==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 10-DEC-09 3L14 . COMPND 2 MOLECULE: CARBONIC ANHYDRASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.G.QUIRIT,A.ROBBINS,C.GENIS,C.TU,D.N.SILVERMAN,R.MCKENNA . 257 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12120.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 161 62.6 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 21.8 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 . 23 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 34 13.2 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 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 4 A H 0 0 217 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 35.4 9.6 -0.1 8.4 2 5 A W + 0 0 71 1,-0.1 2,-0.2 2,-0.1 7,-0.2 -0.423 360.0 136.0 -67.5 154.5 7.7 -1.6 11.4 3 6 A G - 0 0 10 5,-2.5 10,-0.1 2,-0.2 58,-0.1 -0.760 63.5 -78.9-166.1-145.3 5.4 -4.5 10.5 4 7 A Y S S+ 0 0 34 -2,-0.2 5,-0.2 5,-0.2 237,-0.1 0.259 83.2 106.8-125.2 11.1 4.4 -8.0 11.7 5 8 A G S >> S- 0 0 42 4,-0.1 4,-2.0 1,-0.1 3,-0.6 -0.206 84.5 -92.1 -86.4-178.9 7.3 -10.2 10.5 6 9 A K T 34 S+ 0 0 173 1,-0.2 -1,-0.1 2,-0.2 5,-0.0 0.867 124.2 37.4 -61.7 -34.7 10.2 -11.8 12.4 7 10 A H T 34 S+ 0 0 143 1,-0.1 -1,-0.2 4,-0.0 -3,-0.0 0.628 131.8 24.0-102.5 -2.9 12.5 -9.0 11.9 8 11 A N T <4 S+ 0 0 58 -3,-0.6 -5,-2.5 -6,-0.1 -2,-0.2 0.259 94.6 115.4-139.4 12.9 10.1 -6.0 12.2 9 12 A G S >X S- 0 0 3 -4,-2.0 3,-2.9 -5,-0.2 4,-0.7 0.072 84.8 -64.2 -81.2-172.4 7.2 -7.3 14.3 10 13 A P T 34 S+ 0 0 26 0, 0.0 3,-0.5 0, 0.0 4,-0.4 0.726 128.0 59.8 -48.4 -32.4 5.8 -6.4 17.7 11 14 A E T 34 S+ 0 0 143 1,-0.2 3,-0.1 2,-0.1 -5,-0.1 0.642 109.4 45.2 -74.3 -11.5 8.9 -7.5 19.7 12 15 A H T X4 S+ 0 0 58 -3,-2.9 3,-1.8 1,-0.1 4,-0.5 0.588 87.0 89.1 -98.3 -17.4 11.0 -5.0 17.7 13 16 A W G >X S+ 0 0 5 -4,-0.7 4,-2.4 -3,-0.5 3,-0.9 0.786 72.8 70.9 -62.6 -30.3 8.6 -1.9 17.9 14 17 A H G 34 S+ 0 0 67 -4,-0.4 -1,-0.3 1,-0.2 7,-0.1 0.761 87.3 66.3 -60.5 -25.0 10.1 -0.7 21.2 15 18 A K G <4 S+ 0 0 134 -3,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.921 117.1 23.8 -64.2 -41.0 13.3 0.4 19.5 16 19 A D T <4 S+ 0 0 121 -3,-0.9 -2,-0.2 -4,-0.5 -1,-0.2 0.741 136.3 36.4 -90.7 -26.1 11.6 3.1 17.4 17 20 A F >< - 0 0 54 -4,-2.4 3,-2.5 1,-0.1 -1,-0.2 -0.760 64.7-179.3-130.9 78.2 8.7 3.6 19.8 18 21 A P G > S+ 0 0 101 0, 0.0 3,-2.0 0, 0.0 -4,-0.1 0.726 76.0 76.5 -56.6 -21.5 9.9 3.2 23.4 19 22 A I G > S+ 0 0 66 1,-0.3 3,-2.6 179,-0.2 -5,-0.1 0.640 70.5 88.9 -63.8 -13.9 6.3 3.8 24.7 20 23 A A G < S+ 0 0 7 -3,-2.5 -1,-0.3 1,-0.3 -6,-0.1 0.740 90.5 45.8 -53.3 -25.3 5.8 0.1 23.6 21 24 A K G < S+ 0 0 140 -3,-2.0 -1,-0.3 -7,-0.1 -2,-0.2 -0.009 96.1 129.0-103.2 22.9 7.0 -0.8 27.2 22 25 A G S < S- 0 0 13 -3,-2.6 3,-0.5 1,-0.1 -3,-0.1 0.102 72.5-101.4 -74.7-174.4 4.8 1.9 28.8 23 26 A E S S+ 0 0 120 1,-0.2 226,-0.3 225,-0.1 -1,-0.1 0.543 112.4 36.6 -89.4 -9.8 2.3 1.8 31.6 24 27 A R S S+ 0 0 47 224,-0.1 -1,-0.2 2,-0.0 2,-0.2 -0.250 78.9 155.1-141.8 52.9 -1.0 1.7 29.6 25 28 A Q - 0 0 3 -3,-0.5 220,-0.2 221,-0.3 170,-0.1 -0.494 32.8 -99.8 -85.3 151.3 -0.3 -0.5 26.5 26 29 A S S S+ 0 0 0 168,-0.5 2,-0.2 -2,-0.2 -2,-0.0 -0.883 77.6 37.6-122.3 156.8 -2.9 -2.4 24.4 27 30 A P + 0 0 0 0, 0.0 218,-2.9 0, 0.0 2,-0.3 0.589 65.5 177.6 -79.1-178.6 -4.1 -5.0 23.8 28 31 A V - 0 0 1 216,-0.3 77,-1.2 -2,-0.2 2,-0.4 -0.923 36.0 -99.4-136.8 160.9 -4.5 -6.9 27.0 29 32 A D E -a 105 0A 35 216,-0.4 2,-0.8 -2,-0.3 77,-0.2 -0.725 34.6-138.5 -76.2 131.1 -6.0 -10.2 28.1 30 33 A I E -a 106 0A 0 75,-2.9 77,-2.6 -2,-0.4 2,-0.9 -0.874 10.9-158.7 -93.7 105.2 -9.5 -9.7 29.7 31 34 A D >> - 0 0 67 -2,-0.8 4,-1.6 75,-0.2 3,-0.9 -0.762 4.8-161.3 -85.3 106.1 -9.7 -11.9 32.8 32 35 A T T 34 S+ 0 0 44 -2,-0.9 -1,-0.2 1,-0.3 222,-0.0 0.778 86.1 53.2 -69.4 -26.4 -13.5 -12.1 33.1 33 36 A H T 34 S+ 0 0 172 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.1 0.708 112.3 44.9 -78.0 -20.1 -13.4 -13.2 36.7 34 37 A T T <4 S+ 0 0 102 -3,-0.9 -2,-0.2 2,-0.1 -1,-0.2 0.688 89.1 98.3 -94.0 -23.6 -11.2 -10.2 37.7 35 38 A A S < S- 0 0 17 -4,-1.6 2,-0.5 218,-0.1 218,-0.2 -0.403 71.4-136.5 -63.4 135.9 -13.1 -7.6 35.8 36 39 A K E -c 253 0B 152 216,-2.0 218,-2.6 -2,-0.1 2,-0.2 -0.844 8.6-120.5-109.5 138.7 -15.4 -5.8 38.1 37 40 A Y E -c 254 0B 86 -2,-0.5 218,-0.2 216,-0.2 220,-0.1 -0.509 25.1-160.3 -63.0 129.5 -19.0 -4.8 37.4 38 41 A D > - 0 0 27 216,-2.6 3,-1.7 -2,-0.2 -1,-0.1 -0.930 12.4-172.6-117.9 102.7 -19.4 -1.1 37.6 39 42 A P T 3 S+ 0 0 99 0, 0.0 -1,-0.1 0, 0.0 216,-0.1 0.603 83.6 69.4 -71.0 -10.6 -23.1 -0.1 38.1 40 43 A S T 3 S+ 0 0 81 2,-0.1 2,-0.3 -3,-0.0 215,-0.1 0.519 76.0 102.7 -84.1 -2.6 -22.0 3.6 37.7 41 44 A L < - 0 0 29 -3,-1.7 3,-0.1 213,-0.2 38,-0.0 -0.665 69.0-137.1 -76.3 136.3 -21.2 3.0 34.0 42 45 A K - 0 0 117 37,-1.0 39,-0.1 -2,-0.3 3,-0.1 -0.454 31.7 -82.5 -85.3 164.5 -23.9 4.3 31.7 43 46 A P - 0 0 114 0, 0.0 36,-1.5 0, 0.0 2,-0.2 -0.326 51.6-107.0 -63.0 144.5 -25.3 2.5 28.7 44 47 A L E -D 78 0B 15 34,-0.3 2,-0.5 141,-0.2 34,-0.2 -0.557 27.3-148.7 -63.7 137.7 -23.2 2.9 25.6 45 48 A S E +D 77 0B 47 32,-2.7 32,-2.2 -2,-0.2 2,-0.6 -0.959 16.7 179.5-116.8 109.4 -24.6 5.3 22.9 46 49 A V E -D 76 0B 34 -2,-0.5 2,-0.7 30,-0.2 30,-0.2 -0.933 2.4-179.6-109.2 106.7 -23.6 4.3 19.4 47 50 A S E +D 75 0B 42 28,-2.9 28,-1.9 -2,-0.6 3,-0.2 -0.812 21.8 145.4-117.5 91.8 -25.3 6.7 17.0 48 51 A Y > + 0 0 3 -2,-0.7 3,-1.8 26,-0.2 130,-0.2 0.261 32.5 111.6-110.8 6.2 -24.3 5.7 13.4 49 52 A D T 3 S+ 0 0 92 1,-0.3 -1,-0.1 127,-0.1 25,-0.1 0.840 86.9 37.5 -53.1 -35.5 -27.5 6.7 11.5 50 53 A Q T 3 S+ 0 0 126 23,-0.8 -1,-0.3 -3,-0.2 24,-0.2 0.279 83.1 141.3-106.6 21.4 -25.9 9.5 9.6 51 54 A A < - 0 0 22 -3,-1.8 2,-0.5 22,-0.1 18,-0.1 -0.273 33.0-163.2 -60.6 139.5 -22.5 7.9 9.1 52 55 A T - 0 0 37 16,-0.3 16,-2.6 122,-0.1 2,-0.1 -0.876 2.1-160.3-131.6 109.2 -21.0 8.7 5.7 53 56 A S E +E 67 0B 0 -2,-0.5 121,-0.6 122,-0.3 14,-0.3 -0.489 11.1 178.3 -75.0 151.2 -18.2 6.5 4.5 54 57 A L E - 0 0 84 12,-3.4 118,-2.0 1,-0.4 2,-0.3 0.708 51.2 -6.6-120.0 -39.5 -15.9 7.8 1.8 55 58 A R E -EF 66 171B 81 11,-1.1 11,-3.1 116,-0.3 -1,-0.4 -0.988 46.0-133.2-162.1 154.7 -13.1 5.4 0.9 56 59 A I E -EF 65 170B 0 114,-2.3 114,-2.1 -2,-0.3 2,-0.4 -0.982 26.1-168.5-123.8 139.5 -11.2 2.1 1.7 57 60 A L E -EF 64 169B 34 7,-2.2 7,-2.4 -2,-0.4 2,-0.8 -0.992 24.0-143.7-133.9 131.5 -7.4 2.0 1.8 58 61 A N E -E 63 0B 0 110,-2.8 109,-2.9 -2,-0.4 5,-0.2 -0.865 22.4-176.8 -87.3 110.2 -4.8 -0.7 1.9 59 62 A N - 0 0 36 3,-1.7 4,-0.1 -2,-0.8 -1,-0.1 0.313 