==== 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 24-MAY-04 1TE3 . 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) . 12130.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 159 61.6 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 21.7 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 . 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 . 21 8.1 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 3 X H 0 0 185 0, 0.0 2,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 61.4 13.2 -1.1 7.9 2 4 X H - 0 0 126 1,-0.1 0, 0.0 0, 0.0 0, 0.0 -0.501 360.0 -93.4 -68.2 145.7 9.7 0.1 8.6 3 5 X W + 0 0 55 -2,-0.1 2,-0.2 1,-0.1 7,-0.2 -0.199 61.7 135.0 -56.0 152.7 7.7 -1.5 11.4 4 6 X G - 0 0 9 5,-2.5 10,-0.1 2,-0.2 -1,-0.1 -0.786 63.0 -78.1-162.8-142.5 5.4 -4.4 10.6 5 7 X Y S S+ 0 0 34 -2,-0.2 5,-0.2 5,-0.2 237,-0.1 0.276 83.8 106.4-123.1 7.6 4.4 -7.9 11.7 6 8 X G S > S- 0 0 34 4,-0.1 4,-1.5 1,-0.1 3,-0.3 -0.189 85.5 -92.3 -81.5 176.8 7.3 -10.0 10.4 7 9 X K T 4 S+ 0 0 176 1,-0.2 -1,-0.1 2,-0.2 5,-0.1 0.843 122.8 36.8 -54.3 -40.4 10.2 -11.7 12.1 8 10 X H T 4 S+ 0 0 123 1,-0.1 -1,-0.2 5,-0.0 -5,-0.0 0.628 131.8 24.4 -98.4 -11.0 12.6 -8.8 11.7 9 11 X N T 4 S+ 0 0 32 -3,-0.3 -5,-2.5 -6,-0.0 -2,-0.2 0.211 93.3 123.4-134.5 15.9 10.2 -5.8 12.2 10 12 X G S >X S- 0 0 0 -4,-1.5 3,-2.5 -5,-0.2 4,-0.6 0.075 80.0 -71.6 -82.9-176.1 7.4 -7.3 14.2 11 13 X P G >4 S+ 0 0 21 0, 0.0 3,-0.6 0, 0.0 4,-0.4 0.714 125.7 61.2 -54.0 -28.0 6.0 -6.2 17.6 12 14 X E G 34 S+ 0 0 127 1,-0.2 3,-0.1 2,-0.1 -2,-0.1 0.618 108.5 46.7 -76.1 -7.9 8.9 -7.3 19.7 13 15 X H G X4 S+ 0 0 56 -3,-2.5 3,-1.9 1,-0.1 4,-0.5 0.575 86.4 90.1 -98.1 -19.6 11.1 -4.9 17.8 14 16 X W G XX S+ 0 0 6 -3,-0.6 4,-1.9 -4,-0.6 3,-0.8 0.789 72.2 70.5 -58.9 -30.7 8.7 -1.8 17.9 15 17 X H G 34 S+ 0 0 67 -4,-0.4 -1,-0.3 1,-0.2 7,-0.1 0.748 87.0 67.7 -59.0 -27.4 10.2 -0.5 21.2 16 18 X K G <4 S+ 0 0 129 -3,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.901 115.9 23.7 -62.9 -41.7 13.4 0.5 19.4 17 19 X D T <4 S+ 0 0 113 -3,-0.8 -1,-0.2 -4,-0.5 -2,-0.2 0.681 135.9 36.6 -91.1 -19.6 11.7 3.2 17.4 18 20 X F >< - 0 0 60 -4,-1.9 3,-2.4 1,-0.1 -1,-0.2 -0.805 63.5-177.2-137.7 82.0 8.8 3.8 19.8 19 21 X P G > S+ 0 0 100 0, 0.0 3,-2.1 0, 0.0 -4,-0.1 0.755 77.5 76.7 -56.7 -24.7 