==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 25-MAY-04 1TEU . COMPND 2 MOLECULE: CARBONIC ANHYDRASE II; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR Z.FISHER,J.A.HERNANDEZ PRADA,C.K.TU,D.DUDA,C.YOSHIOKA,H.AN, . 258 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12062.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 161 62.4 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 . 57 22.1 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 . 21 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 35 13.6 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 2 2 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 X H 0 0 173 0, 0.0 2,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 63.6 13.3 -1.0 7.7 2 4 X H - 0 0 166 1,-0.1 0, 0.0 0, 0.0 0, 0.0 -0.419 360.0 -89.3 -80.8 157.8 9.8 0.2 8.7 3 5 X W + 0 0 66 -2,-0.1 2,-0.2 1,-0.1 7,-0.2 -0.268 62.7 132.7 -63.3 152.6 7.8 -1.4 11.4 4 6 X G - 0 0 11 5,-2.3 10,-0.1 2,-0.1 -1,-0.1 -0.779 63.7 -76.4-163.9-141.1 5.5 -4.3 10.5 5 7 X Y S S+ 0 0 34 -2,-0.2 5,-0.2 5,-0.2 237,-0.1 0.271 82.7 106.3-125.0 11.2 4.5 -7.8 11.7 6 8 X G S > S- 0 0 31 4,-0.1 4,-1.5 1,-0.1 3,-0.2 -0.124 85.1 -90.7 -82.4-178.0 7.4 -10.0 10.4 7 9 X K T 4 S+ 0 0 180 1,-0.2 -1,-0.1 2,-0.2 5,-0.1 0.873 124.2 35.2 -57.0 -38.2 10.2 -11.8 12.1 8 10 X H T 4 S+ 0 0 125 1,-0.1 -1,-0.2 4,-0.0 -5,-0.0 0.615 131.4 25.1-104.2 -9.1 12.6 -8.8 11.8 9 11 X N T 4 S+ 0 0 47 -3,-0.2 -5,-2.3 -6,-0.0 -2,-0.2 0.258 93.2 122.6-134.7 12.8 10.3 -5.8 12.1 10 12 X G S >X S- 0 0 0 -4,-1.5 3,-2.8 -7,-0.2 4,-0.6 0.103 80.4 -71.2 -83.4-175.7 7.4 -7.2 14.2 11 13 X P G >4 S+ 0 0 24 0, 0.0 3,-0.7 0, 0.0 4,-0.4 0.731 126.1 61.1 -54.3 -31.0 6.0 -6.2 17.6 12 14 X E G 34 S+ 0 0 124 1,-0.2 3,-0.1 2,-0.1 -5,-0.0 0.692 108.4 46.3 -72.5 -12.7 8.9 -7.3 19.6 13 15 X H G X4 S+ 0 0 56 -3,-2.8 3,-1.9 1,-0.1 4,-0.5 0.543 86.6 90.9 -91.0 -18.4 11.1 -4.8 17.7 14 16 X W G XX S+ 0 0 5 -3,-0.7 4,-2.0 -4,-0.6 3,-0.9 0.814 72.3 68.9 -60.8 -30.4 8.8 -1.8 17.9 15 17 X H G 34 S+ 0 0 66 -4,-0.4 -1,-0.3 1,-0.2 7,-0.1 0.719 86.1 68.4 -60.1 -24.5 10.2 -0.4 21.2 16 18 X K G <4 S+ 0 0 130 -3,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.907 