51.4 -97.7 -95.7 11.9 -2.2 0.9 4.2 60 63 A G S S+ 0 0 13 2,-0.6 106,-0.1 166,-0.2 3,-0.1 0.283 117.9 44.7 92.0 -12.1 0.3 -1.9 4.0 61 64 A H S S- 0 0 40 1,-0.5 2,-0.2 -58,-0.1 166,-0.1 0.579 127.1 -21.2-131.8 -25.1 -0.6 -3.6 7.3 62 65 A A S S- 0 0 2 -5,-0.1 -3,-1.7 165,-0.1 -2,-0.6 -0.735 73.0 -92.7-154.4-163.0 -4.5 -3.7 7.2 63 66 A F E -E 58 0B 0 29,-0.3 29,-0.5 -5,-0.2 2,-0.5 -0.997 27.6-150.3-126.1 140.9 -7.2 -1.8 5.4 64 67 A N E -E 57 0B 26 -7,-2.4 -7,-2.2 -2,-0.4 2,-0.7 -0.917 5.1-152.3-107.9 129.7 -9.1 1.3 6.8 65 68 A V E -EG 56 90B 0 25,-2.9 25,-1.9 -2,-0.5 2,-0.3 -0.916 30.6-150.9 -94.2 114.6 -12.7 2.1 5.9 66 69 A E E -EG 55 89B 42 -11,-3.1 -12,-3.4 -2,-0.7 -11,-1.1 -0.723 12.1-159.3 -98.9 146.4 -12.7 5.9 6.2 67 70 A F E -E 53 0B 10 21,-2.5 2,-0.8 -2,-0.3 -14,-0.2 -0.818 30.6-103.8-119.0 156.4 -15.5 8.3 7.2 68 71 A D + 0 0 41 -16,-2.6 -16,-0.3 -2,-0.3 3,-0.3 -0.668 40.1 172.7 -76.7 109.4 -16.3 12.0 6.8 69 72 A D + 0 0 42 -2,-0.8 -1,-0.1 1,-0.1 17,-0.1 -0.013 44.6 107.9-107.2 27.4 -15.6 13.2 10.3 70 73 A S S S+ 0 0 86 2,-0.0 2,-0.3 1,-0.0 -1,-0.1 0.453 87.8 20.3 -92.6 3.0 -16.0 17.0 9.5 71 74 A Q S S- 0 0 112 -3,-0.3 2,-1.7 3,-0.1 3,-0.3 -0.961 102.4 -82.9-150.2 168.9 -19.3 17.2 11.4 72 75 A D S S+ 0 0 88 -2,-0.3 3,-0.1 1,-0.2 -3,-0.1 -0.531 74.3 132.5 -75.2 92.0 -20.9 15.1 14.1 73 76 A K S S+ 0 0 58 -2,-1.7 -23,-0.8 1,-0.3 2,-0.4 0.794 71.8 23.0-104.2 -38.5 -22.4 12.4 11.8 74 77 A A S S+ 0 0 4 -3,-0.3 13,-3.0 -24,-0.2 2,-0.4 -0.961 81.4 173.0-138.0 105.8 -21.5 9.1 13.6 75 78 A V E -DH 47 86B 18 -28,-1.9 -28,-2.9 -2,-0.4 2,-0.4 -0.932 28.8-149.6-132.7 149.0 -20.7 9.4 17.3 76 79 A L E +DH 46 85B 0 9,-2.8 9,-2.2 -2,-0.4 2,-0.3 -0.952 32.0 153.9-111.8 132.7 -20.0 7.4 20.3 77 80 A K E +D 45 0B 87 -32,-2.2 -32,-2.7 -2,-0.4 7,-0.1 -0.908 34.9 33.9-147.5 170.7 -21.0 8.7 23.7 78 81 A G E > S+D 44 0B 21 5,-0.5 3,-2.5 3,-0.3 -34,-0.3 -0.329 72.9 84.1 74.3-159.3 -22.0 7.4 27.2 79 82 A G T 3 S- 0 0 0 -36,-1.5 -37,-1.0 1,-0.3 -1,-0.2 -0.354 120.1 -22.9 62.2-135.9 -20.4 4.3 28.8 80 83 A P T 3 S+ 0 0 42 0, 0.0 -1,-0.3 0, 0.0 2,-0.2 0.510 115.7 111.2 -81.4 -4.4 -17.2 5.3 30.4 81 84 A L < - 0 0 10 -3,-2.5 2,-0.5 -39,-0.1 -3,-0.3 -0.483 55.9-152.9 -84.2 143.5 -16.9 8.3 28.2 82 85 A D - 0 0 126 -2,-0.2 2,-0.1 53,-0.1 -1,-0.0 -0.912 69.5 -12.8-102.4 126.6 -17.2 12.0 29.0 83 86 A G S S- 0 0 53 -2,-0.5 -5,-0.5 38,-0.1 2,-0.4 -0.402 99.7 -37.6 82.6-160.2 -18.3 14.0 26.0 84 87 A T - 0 0 21 -7,-0.1 38,-2.7 -2,-0.1 2,-0.5 -0.917 41.0-165.0-121.1 132.0 -18.6 13.1 22.3 85 88 A Y E -HI 76 121B 4 -9,-2.2 -9,-2.8 -2,-0.4 2,-0.4 -0.974 13.8-145.3-122.5 126.6 -16.4 11.0 20.1 86 89 A R E -HI 75 120B 36 34,-2.7 34,-2.1 -2,-0.5 2,-0.3 -0.754 18.9-116.4 -98.6 134.8 -16.6 11.0 16.3 87 90 A L E + I 0 119B 2 -13,-3.0 32,-0.2 -2,-0.4 -13,-0.2 -0.472 37.9 164.4 -66.6 127.8 -16.1 8.0 14.1 88 91 A I E - 0 0 36 30,-2.7 -21,-2.5 1,-0.4 2,-0.3 0.727 60.2 -25.1-109.5 -37.3 -13.0 8.5 11.7 89 92 A Q E -GI 66 118B 34 29,-1.2 29,-2.8 -23,-0.2 -1,-0.4 -0.986 46.5-142.9-165.4 160.1 -12.3 4.9 10.5 90 93 A F E +GI 65 117B 0 -25,-1.9 -25,-2.9 -2,-0.3 2,-0.3 -0.970 23.2 161.8-126.7 160.8 -12.7 1.2 11.1 91 94 A H E - I 0 116B 24 25,-1.8 25,-3.0 -2,-0.3 2,-0.3 -0.938 23.6-125.8-157.6 177.4 -10.3 -1.6 10.4 92 95 A F E - I 0 115B 0 -29,-0.5 2,-0.4 -2,-0.3 -29,-0.3 -0.848 0.5-150.0-128.0 162.1 -9.6 -5.2 11.4 93 96 A H E + I 0 114B 2 21,-2.0 21,-2.1 -2,-0.3 2,-0.3 -0.980 31.5 168.2-124.3 141.7 -6.8 -7.4 12.7 94 97 A W E - I 0 113B 0 -2,-0.4 146,-1.3 19,-0.2 145,-1.0 -0.945 23.8-117.4-153.2 170.8 -6.9 -11.1 11.7 95 98 A G - 0 0 0 17,-1.3 6,-0.1 5,-0.6 3,-0.1 -0.488 23.5-119.9-107.3 176.5 -4.9 -14.4 11.6 96 99 A S S S+ 0 0 43 -2,-0.2 2,-0.3 142,-0.1 5,-0.1 0.617 105.3 28.4 -82.1 -20.1 -3.5 -16.9 9.2 97 100 A L S > S- 0 0 109 3,-0.3 3,-1.6 15,-0.1 -2,-0.2 -0.935 90.8-108.2-140.9 158.0 -5.7 -19.6 10.8 98 101 A D T 3 S+ 0 0 76 -2,-0.3 48,-0.1 1,-0.3 15,-0.1 0.756 109.8 69.9 -68.6 -20.9 -9.1 -19.3 12.6 99 102 A G T 3 S+ 0 0 57 13,-0.1 2,-0.3 2,-0.1 -1,-0.3 0.373 105.9 30.5 -76.2 1.3 -7.4 -20.0 16.0 100 103 A Q < + 0 0 56 -3,-1.6 -5,-0.6 12,-0.1 -3,-0.3 -0.975 65.5 96.2-151.4 165.0 -5.7 -16.6 16.1 101 104 A G + 0 0 0 1,-0.5 13,-0.3 -2,-0.3 11,-0.2 0.007 54.9 107.0 143.4 -32.4 -6.1 -13.0 14.9 102 105 A S - 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