10.0 3.4 23.4 20 22 X I G > S+ 0 0 57 1,-0.3 3,-2.4 179,-0.2 5,-0.2 0.688 71.1 88.7 -63.9 -10.9 6.4 4.0 24.6 21 23 X A G < S+ 0 0 8 -3,-2.4 -1,-0.3 1,-0.3 -6,-0.1 0.726 90.6 44.4 -51.8 -29.0 5.9 0.3 23.5 22 24 X K G < S+ 0 0 139 -3,-2.1 -1,-0.3 -7,-0.1 -2,-0.2 0.043 95.2 129.3-103.5 23.6 7.0 -0.6 27.0 23 25 X G S < S- 0 0 17 -3,-2.4 3,-0.5 1,-0.1 -3,-0.0 0.027 72.0-102.4 -76.6-173.0 4.8 2.0 28.7 24 26 X E S S+ 0 0 124 1,-0.2 -1,-0.1 169,-0.0 -3,-0.1 0.539 112.3 40.3 -87.4 -13.0 2.3 1.8 31.6 25 27 X R S S+ 0 0 48 -5,-0.2 -1,-0.2 168,-0.1 2,-0.1 -0.152 77.9 151.4-138.2 50.0 -0.9 1.8 29.5 26 28 X Q - 0 0 2 -3,-0.5 220,-0.1 221,-0.3 170,-0.1 -0.376 34.4-105.1 -82.4 147.3 -0.2 -0.3 26.5 27 29 X S S S+ 0 0 0 168,-0.5 2,-0.2 -2,-0.1 -2,-0.1 -0.914 75.1 43.9-126.1 156.7 -2.9 -2.3 24.5 28 30 X P + 0 0 0 0, 0.0 218,-2.9 0, 0.0 2,-0.3 0.588 64.0 174.6 -85.0-179.2 -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 -0.916 36.5 -99.0-136.1 165.2 -4.6 -6.9 27.1 30 32 X D E -a 106 0A 37 216,-0.4 2,-0.9 -2,-0.3 77,-0.2 -0.740 33.1-139.8 -84.7 131.6 -6.1 -10.1 28.3 31 33 X I E -a 107 0A 0 75,-3.0 77,-3.0 -2,-0.4 2,-0.9 -0.844 11.1-158.0 -96.2 107.0 -9.5 -9.5 29.8 32 34 X D >> - 0 0 66 -2,-0.9 4,-1.3 75,-0.2 3,-0.8 -0.797 4.1-158.4 -85.3 106.1 -9.7 -11.8 32.9 33 35 X T T 34 S+ 0 0 47 -2,-0.9 -1,-0.1 1,-0.2 222,-0.0 0.644 86.9 51.8 -65.9 -17.2 -13.4 -12.1 33.3 34 36 X H T 34 S+ 0 0 164 1,-0.1 -1,-0.2 3,-0.0 -2,-0.0 0.723 113.3 45.0 -90.5 -23.0 -13.3 -13.1 37.0 35 37 X T T <4 S+ 0 0 100 -3,-0.8 -2,-0.2 2,-0.1 218,-0.1 0.589 87.3 104.2 -95.1 -18.2 -11.1 -10.1 37.9 36 38 X A S < S- 0 0 20 -4,-1.3 2,-0.5 216,-0.1 218,-0.2 -0.447 70.7-129.8 -65.0 138.6 -13.0 -7.4 36.0 37 39 X K E -c 254 0B 123 216,-2.4 218,-2.6 -2,-0.1 2,-0.3 -0.826 7.7-129.8 -99.4 123.3 -15.0 -5.3 38.3 38 40 X Y E -c 255 0B 85 -2,-0.5 218,-0.2 216,-0.2 220,-0.1 -0.525 23.2-164.1 -61.7 127.8 -18.8 -4.6 37.6 39 41 X D > - 0 0 33 216,-2.3 3,-1.7 -2,-0.3 -1,-0.0 -0.918 11.2-169.7-124.4 100.8 -19.2 -0.8 37.9 40 42 X P T 3 S+ 0 0 99 0, 0.0 -1,-0.1 0, 0.0 216,-0.0 0.652 82.6 69.1 -72.6 -9.5 -22.9 0.0 38.3 41 43 X S T 3 S+ 0 0 90 -3,-0.1 2,-0.3 2,-0.1 215,-0.1 0.609 74.8 105.9 -78.4 -13.3 -22.1 3.8 37.7 42 44 X L < - 0 0 29 -3,-1.7 3,-0.1 213,-0.2 -3,-0.0 -0.544 66.2-139.5 -70.2 129.9 -21.2 3.1 34.0 43 45 X K - 0 0 150 37,-0.9 39,-0.1 -2,-0.3 2,-0.1 -0.387 27.9 -91.3 -77.6 159.2 -23.9 4.3 31.6 44 46 X P - 0 0 108 0, 0.0 36,-1.4 0, 0.0 2,-0.2 -0.400 49.0-104.5 -63.0 151.1 -25.1 2.4 28.5 45 47 X L E -D 79 0B 14 141,-0.3 2,-0.5 34,-0.3 34,-0.2 -0.530 27.1-147.8 -69.5 153.8 -23.2 3.3 25.4 46 48 X S E -D 78 0B 51 32,-2.7 32,-2.3 -2,-0.2 2,-0.6 -0.977 14.7-175.9-127.6 115.2 -24.9 5.4 22.9 47 49 X V E -D 77 0B 35 -2,-0.5 2,-0.7 30,-0.2 30,-0.2 -0.963 3.0-177.7-113.9 111.9 -24.0 4.7 19.3 48 50 X S E +D 76 0B 41 28,-2.7 28,-2.1 -2,-0.6 3,-0.2 -0.846 24.7 144.1-113.2 89.6 -25.6 7.1 16.7 49 51 X Y > + 0 0 3 -2,-0.7 3,-1.6 26,-0.2 130,-0.2 0.236 33.8 108.6-107.9 11.7 -24.5 6.0 13.4 50 52 X D T 3 S+ 0 0 98 1,-0.3 -1,-0.1 -3,-0.1 25,-0.1 0.809 86.7 40.4 -57.9 -29.9 -27.7 6.8 11.4 51 53 X Q T 3 S+ 0 0 128 23,-0.9 -1,-0.3 -3,-0.2 24,-0.2 0.200 83.3 145.7-104.4 17.9 -26.1 9.7 9.5 52 54 X A < - 0 0 24 -3,-1.6 2,-0.5 22,-0.2 123,-0.1 -0.232 33.8-157.8 -63.3 139.3 -22.7 8.1 8.9 53 55 X T - 0 0 42 16,-0.3 16,-2.3 122,-0.1 2,-0.1 -0.843 4.1-162.8-116.4 101.0 -21.0 9.1 5.7 54 56 X S E +E 68 0B 3 -2,-0.5 121,-0.6 122,-0.3 14,-0.3 -0.448 12.5 174.0 -76.7 149.0 -18.3 6.5 4.5 55 57 X L E - 0 0 81 12,-3.3 118,-2.2 1,-0.4 2,-0.3 0.686 50.3 -6.5-117.5 -44.4 -15.9 7.9 1.8 56 58 X R E -EF 67 172B 84 11,-1.2 11,-2.6 116,-0.3 2,-0.4 -0.977 44.2-137.0-161.4 152.5 -13.2 5.6 1.0 57 59 X I E -EF 66 171B 0 114,-2.5 114,-2.1 -2,-0.3 2,-0.4 -0.984 28.5-176.2-123.6 137.7 -11.4 2.3 1.7 58 60 X L E -EF 65 170B 31 7,-2.2 7,-2.3 -2,-0.4 2,-0.7 -0.994 28.4-141.3-139.0 136.1 -7.6 2.1 1.7 59 61 X N E -E 64 0B 0 110,-2.9 109,-2.8 -2,-0.4 5,-0.2 -0.880 22.6-179.7 -91.2 112.4 -4.9 -0.5 2.0 60 62 X N - 0 0 42 3,-1.9 4,-0.1 -2,-0.7 -1,-0.1 0.299 53.0 -99.9-101.2 10.7 -2.3 1.3 4.1 61 63 X G S S+ 0 0 14 2,-0.5 3,-0.1 166,-0.2 106,-0.1 0.270 116.9 53.1 89.9 -9.0 0.1 -1.6 4.3 62 64 X H S S- 0 0 53 1,-0.5 2,-0.3 -58,-0.1 166,-0.1 0.589 123.9 -25.6-123.0 -26.1 -0.8 -2.8 7.7 63 65 X A S S- 0 0 4 -5,-0.1 -3,-1.9 165,-0.1 -2,-0.5 -0.850 70.5 -92.9-162.3-175.5 -4.6 -3.2 7.5 64 66 X F E -E 59 0B 0 29,-0.3 29,-0.5 -2,-0.3 2,-0.5 -0.989 36.7-157.1-113.1 137.9 -7.4 -1.8 5.4 65 67 X N E -E 58 0B 18 -7,-2.3 -7,-2.2 -2,-0.4 2,-0.6 -0.941 10.9-150.7-112.0 136.8 -9.3 1.3 6.8 