==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 19-NOV-06 2NXT . COMPND 2 MOLECULE: CARBONIC ANHYDRASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.Z.FISHER,R.MCKENNA . 258 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11877.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 163 63.2 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 . 24 9.3 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 . 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 . 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 0 174 0, 0.0 3,-0.1 0, 0.0 2,-0.0 0.000 360.0 360.0 360.0 53.8 13.5 -1.5 7.7 2 4 A H - 0 0 134 1,-0.2 12,-0.0 15,-0.0 0, 0.0 -0.239 360.0 -70.7 -89.6 178.7 10.4 -0.1 9.3 3 5 A W + 0 0 48 1,-0.1 2,-0.2 11,-0.1 7,-0.2 -0.201 65.8 124.8 -66.4 155.3 7.9 -1.9 11.6 4 6 A G - 0 0 12 5,-2.7 10,-0.1 2,-0.1 -1,-0.1 -0.812 67.1 -74.6-171.2-142.6 5.5 -4.5 10.5 5 7 A F S S+ 0 0 35 -2,-0.2 5,-0.2 5,-0.2 237,-0.1 0.043 82.8 107.1-129.5 23.1 4.5 -8.1 11.2 6 8 A G S > S- 0 0 42 1,-0.1 4,-1.1 4,-0.0 3,-0.3 -0.301 84.9 -89.0 -90.9-170.5 7.3 -10.2 9.8 7 9 A K T 4 S+ 0 0 174 1,-0.2 -1,-0.1 2,-0.2 3,-0.0 0.845 124.4 36.0 -64.9 -33.2 10.1 -12.2 11.5 8 10 A H T 4 S+ 0 0 138 1,-0.1 -1,-0.2 5,-0.0 -3,-0.0 0.610 127.8 29.2-107.1 -4.6 12.5 -9.3 11.6 9 11 A N T 4 S+ 0 0 39 -3,-0.3 -5,-2.7 -6,-0.1 -2,-0.2 0.238 88.5 125.7-137.5 19.5 10.2 -6.3 12.2 10 12 A G S >X S- 0 0 1 -4,-1.1 3,-2.9 -7,-0.2 4,-0.7 0.111 79.7 -69.0 -74.4-177.6 7.3 -7.7 14.2 11 13 A P G >4 S+ 0 0 27 0, 0.0 3,-0.7 0, 0.0 4,-0.4 0.752 127.5 61.6 -48.6 -33.0 5.8 -6.6 17.6 12 14 A E G 34 S+ 0 0 120 1,-0.2 3,-0.1 2,-0.1 -2,-0.0 0.614 107.9 46.1 -72.7 -7.0 8.8 -7.8 19.6 13 15 A H G X> S+ 0 0 51 -3,-2.9 3,-1.7 1,-0.1 4,-0.5 0.595 85.9 89.0-104.0 -15.3 10.9 -5.3 17.7 14 16 A W H XX S+ 0 0 4 -3,-0.7 4,-2.5 -4,-0.7 3,-1.0 0.805 73.3 71.2 -61.2 -30.6 8.7 -2.2 17.9 15 17 A H H 34 S+ 0 0 67 -4,-0.4 -1,-0.3 1,-0.2 7,-0.1 0.736 86.9 65.9 -60.6 -22.2 10.1 -1.0 21.2 16 18 A K H <4 S+ 0 0 131 -3,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.871 117.7 23.8 -69.1 -36.1 13.4 -0.0 19.5 17 19 A D H << S+ 0 0 107 -3,-1.0 -2,-0.2 -4,-0.5 -1,-0.2 