 130.9 22.7 -99.6 -15.6 12.5 -8.6 11.7 7 11 A N T 4 S+ 0 0 65 -6,-0.0 -5,-2.6 3,-0.0 -2,-0.2 0.238 92.0 130.1-131.5 9.8 10.1 -5.7 12.2 8 12 A G S >< S- 0 0 0 -4,-1.6 3,-2.1 -5,-0.2 4,-0.4 0.200 77.9 -80.8 -60.9 177.1 7.4 -7.3 14.3 9 13 A P G > S+ 0 0 24 0, 0.0 3,-0.7 0, 0.0 4,-0.4 0.707 124.2 67.6 -57.1 -28.6 5.9 -6.0 17.6 10 14 A E G 3 S+ 0 0 112 1,-0.2 -2,-0.1 2,-0.1 -5,-0.0 0.595 106.8 43.1 -71.8 -3.0 8.8 -7.4 19.6 11 15 A H G X S+ 0 0 48 -3,-2.1 3,-1.8 1,-0.1 4,-0.4 0.515 84.3 95.2-113.4 -13.9 11.0 -4.7 17.9 12 16 A W G X> S+ 0 0 6 -3,-0.7 4,-2.3 -4,-0.4 3,-1.4 0.753 71.8 69.8 -55.9 -33.1 8.6 -1.7 18.0 13 17 A H G 34 S+ 0 0 67 -4,-0.4 -1,-0.3 1,-0.3 7,-0.1 0.661 85.1 69.7 -58.9 -23.9 10.2 -0.3 21.2 14 18 A K G <4 S+ 0 0 128 -3,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.855 117.3 20.3 -68.7 -33.1 13.4 0.6 19.4 15 19 A D T <4 S+ 0 0 128 -3,-1.4 -2,-0.2 -4,-0.4 -1,-0.2 0.647 135.5 40.9-104.1 -21.4 11.6 3.4 17.4 16 20 A F >< - 0 0 59 -4,-2.3 3,-2.3 1,-0.1 -1,-0.2 -0.806 63.5-179.2-133.2 84.0 8.6 3.8 19.8 17 21 A P G > S+ 0 0 101 0, 0.0 3,-2.0 0, 0.0 -4,-0.1 0.777 77.3 75.2 -54.5 -28.8 9.9 3.6 23.4 18 22 A I G > S+ 0 0 57 1,-0.3 3,-2.7 179,-0.2 -5,-0.1 0.674 70.5 89.5 -58.9 -16.0 6.4 4.1 24.6 19 23 A A G < S+ 0 0 8 -3,-2.3 -1,-0.3 1,-0.3 -6,-0.1 0.725 91.9 42.3 -54.5 -25.5 5.9 0.5 23.5 20 24 A K G < S+ 0 0 148 -3,-2.0 -1,-0.3 -7,-0.1 -2,-0.2 0.034 94.9 124.3-113.0 29.3 7.0 -0.5 27.1 21 25 A G S X S- 0 0 18 -3,-2.7 3,-0.5 1,-0.0 -3,-0.0 -0.020 74.7 -95.7 -78.3-176.9 5.0 2.2 28.8 22 26 A E T 3 S+ 0 0 115 1,-0.2 227,-0.3 169,-0.0 -3,-0.1 0.636 113.4 40.4 -73.2 -28.6 2.3 2.0 31.6 23 27 A R T 3 S+ 0 0 46 168,-0.1 -1,-0.2 2,-0.0 2,-0.1 -0.323 78.7 153.8-128.5 59.2 -0.9 2.0 29.5 24 28 A Q < - 0 0 2 -3,-0.5 220,-0.2 221,-0.3 170,-0.1 -0.432 32.6-100.8 -86.4 156.7 -0.2 -0.2 26.5 25 29 A S S S+ 0 0 0 168,-0.4 2,-0.1 -2,-0.1 -2,-0.0 -0.877 75.6 35.2-132.8 