116.7 24.4 -64.6 -37.1 13.6 0.5 19.5 17 19 X D T <4 S+ 0 0 122 -3,-0.9 -2,-0.2 -4,-0.5 -1,-0.2 0.688 134.7 36.8 -95.9 -20.4 11.8 3.2 17.4 18 20 X F >< - 0 0 60 -4,-2.0 3,-2.4 1,-0.1 -1,-0.2 -0.795 64.9-175.5-135.9 84.5 8.8 3.8 19.8 19 21 X P G > S+ 0 0 102 0, 0.0 3,-2.0 0, 0.0 -4,-0.1 0.747 77.4 76.1 -57.7 -26.0 10.0 3.5 23.4 20 22 X I G > S+ 0 0 56 1,-0.3 3,-2.1 179,-0.1 5,-0.2 0.646 70.1 89.9 -60.0 -13.6 6.4 3.9 24.7 21 23 X A G < S+ 0 0 8 -3,-2.4 -1,-0.3 1,-0.3 -6,-0.1 0.759 90.5 44.7 -50.2 -28.3 6.0 0.3 23.5 22 24 X K G < S+ 0 0 140 -3,-2.0 -1,-0.3 -7,-0.1 -2,-0.1 -0.076 94.8 132.5-106.6 29.0 7.1 -0.6 27.1 23 25 X G S < S- 0 0 16 -3,-2.1 3,-0.4 1,-0.1 -3,-0.0 -0.027 70.6-105.6 -77.3-174.0 4.9 2.0 28.7 24 26 X E S S+ 0 0 124 1,-0.2 226,-0.1 225,-0.0 -1,-0.1 0.543 112.2 40.0 -90.1 -12.8 2.4 1.8 31.6 25 27 X R S S+ 0 0 49 -5,-0.2 -1,-0.2 224,-0.1 2,-0.2 -0.171 79.1 150.3-137.1 49.3 -0.8 1.9 29.5 26 28 X Q - 0 0 3 -3,-0.4 220,-0.2 221,-0.3 170,-0.1 -0.472 34.4-103.9 -82.3 150.3 -0.2 -0.3 26.4 27 29 X S S S+ 0 0 0 168,-0.5 2,-0.2 -2,-0.2 -2,-0.0 -0.871 74.8 42.8-125.9 158.1 -2.8 -2.3 24.5 28 30 X P + 0 0 0 0, 0.0 218,-2.5 0, 0.0 2,-0.3 0.610 64.2 175.2 -83.6-179.6 -4.1 -4.8 23.9 29 31 X V - 0 0 1 216,-0.3 77,-1.2 -2,-0.2 2,-0.4 -0.926 36.5 -99.0-135.0 167.6 -4.5 -6.8 27.0 30 32 X D E -a 106 0A 31 216,-0.4 2,-0.8 -2,-0.3 77,-0.2 -0.698 34.1-138.9 -84.6 132.7 -6.0 -10.1 28.2 31 33 X I E -a 107 0A 0 75,-2.8 77,-3.2 -2,-0.4 2,-0.8 -0.856 10.6-157.6 -98.2 111.1 -9.4 -9.5 29.8 32 34 X D >> - 0 0 67 -2,-0.8 4,-1.7 75,-0.2 3,-0.9 -0.821 3.0-160.3 -89.9 105.6 -9.7 -11.7 32.9 33 35 X T T 34 S+ 0 0 47 -2,-0.8 -1,-0.1 1,-0.2 222,-0.0 0.697 87.0 52.8 -66.5 -19.3 -13.5 -12.0 33.3 34 36 X H T 34 S+ 0 0 166 1,-0.1 -1,-0.2 -3,-0.0 -2,-0.0 0.715 112.8 43.0 -90.9 -16.6 -13.2 -13.0 36.9 35 37 X T T <4 S+ 0 0 103 -3,-0.9 -2,-0.2 2,-0.1 218,-0.2 0.587 88.0 105.4-103.6 -16.3 -11.0 -10.1 37.9 36 38 X A < - 0 0 20 -4,-1.7 2,-0.5 216,-0.1 218,-0.2 -0.461 69.8-130.6 -63.2 135.9 -12.9 -7.4 36.0 37 39 X K E -c 254 0B 122 216,-2.2 218,-2.7 -2,-0.1 2,-0.3 -0.808 7.5-131.4 -98.7 121.9 -15.0 -5.2 38.3 38 40 X Y E -c 255 0B 74 -2,-0.5 218,-0.2 216,-0.2 220,-0.1 -0.596 22.2-167.1 -64.5 129.3 -18.7 -4.5 37.6 39 41 X D > - 0 0 38 216,-2.3 3,-1.9 -2,-0.3 215,-0.0 -0.938 10.1-169.8-126.1 100.4 -19.2 -0.8 37.9 40 42 X P T 3 S+ 0 0 95 0, 0.0 -1,-0.1 0, 0.0 216,-0.1 0.541 82.4 73.8 -76.9 -0.5 -22.9 -0.1 38.1 41 43 X S T 3 S+ 0 0 82 2,-0.1 2,-0.5 -3,-0.0 215,-0.1 0.542 73.3 104.2 -80.5 -10.1 -22.0 3.6 37.7 42 44 X L < - 0 0 28 -3,-1.9 3,-0.1 213,-0.2 -3,-0.0 -0.629 67.6-140.3 -75.2 127.8 -21.2 3.0 34.0 43 45 X K - 0 0 129 37,-0.7 2,-0.1 -2,-0.5 -2,-0.1 -0.340 28.5 -91.2 -73.1 160.9 -23.9 4.3 31.7 44 46 X P - 0 0 110 0, 0.0 36,-1.5 0, 0.0 2,-0.2 -0.433 48.7-102.3 -68.5 147.6 -25.0 2.4 28.5 45 47 X L E -D 79 0B 15 141,-0.3 2,-0.5 34,-0.3 34,-0.2 -0.528 27.2-145.9 -63.8 148.1 -23.1 3.2 25.4 46 48 X S E -D 78 0B 50 32,-2.7 32,-2.1 -2,-0.2 2,-0.6 -0.967 16.2-176.2-121.2 106.1 -24.9 5.5 22.9 47 49 X V E +D 77 0B 37 -2,-0.5 2,-0.6 30,-0.2 30,-0.2 -0.954 3.8 178.9-106.0 109.9 -24.0 4.7 19.2 48 50 X S E +D 76 0B 41 28,-2.5 28,-2.1 -2,-0.6 3,-0.1 -0.869 23.7 142.5-113.0 92.7 -25.6 7.1 16.7 49 51 X Y > + 0 0 3 -2,-0.6 3,-1.6 26,-0.2 130,-0.2 0.249 33.5 108.0-114.4 9.0 -24.5 6.0 13.4 50 52 X D T 3 S+ 0 0 97 1,-0.3 -1,-0.1 -3,-0.1 25,-0.1 0.796 87.0 41.7 -60.9 -28.8 -27.7 6.7 11.3 51 53 X Q T 3 S+ 0 0 131 23,-0.8 -1,-0.3 -3,-0.1 24,-0.2 0.234 83.6 144.5-101.3 18.4 -26.1 9.7 9.5 52 54 X A < - 0 0 23 -3,-1.6 2,-0.5 22,-0.1 123,-0.1 -0.221 34.4-158.0 -63.4 138.4 -22.6 8.1 8.9 53 55 X T - 0 0 45 16,-0.3 16,-2.4 122,-0.1 2,-0.2 -0.895 4.0-163.4-116.1 103.1 -20.9 9.0 5.7 54 56 X S E +E 68 0B 1 -2,-0.5 121,-0.6 122,-0.3 14,-0.3 -0.552 12.8 172.9 -82.0 148.0 -18.3 6.6 4.4 55 57 X L E - 0 0 82 12,-3.4 118,-2.4 1,-0.4 2,-0.3 0.734 50.8 -2.0-116.6 -41.4 -16.0 7.9 1.8 56 58 X R E -EF 67 172B 87 11,-1.2 11,-2.4 116,-0.3 2,-0.4 -0.979 44.8-141.8-160.3 147.4 -13.2 5.6 1.0 57 59 X I E +EF 66 171B 0 114,-2.7 114,-2.3 -2,-0.3 2,-0.4 -0.980 29.1 179.4-120.1 141.2 -11.5 2.2 1.6 58 60 X L E -EF 65 170B 26 7,-2.4 7,-2.5 -2,-0.4 2,-0.7 -0.995 32.8-136.5-146.1 150.6 -7.7 1.9 1.6 59 61 X N E +E 64 0B 0 110,-2.5 109,-2.7 -2,-0.4 5,-0.2 -0.881 21.3 179.9 -99.3 112.9 -4.9 -0.5 2.1 60 62 X N - 0 0 43 3,-1.9 4,-0.1 -2,-0.7 -1,-0.1 0.263 