0.736 135.8 36.4 -93.5 -22.9 11.7 2.7 17.4 18 20 A F >< - 0 0 54 -4,-2.5 3,-2.7 1,-0.1 -1,-0.2 -0.748 64.5-178.9-130.2 78.5 8.7 3.2 19.8 19 21 A P G > S+ 0 0 99 0, 0.0 3,-2.0 0, 0.0 -1,-0.1 0.748 75.5 76.6 -57.7 -21.4 9.9 2.9 23.4 20 22 A I G > S+ 0 0 53 1,-0.3 3,-2.5 2,-0.2 -5,-0.1 0.675 71.2 87.7 -63.5 -10.5 6.3 3.5 24.7 21 23 A A G < S+ 0 0 6 -3,-2.7 -1,-0.3 1,-0.3 -6,-0.1 0.733 90.6 46.3 -55.8 -25.3 5.7 -0.2 23.5 22 24 A K G < S+ 0 0 141 -3,-2.0 -1,-0.3 -4,-0.2 -2,-0.2 0.034 96.8 129.3-102.9 22.8 7.0 -1.1 27.0 23 25 A G S < S- 0 0 15 -3,-2.5 3,-0.5 1,-0.1 -3,-0.1 0.111 72.5 -98.9 -77.7-175.3 4.8 1.6 28.7 24 26 A E S S+ 0 0 123 1,-0.2 226,-0.3 225,-0.1 -1,-0.1 0.554 113.0 31.8 -86.1 -11.7 2.3 1.6 31.5 25 27 A R S S+ 0 0 48 224,-0.1 -1,-0.2 168,-0.1 2,-0.2 -0.286 79.1 155.5-145.3 56.5 -1.0 1.3 29.6 26 28 A Q - 0 0 3 -3,-0.5 220,-0.2 221,-0.3 170,-0.1 -0.494 32.8-100.7 -85.9 153.4 -0.3 -0.7 26.4 27 29 A S S S+ 0 0 0 168,-0.5 2,-0.2 -2,-0.2 -2,-0.0 -0.882 77.5 41.0-124.4 157.9 -2.9 -2.6 24.4 28 30 A P + 0 0 0 0, 0.0 218,-2.8 0, 0.0 2,-0.3 0.573 65.4 176.3 -80.1 179.3 -4.2 -5.2 23.7 29 31 A V - 0 0 1 216,-0.3 77,-1.3 -2,-0.2 2,-0.4 -0.930 36.3 -98.7-135.4 161.4 -4.5 -7.1 26.9 30 32 A D E -a 106 0A 29 216,-0.4 2,-0.8 -2,-0.3 77,-0.2 -0.747 33.8-139.1 -76.5 134.5 -6.0 -10.4 28.1 31 33 A I E -a 107 0A 0 75,-3.0 77,-2.6 -2,-0.4 2,-0.9 -0.879 10.1-158.4 -99.0 103.5 -9.4 -10.0 29.6 32 34 A D >> - 0 0 68 -2,-0.8 4,-1.6 75,-0.2 3,-0.8 -0.796 5.2-161.0 -81.7 105.3 -9.7 -12.2 32.6 33 35 A T T 34 S+ 0 0 43 -2,-0.9 -1,-0.2 1,-0.3 222,-0.0 0.770 86.1 53.3 -69.4 -25.0 -13.4 -12.5 32.9 34 36 A H T 34 S+ 0 0 174 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.0 0.819 113.3 43.4 -78.5 -25.5 -13.4 -13.6 36.5 35 37 A T T <4 S+ 0 0 113 -3,-0.8 -2,-0.2 2,-0.1 -1,-0.2 0.567 87.9 102.1 -91.5 -22.1 -11.2 -10.6 37.7 36 38 A A S < S- 0 0 18 -4,-1.6 2,-0.5 216,-0.1 218,-0.2 -0.397 71.4-131.2 -59.5 142.3 -13.0 -7.9 35.7 37 39 A K E -c 254 0B 141 216,-2.1 218,-3.3 -2,-0.1 2,-0.2 -0.875 8.0-121.4-104.5 128.7 -15.2 -5.9 38.0 38 40 A Y E -c 255 0B 94 -2,-0.5 218,-0.2 216,-0.2 220,-0.1 -0.476 25.2-161.8 -52.2 128.3 -18.9 -5.0 37.4 39 41 A D > - 0 0 23 216,-2.6 3,-3.3 -2,-0.2 -1,-0.1 -0.787 7.7-171.8-122.4 87.7 -19.1 -1.2 37.5 40 42 A P T 3 S+ 0 0 95 0, 0.0 -1,-0.1 0, 0.0 216,-0.0 0.602 82.2 66.9 -64.0 -11.4 -22.8 -0.4 38.1 41 43 A S T 3 S+ 0 0 90 -3,-0.1 2,-0.6 2,-0.1 215,-0.1 0.484 76.4 110.1 -83.2 -3.4 -22.1 3.3 37.5 42 44 A L < - 0 0 27 -3,-3.3 3,-0.1 213,-0.2 -3,-0.1 -0.643 62.8-145.9 -76.9 117.5 -21.3 2.4 33.9 43 45 A K - 0 0 124 37,-0.9 3,-0.1 -2,-0.6 2,-0.1 -0.326 28.9 -85.5 -77.5 163.7 -24.0 3.7 31.6 44 46 A P - 0 0 110 0, 0.0 36,-1.5 0, 0.0 2,-0.1 -0.403 49.3-104.3 -65.2 148.0 -25.1 2.0 28.4 45 47 A L E -D 79 0B 16 34,-0.3 2,-0.6 141,-0.3 34,-0.2 -0.445 25.3-146.9 -62.6 143.7 -23.1 2.7 25.4 46 48 A S E -D 78 0B 49 32,-2.9 32,-2.2 -2,-0.1 2,-0.6 -0.956 16.3-176.6-116.1 110.9 -24.7 5.0 22.9 47 49 A V E -D 77 0B 33 -2,-0.6 2,-0.7 30,-0.2 30,-0.2 -0.938 1.9-175.6-106.6 108.0 -23.7 4.0 19.4 48 50 A S E +D 76 0B 42 28,-3.2 28,-2.0 -2,-0.6 3,-0.2 -0.815 25.8 141.1-109.9 83.9 -25.1 6.6 16.9 49 51 A Y > + 0 0 4 -2,-0.7 3,-1.9 26,-0.2 130,-0.2 0.276 33.7 107.4-109.9 8.5 -24.4 5.5 13.4 50 52 A D T 3 S+ 0 0 95 1,-0.3 -1,-0.2 127,-0.1 25,-0.1 0.797 88.8 38.4 -64.5 -26.2 -27.6 6.4 11.5 51 53 A Q T 3 S+ 0 0 125 23,-0.9 -1,-0.3 -3,-0.2 24,-0.2 0.144 84.0 147.1-104.3 18.5 -26.0 9.3 9.7 52 54 A A < - 0 0 22 -3,-1.9 2,-0.5 1,-0.1 23,-0.1 -0.234 32.8-158.9 -57.4 140.3 -22.6 7.7 9.1 53 55 A T - 0 0 47 16,-0.3 16,-2.8 122,-0.1 2,-0.2 -0.875 5.4-165.0-124.3 93.7 -20.9 8.8 5.8 54 56 A S E +E 68 0B 1 -2,-0.5 121,-0.6 122,-0.3 14,-0.3 -0.517 10.6 175.3 -74.1 152.6 -18.3 6.3 4.6 55 57 A L E - 0 0 78 12,-3.2 118,-2.3 1,-0.4 2,-0.3 0.708 49.5 -10.0-121.1 -47.3 -15.9 7.6 2.0 56 58 A R E -EF 67 172B 83 11,-1.1 11,-2.8 116,-0.3 -1,-0.4 -0.980 45.6-131.8-158.7 159.5 -13.2 5.2 1.0 57 59 A I E -EF 66 171B 0 114,-2.4 114,-2.0 -2,-0.3 2,-0.4 -0.992 28.0-170.9-126.7 136.7 -11.4 2.0 1.7 58 60 A L E -EF 65 170B 33 7,-2.2 7,-2.5 -2,-0.4 2,-0.8 -0.990 24.1-143.6-132.1 131.0 -7.5 2.0 1.8 59 61 A N E -E 64 0B 0 110,-2.8 109,-3.1 -2,-0.4 5,-0.2 -0.860 22.1-178.2 -86.9 112.6 -4.9 -0.8 2.0 60 62 A N - 0 0 39 3,-2.0 4,-0.1 -2,-0.8 -1,-0.1 0.295 51.3 -99.4 -97.9 12.4 -2.3 0.9 4.2 61 63 A G S S+ 0 0 17 2,-0.5 3,-0.1 166,-0.2 106,-0.1 0.295 118.3 49.8 91.3 -13.1 0.2 -2.0 4.2 62 64 A H S S- 0 0 50 1,-0.5 2,-0.2 -58,-0.1 -1,-0.1 0.587 126.1 -25.8-126.2 -29.3 -0.8 -3.4 7.6 63 65 A A S S- 0 0 3 -5,-0.1 -3,-2.0 165,-0.1 -1,-0.5 -0.818 71.1 -91.8-158.1-170.7 -4.6 -3.6 7.3 64 66 A F E -E 59 0B 0 -2,-0.2 2,-0.5 -5,-0.2 29,-0.4 -0.983 33.2-152.5-116.5 140.9 -7.4 -2.0 5.4 65 67 A N E -E 58 0B 23 -7,-2.5 -7,-2.2 -2,-0.4 2,-0.7 -0.935 7.9-152.0-110.3 132.1 -9.2 1.1 6.8 66 68 A V E -EG 57 91B 0 25,-2.8 25,-1.9 -2,-0.5 2,-0.3 -0.914 29.7-152.4 -94.0 116.4 -12.8 2.0 5.9 67 69 A E E -EG 56 90B 47 -11,-2.8 -12,-3.2 -2,-0.7 -11,-1.1 -0.702 11.2-160.9-101.1 149.8 -12.8 5.8 6.3 68 70 A F E -E 54 0B 8 21,-2.4 2,-0.7 -2,-0.3 -14,-0.2 -0.830 31.9 -98.5-123.0 156.2 -15.6 8.1 7.3 69 71 A D + 0 0 34 -16,-2.8 -16,-0.3 -2,-0.3 5,-0.3 -0.654 41.9 171.3 -71.5 115.1 -16.4 11.8 7.0 70 72 A D + 0 0 42 -2,-0.7 -1,-0.1 1,-0.2 17,-0.1 0.036 48.3 102.1-115.9 24.2 -15.5 13.0 10.5 71 73 A S S S+ 0 0 81 56,-0.0 2,-0.3 2,-0.0 -1,-0.2 0.399 90.3 27.2 -87.8 3.4 -15.9 16.8 9.8 72 74 A Q S S- 0 0 121 -3,-0.2 2,-1.9 3,-0.1 3,-0.3 -0.940 100.2 -88.1-150.0 164.2 -19.3 16.8 11.5 73 75 A D S S+ 0 0 89 -2,-0.3 3,-0.2 1,-0.2 -3,-0.1 -0.554 76.3 129.7 -75.4 74.6 -21.1 14.8 14.3 74 76 A K S S+ 0 0 46 -2,-1.9 -23,-0.9 1,-0.3 2,-0.4 0.735 73.0 19.9 -98.9 -33.8 -22.4 12.1 11.9 75 77 A A S S+ 0 0 6 -3,-0.3 13,-3.0 -6,-0.2 2,-0.4 -0.916 84.2 169.4-139.9 107.4 -21.4 8.8 13.5 76 78 A V E -DH 48 87B 10 -28,-2.0 -28,-3.2 -2,-0.4 2,-0.4 -0.914 30.1-147.9-132.2 152.0 -20.7 9.1 17.2 77 79 A L E +DH 47 86B 0 9,-2.9 9,-2.4 -2,-0.4 2,-0.3 -0.973 30.8 155.0-114.0 135.4 -20.0 7.1 20.2 78 80 A K E +D 46 0B 85 -32,-2.2 -32,-2.9 -2,-0.4 7,-0.1 -0.885 35.6 35.6-146.2 170.5 -21.1 8.4 23.7 79 81 A G E > S+D 45 0B 18 5,-0.5 3,-2.7 3,-0.3 -34,-0.3 -0.317 72.3 83.4 79.1-160.4 -22.0 7.0 27.0 80 82 A G T 3 S- 0 0 5 -36,-1.5 -37,-0.9 1,-0.3 -1,-0.1 -0.386 121.1 -23.2 59.4-134.0 -20.4 4.0 28.7 81 83 A P T 3 S+ 0 0 39 0, 0.0 -1,-0.3 0, 0.0 2,-0.2 0.457 115.2 112.7 -82.2 -2.4 -17.2 5.1 30.3 82 84 A L < - 0 0 7 -3,-2.7 2,-0.5 