150.1 -2.7 -2.1 24.4 26 30 A P + 0 0 0 0, 0.0 218,-2.7 0, 0.0 2,-0.3 0.705 66.6 176.2 -88.7-176.0 -4.1 -4.7 23.7 27 31 A V - 0 0 0 216,-0.3 77,-1.2 -2,-0.1 2,-0.4 -0.903 36.1 -98.1-149.3 162.4 -4.5 -6.8 27.0 28 32 A D E -a 104 0A 35 216,-0.5 2,-0.7 -2,-0.3 77,-0.2 -0.760 34.8-140.5 -84.2 134.2 -6.0 -10.0 28.3 29 33 A I E -a 105 0A 0 75,-3.1 77,-2.6 -2,-0.4 2,-1.0 -0.877 9.8-157.4-101.3 113.9 -9.4 -9.4 29.9 30 34 A D >> - 0 0 63 -2,-0.7 4,-1.6 75,-0.2 3,-1.2 -0.806 2.4-161.7 -92.2 102.5 -9.7 -11.6 33.0 31 35 A T T 34 S+ 0 0 48 -2,-1.0 -1,-0.1 1,-0.3 222,-0.0 0.564 87.6 54.1 -62.7 -20.0 -13.5 -11.8 33.5 32 36 A H T 34 S+ 0 0 165 1,-0.1 -1,-0.3 3,-0.0 -2,-0.0 0.648 115.0 40.9 -86.6 -19.6 -13.2 -13.0 37.1 33 37 A T T <4 S+ 0 0 98 -3,-1.2 -2,-0.2 2,-0.1 218,-0.2 0.560 88.4 105.0 -98.3 -24.8 -11.1 -9.9 37.9 34 38 A A S < S- 0 0 20 -4,-1.6 2,-0.6 216,-0.1 218,-0.2 -0.444 71.5-128.7 -64.1 140.1 -13.0 -7.3 35.9 35 39 A K E -c 252 0B 124 216,-2.4 218,-2.6 -2,-0.1 2,-0.3 -0.818 8.7-130.9 -98.3 122.3 -15.0 -5.1 38.2 36 40 A Y E -c 253 0B 128 -2,-0.6 218,-0.2 216,-0.2 151,-0.0 -0.540 23.6-159.1 -70.9 122.2 -18.7 -4.5 37.5 37 41 A D > - 0 0 31 216,-3.0 3,-1.6 -2,-0.3 -1,-0.1 -0.931 13.7-169.9-114.1 105.0 -19.2 -0.8 37.7 38 42 A P T 3 S+ 0 0 94 0, 0.0 -1,-0.1 0, 0.0 216,-0.1 0.560 85.4 68.3 -67.6 -15.7 -22.9 0.2 38.4 39 43 A S T 3 S+ 0 0 78 2,-0.1 2,-0.6 -3,-0.0 215,-0.1 0.380 75.8 110.3 -87.0 3.5 -21.9 3.8 37.7 40 44 A L < - 0 0 31 -3,-1.6 3,-0.1 213,-0.2 -3,-0.0 -0.695 60.9-146.8 -87.8 120.4 -21.3 2.9 34.0 41 45 A K - 0 0 124 37,-0.7 39,-0.1 -2,-0.6 3,-0.1 -0.421 29.1 -89.0 -81.4 155.9 -23.9 4.3 31.6 42 46 A P - 0 0 109 0, 0.0 36,-1.3 0, 0.0 -1,-0.1 -0.365 47.4-102.0 -66.3 147.3 -25.1 2.6 28.5 43 47 A L E -D 77 0B 16 141,-0.3 2,-0.5 34,-0.2 34,-0.2 -0.427 28.7-147.3 -68.9 150.6 -23.2 3.2 25.3 44 48 A S E -D 76 0B 41 32,-2.6 32,-2.0 -2,-0.1 2,-0.7 -0.928 