55.4 -99.0-101.5 10.3 -2.3 1.3 4.2 61 63 X G S S+ 0 0 15 2,-0.5 3,-0.1 166,-0.2 106,-0.1 0.257 117.8 52.7 91.3 -8.0 0.1 -1.6 4.2 62 64 X H S S- 0 0 53 1,-0.5 2,-0.3 -58,-0.1 166,-0.1 0.533 123.8 -23.9-125.2 -19.3 -0.8 -2.9 7.7 63 65 X A S S- 0 0 3 165,-0.1 -3,-1.9 -5,-0.1 -1,-0.5 -0.894 70.8 -92.6-162.7-173.6 -4.6 -3.2 7.4 64 66 X F E -E 59 0B 0 -2,-0.3 29,-0.5 29,-0.3 2,-0.5 -0.974 36.7-156.3-113.5 136.7 -7.4 -1.8 5.3 65 67 X N E -EG 58 92B 18 -7,-2.5 -7,-2.4 -2,-0.4 2,-0.6 -0.951 9.9-153.0-109.2 134.3 -9.2 1.3 6.7 66 68 X V E -EG 57 91B 0 25,-2.7 25,-2.2 -2,-0.5 2,-0.3 -0.958 26.5-152.8 -98.4 122.3 -12.8 2.4 5.8 67 69 X E E -EG 56 90B 51 -11,-2.4 -12,-3.4 -2,-0.6 -11,-1.2 -0.729 9.4-160.9-106.1 143.6 -12.8 6.2 6.3 68 70 X F E -E 54 0B 8 21,-2.4 2,-0.7 -2,-0.3 -14,-0.2 -0.797 31.9 -97.8-118.2 158.7 -15.7 8.4 7.2 69 71 X D + 0 0 39 -16,-2.4 -16,-0.3 -2,-0.3 5,-0.2 -0.695 39.5 175.4 -81.9 115.3 -16.4 12.1 6.9 70 72 X D + 0 0 44 -2,-0.7 -1,-0.1 1,-0.1 17,-0.1 -0.027 45.8 108.0-112.2 26.8 -15.7 13.5 10.4 71 73 X S S S+ 0 0 79 56,-0.0 2,-0.3 2,-0.0 -1,-0.1 0.501 88.6 20.6 -81.6 -11.2 -16.2 17.3 9.6 72 74 X Q S S- 0 0 111 -3,-0.2 2,-2.0 3,-0.1 3,-0.4 -0.944 99.2 -83.3-148.4 171.7 -19.4 17.3 11.5 73 75 X D S S+ 0 0 88 -2,-0.3 3,-0.2 1,-0.2 -3,-0.1 -0.436 77.1 126.3 -77.8 68.6 -21.2 15.3 14.3 74 76 X K S S+ 0 0 56 -2,-2.0 -23,-0.8 1,-0.3 2,-0.4 0.797 74.1 24.8-101.7 -38.0 -22.7 12.6 11.9 75 77 X A S S+ 0 0 7 -3,-0.4 13,-2.8 -6,-0.2 2,-0.3 -0.945 85.1 166.5-129.4 107.9 -21.5 9.3 13.4 76 78 X V E -DH 48 87B 10 -28,-2.1 -28,-2.5 -2,-0.4 2,-0.4 -0.920 31.6-149.5-129.7 156.7 -20.8 9.6 17.1 77 79 X L E +DH 47 86B 0 9,-2.7 9,-2.1 -2,-0.3 2,-0.3 -0.956 29.3 157.1-121.1 134.0 -20.2 7.6 20.2 78 80 X K E +D 46 0B 93 -32,-2.1 -32,-2.7 -2,-0.4 7,-0.1 -0.908 36.4 34.9-143.2 172.5 -21.3 8.9 23.6 79 81 X G E > S+D 45 0B 21 5,-0.4 3,-2.0 3,-0.3 -34,-0.3 -0.320 71.7 85.2 79.5-158.1 -22.1 7.6 27.0 80 82 X G T 3 S- 0 0 4 -36,-1.5 -37,-0.7 1,-0.3 -1,-0.1 -0.405 119.1 -25.1 59.2-135.9 -20.5 4.6 28.6 81 83 X P T 3 S+ 0 0 45 0, 0.0 -1,-0.3 0, 0.0 2,-0.2 0.375 116.2 107.7 -84.3 4.2 -17.2 5.7 30.4 82 84 X L < - 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