2,-0.1 -3,-0.3 -0.520 53.5-155.7 -86.4 141.7 -16.9 8.1 28.1 83 85 A D - 0 0 117 -2,-0.2 2,-0.2 53,-0.1 -1,-0.0 -0.938 68.3 -7.3 -99.1 123.3 -17.2 11.8 28.8 84 86 A G S S- 0 0 49 -2,-0.5 -5,-0.5 38,-0.1 2,-0.4 -0.552 99.2 -42.5 94.1-164.2 -18.3 13.8 25.8 85 87 A T - 0 0 26 -2,-0.2 38,-2.7 -7,-0.1 2,-0.5 -0.934 42.4-164.4-119.4 128.7 -18.7 12.9 22.1 86 88 A Y E -HI 77 122B 3 -9,-2.4 -9,-2.9 -2,-0.4 2,-0.4 -0.969 13.5-144.6-118.1 126.4 -16.4 10.7 20.0 87 89 A R E -HI 76 121B 44 34,-2.7 34,-2.2 -2,-0.5 2,-0.3 -0.748 17.7-116.9 -95.7 137.9 -16.6 10.7 16.2 88 90 A L E + I 0 120B 3 -13,-3.0 32,-0.3 -2,-0.4 -14,-0.1 -0.489 37.7 165.1 -70.6 125.1 -16.0 7.7 14.0 89 91 A I E - 0 0 32 30,-2.8 -21,-2.4 1,-0.4 2,-0.3 0.729 60.5 -24.4-108.1 -37.7 -13.0 8.2 11.7 90 92 A Q E -GI 67 119B 29 29,-1.2 29,-3.0 -23,-0.2 -1,-0.4 -0.989 47.4-144.1-162.8 160.1 -12.3 4.7 10.5 91 93 A F E +GI 66 118B 0 -25,-1.9 -25,-2.8 -2,-0.3 2,-0.3 -0.969 23.1 163.8-127.0 159.9 -12.7 1.0 11.2 92 94 A H E - I 0 117B 23 25,-1.8 25,-3.1 -2,-0.3 2,-0.3 -0.935 23.0-125.7-156.6 172.7 -10.3 -1.9 10.4 93 95 A F E - I 0 116B 0 -29,-0.4 2,-0.4 -2,-0.3 -29,-0.2 -0.842 0.2-148.8-124.1 163.4 -9.7 -5.5 11.4 94 96 A H E + I 0 115B 5 21,-2.0 21,-2.3 -2,-0.3 2,-0.3 -0.976 31.4 169.3-122.9 137.3 -6.9 -7.7 12.7 95 97 A W E - I 0 114B 2 -2,-0.4 146,-1.2 19,-0.2 145,-1.0 -0.945 23.5-119.7-150.7 169.6 -6.9 -11.3 11.6 96 98 A G - 0 0 0 17,-1.4 6,-0.1 5,-0.6 3,-0.1 -0.476 23.4-121.4-104.8 174.0 -4.9 -14.6 11.5 97 99 A S S S+ 0 0 43 142,-0.2 2,-0.3 -2,-0.2 5,-0.1 0.612 105.6 30.1 -81.7 -16.6 -3.5 -17.0 9.0 98 100 A L S > S- 0 0 105 3,-0.3 3,-1.7 15,-0.1 -2,-0.2 -0.942 89.8-110.5-139.2 156.6 -5.7 -19.7 10.7 99 101 A D T 3 S+ 0 0 73 -2,-0.3 48,-0.1 1,-0.3 15,-0.1 0.726 109.5 70.5 -66.2 -22.3 -9.0 -19.5 12.5 100 102 A G T 3 S+ 0 0 57 13,-0.1 2,-0.3 2,-0.1 -1,-0.3 0.386 107.0 26.2 -71.8 -3.6 -7.4 -20.2 15.9 101 103 A Q < + 0 0 50 -3,-1.7 -5,-0.6 12,-0.1 -3,-0.3 -0.972 65.3 99.7-153.9 166.1 -5.7 -16.8 16.1 102 104 A G + 0 0 0 1,-0.5 13,-0.3 -2,-0.3 11,-0.2 0.037 55.1 107.2 142.4 -28.7 -6.1 -13.2 14.8 103 105 A S - 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