16.7-177.1-128.8 98.5 -24.8 5.7 22.9 45 49 A V E +D 75 0B 37 -2,-0.5 2,-0.7 30,-0.2 30,-0.2 -0.887 4.7 176.8-101.8 105.7 -24.0 4.8 19.2 46 50 A S E +D 74 0B 37 28,-2.6 28,-2.7 -2,-0.7 3,-0.1 -0.883 23.9 138.8-111.9 92.7 -25.5 7.3 16.7 47 51 A Y > + 0 0 3 -2,-0.7 3,-1.5 26,-0.2 130,-0.2 0.204 32.4 108.3-118.6 13.8 -24.4 6.3 13.3 48 52 A D T 3 S+ 0 0 107 1,-0.3 25,-0.1 -3,-0.1 -1,-0.1 0.794 86.6 45.0 -63.1 -26.3 -27.6 6.8 11.2 49 53 A Q T 3 S+ 0 0 110 23,-0.8 -1,-0.3 -3,-0.1 24,-0.2 0.293 83.1 145.5 -99.8 12.9 -26.0 9.9 9.5 50 54 A A < - 0 0 24 -3,-1.5 2,-0.5 22,-0.2 123,-0.1 -0.096 33.7-158.4 -55.0 141.3 -22.6 8.3 8.8 51 55 A T - 0 0 49 16,-0.3 16,-2.6 122,-0.1 2,-0.3 -0.890 5.2-166.6-129.0 103.7 -20.8 9.3 5.7 52 56 A S E +E 66 0B 2 -2,-0.5 121,-0.6 122,-0.2 14,-0.2 -0.635 9.6 176.5 -88.6 145.4 -18.2 6.8 4.4 53 57 A L E - 0 0 76 12,-1.6 118,-2.0 1,-0.3 2,-0.3 0.703 51.7 -26.1-117.4 -40.0 -15.8 8.1 1.7 54 58 A R E -EF 65 170B 84 11,-0.8 11,-2.7 116,-0.3 2,-0.4 -0.996 42.6-121.7-173.0 173.3 -13.3 5.4 0.9 55 59 A I E -EF 64 169B 0 114,-2.6 114,-2.5 -2,-0.3 2,-0.3 -0.981 27.9-176.4-130.8 140.7 -11.2 2.3 1.7 56 60 A L E -EF 63 168B 27 7,-2.2 7,-2.4 -2,-0.4 2,-0.7 -0.998 30.1-135.6-146.0 147.8 -7.5 1.9 1.6 57 61 A N E +E 62 0B 2 110,-2.7 109,-3.2 -2,-0.3 5,-0.2 -0.880 22.4 179.8 -98.5 111.3 -4.6 -0.6 2.0 58 62 A N - 0 0 34 3,-2.0 4,-0.1 -2,-0.7 -1,-0.1 0.326 56.2 -98.8-101.6 10.5 -2.0 1.3 4.2 59 63 A G S S+ 0 0 11 2,-0.6 3,-0.1 166,-0.2 106,-0.1 0.294 117.7 49.9 90.2 -8.9 0.4 -1.7 4.2 60 64 A H S S- 0 0 47 1,-0.5 2,-0.3 -58,-0.1 166,-0.1 0.488 123.8 -20.2-129.8 -13.4 -0.6 -3.0 7.6 61 65 A A - 0 0 2 165,-0.1 -3,-2.0 -5,-0.1 -2,-0.6 -0.874 69.9 -94.1-168.3-172.9 -4.4 -3.2 7.4 62 66 A F E -E 57 0B 0 29,-0.3 29,-0.5 -2,-0.3 2,-0.4 -0.985 33.8-155.5-124.3 134.6 -7.3 -1.7 5.4 63 67 A N E -E 56 0B 22 -7,-2.4 -7,-2.2 -2,-0.4 2,-0.7 -0.951 12.2-154.9-116.7 135.3 -9.2 1.4 6.6 64 68 A V E -EG 55 89B 0 25,-2.4 25,-1.7 -2,-0.4 -9,-0.2 -0.963 28.8-155.2-103.4 108.5 -12.7 2.5 5.9 65 69 A E E -EG 54 88B 44 -11,-2.7 -12,-1.6 -2,-0.7 -11,-0.8 -0.537 8.3-159.6 -92.1 154.3 -12.5 6.3 6.4 66 70 A F E -E 52 0B 9 21,-2.3 2,-0.8 -14,-0.2 -14,-0.2 -0.947 29.9-100.7-136.7 153.9 -15.4 8.6 7.2 67 71 A D + 0 0 39 -16,-2.6 -16,-0.3 -2,-0.3 5,-0.3 -0.736 37.9 176.4 -79.3 108.0 -16.2 12.3 6.9 68 72 A D + 0 0 40 -2,-0.8 -1,-0.1 1,-0.2 17,-0.1 -0.116 47.5 106.4-105.7 31.2 -15.5 13.6 10.5 69 73 A S S S+ 0 0 80 1,-0.1 2,-0.3 56,-0.0 -1,-0.2 0.575 86.7 26.5 -88.6 -8.9 -16.1 17.3 9.7 70 74 A Q S S- 0 0 116 -3,-0.3 2,-3.1 3,-0.1 3,-0.4 -0.967 100.0 -89.6-146.8 156.1 -19.5 17.3 11.4 71 75 A D S S+ 0 0 79 -2,-0.3 3,-0.2 1,-0.2 -3,-0.1 -0.417 78.0 130.9 -63.5 69.8 -21.1 15.3 14.3 72 76 A K S S+ 0 0 49 -2,-3.1 -23,-0.8 1,-0.3 2,-0.6 0.915 71.0 24.1 -93.0 -51.0 -22.4 12.7 11.8 73 77 A A S S+ 0 0 5 -3,-0.4 13,-2.7 13,-0.2 -1,-0.3 -0.980 88.0 171.2-113.1 111.0 -21.4 9.3 13.2 74 78 A V E -DH 46 85B 13 -28,-2.7 -28,-2.6 -2,-0.6 2,-0.4 -0.883 28.6-154.9-131.4 153.9 -20.9 9.8 17.0 75 79 A L E +DH 45 84B 0 9,-2.6 9,-2.2 -2,-0.3 2,-0.3 -0.981 27.5 149.8-121.5 137.5 -20.2 7.8 20.1 76 80 A K E +D 44 0B 78 -32,-2.0 -32,-2.6 -2,-0.4 7,-0.1 -0.878 34.4 41.9-155.3 178.0 -21.2 9.0 23.7 77 81 A G E > S+D 43 0B 23 5,-0.3 3,-1.8 -2,-0.3 -34,-0.2 -0.268 71.3 85.1 77.2-160.8 -22.2 7.8 27.1 78 82 A G T 3 S- 0 0 1 -36,-1.3 -37,-0.7 1,-0.3 -1,-0.1 -0.470 119.9 -26.0 66.2-138.1 -20.5 4.7 28.7 79 83 A P T 3 S+ 0 0 41 0, 0.0 -1,-0.3 0, 0.0 2,-0.2 0.287 117.8 105.9 -81.2 -1.4 -17.4 5.8 30.4 80 84 A L < - 0 0 11 -3,-1.8 2,-0.5 -39,-0.1 -3,-0.3 -0.582 56.0-153.8 -86.8 154.1 -17.0 8.8 28.1 81 85 A D - 0 0 128 -2,-0.2 2,-0.1 53,-0.1 -3,-0.0 -0.997 66.8 -1.1-126.2 118.6 -17.5 12.5 28.7 82 86 A G S S- 0 0 49 -2,-0.5 2,-0.4 39,-0.1 -5,-0.3 -0.329 98.8 -47.0 97.4-173.2 -18.4 14.5 25.6 83 87 A T - 0 0 33 -7,-0.1 38,-2.8 -2,-0.1 2,-0.5 -0.806 40.6-164.9-105.8 131.1 -18.7 13.5 22.0 84 88 A Y E -HI 75 120B 5 -9,-2.2 -9,-2.6 -2,-0.4 2,-0.4 -0.983 15.1-144.0-118.1 126.8 -16.4 11.3 20.0 85 89 A R E -HI 74 119B 45 34,-2.3 34,-1.8 -2,-0.5 -11,-0.2 -0.768 18.1-116.1 -95.4 136.8 -16.6 11.3 16.2 86 90 A L E + I 0 118B 2 -13,-2.7 32,-0.2 -2,-0.4 -13,-0.2 -0.462 38.3 165.3 -67.2 128.4 -16.0 8.2 14.0 87 91 A I E - 0 0 36 30,-2.2 -21,-2.3 1,-0.5 2,-0.3 0.683 60.8 -23.7-113.2 -37.5 -13.0 8.8 11.7 88 92 A Q E -GI 65 117B 32 29,-1.0 29,-3.1 -23,-0.2 -1,-0.5 -0.964 46.5-142.6-166.3 170.5 -12.3 5.2 10.5 89 93 A F E +GI 64 116B 0 -25,-1.7 -25,-2.4 -2,-0.3 2,-0.3 -0.971 22.4 165.0-140.5 150.7 -12.6 1.5 11.2 90 94 A H E - I 0 115B 21 25,-1.9 25,-2.9 -2,-0.3 2,-0.3 -0.918 22.7-129.7-157.4 169.6 -10.1 -1.4 10.5 91 95 A F E - I 0 114B 1 -29,-0.5 2,-0.3 -2,-0.3 -29,-0.3 -0.879 0.4-148.6-124.8 159.6 -9.6 -5.0 11.4 92 96 A H E + I 0 113B 2 21,-1.8 21,-2.0 -2,-0.3 2,-0.3 -0.929 32.1 169.3-125.1 138.6 -6.8 -7.2 12.8 93 97 A W E - I 0 112B 0 -2,-0.3 146,-1.2 19,-0.2 145,-0.8 -0.949 21.8-125.3-152.7 168.0 -6.9 -10.9 11.7 94 98 A G - 0 0 0 17,-1.2 6,-0.1 5,-0.6 3,-0.1 -0.464 26.4-113.5-112.5-177.1 -4.9 -14.1 11.6 95 99 A S S S+ 0 0 39 -2,-0.1 2,-0.3 142,-0.1 5,-0.1 0.689 105.1 25.5 -87.5 -22.9 -3.6 -16.8 9.3 96 100 A L S > S- 0 0 105 3,-0.2 3,-1.5 15,-0.1 -2,-0.2 -0.889 89.8-104.8-132.4 165.1 -6.0 -19.3 10.9 97 101 A D T 3 S+ 0 0 74 -2,-0.3 48,-0.1 1,-0.3 15,-0.1 0.704 111.6 70.1 -66.1 -22.3 -9.3 -19.1 12.8 98 102 A G T 3 S+ 0 0 56 13,-0.1 2,-0.3 2,-0.1 -1,-0.3 0.484 106.0 28.2 -74.5 -8.5 -7.5 -19.8 16.1 99 103 A Q < + 0 0 55 -3,-1.5 -5,-0.6 12,-0.1 -3,-0.2 -0.955 67.4 94.5-149.9 163.9 -5.8 -16.4 16.2 100 104 A G + 0 0 0 1,-0.5 13,-0.3 -2,-0.3 11,-0.2 0.049 55.0 106.5 143.3 -32.6 -6.2 -12.8 15.0 101 105 A S - 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