66 68 X V E -EG 57 91B 0 25,-2.9 25,-2.1 -2,-0.5 2,-0.3 -0.937 26.6-149.6 -98.7 123.2 -12.7 2.4 5.9 67 69 X E E -EG 56 90B 50 -11,-2.6 -12,-3.3 -2,-0.6 -11,-1.2 -0.695 10.6-162.0-105.8 142.7 -12.8 6.2 6.3 68 70 X F E -E 54 0B 8 21,-2.5 2,-0.7 -2,-0.3 -14,-0.2 -0.820 31.9-101.4-120.2 155.5 -15.7 8.4 7.2 69 71 X D + 0 0 41 -16,-2.3 -16,-0.3 -2,-0.3 3,-0.2 -0.682 39.5 173.7 -78.3 113.0 -16.4 12.1 6.9 70 72 X D + 0 0 42 -2,-0.7 -1,-0.1 1,-0.1 17,-0.1 -0.048 45.2 109.6-112.6 26.4 -15.7 13.4 10.4 71 73 X S S S+ 0 0 82 56,-0.0 2,-0.3 1,-0.0 -1,-0.1 0.576 88.4 18.6 -78.1 -11.6 -16.1 17.1 9.5 72 74 X Q S S- 0 0 114 -3,-0.2 2,-2.1 3,-0.0 3,-0.4 -0.945 98.4 -82.6-148.2 170.2 -19.4 17.2 11.5 73 75 X D S S+ 0 0 91 -2,-0.3 3,-0.2 1,-0.2 -3,-0.1 -0.404 77.4 125.0 -75.6 71.5 -21.2 15.2 14.2 74 76 X K S S+ 0 0 56 -2,-2.1 -23,-0.9 1,-0.3 2,-0.5 0.817 74.8 24.6-102.1 -43.0 -22.7 12.6 11.9 75 77 X A S S+ 0 0 7 -3,-0.4 13,-2.3 -6,-0.2 2,-0.3 -0.959 84.8 164.2-125.7 111.7 -21.6 9.3 13.4 76 78 X V E -DH 48 87B 9 -28,-2.1 -28,-2.7 -2,-0.5 2,-0.4 -0.915 31.8-149.2-133.6 159.7 -20.8 9.6 17.1 77 79 X L E +DH 47 86B 0 9,-2.4 9,-2.1 -2,-0.3 2,-0.3 -0.967 28.9 153.8-125.7 131.6 -20.3 7.6 20.2 78 80 X K E +D 46 0B 97 -32,-2.3 -32,-2.7 -2,-0.4 7,-0.1 -0.912 36.5 42.5-143.6-180.0 -21.2 8.9 23.6 79 81 X G E > S+D 45 0B 23 5,-0.3 3,-1.9 3,-0.3 -34,-0.3 -0.390 71.1 82.9 76.1-160.5 -22.2 7.5 27.0 80 82 X G T 3 S- 0 0 7 -36,-1.4 -37,-0.9 1,-0.3 -1,-0.1 -0.395 120.4 -25.9 59.5-134.1 -20.5 4.5 28.6 81 83 X P T 3 S+ 0 0 44 0, 0.0 -1,-0.3 0, 0.0 2,-0.2 0.398 115.6 110.3 -84.5 1.6 -17.3 5.7 30.4 82 84 X L < - 0 0 14 -3,-1.9 2,-0.5 -39,-0.1 -3,-0.3 -0.518 54.8-154.3 -88.8 146.2 -17.0 8.6 28.1 83 85 X D - 0 0 138 -2,-0.2 2,-0.1 53,-0.1 -1,-0.0 -0.959 68.2 -2.8-109.2 130.3 -17.4 12.4 28.7 84 86 X G S S- 0 0 47 -2,-0.5 2,-0.4 38,-0.1 -5,-0.3 -0.322 98.4 -47.8 83.3-170.6 -18.4 14.3 25.6 85 87 X T - 0 0 27 -7,-0.1 38,-2.4 -2,-0.1 2,-0.5 -0.877 41.3-162.1-113.8 132.2 -18.8 13.3 22.0 86 88 X Y E -HI 77 122B 4 -9,-2.1 -9,-2.4 -2,-0.4 2,-0.4 -0.975 13.7-142.7-117.0 125.8 -16.4 11.2 20.0 87 89 X R E -HI 76 121B 43 34,-2.8 34,-2.2 -2,-0.5 2,-0.2 -0.774 17.3-118.6 -90.9 137.6 -16.7 11.2 16.2 88 90 X L E + I 0 120B 3 -13,-2.3 32,-0.3 -2,-0.4 -13,-0.2 -0.464 38.2 164.0 -67.4 126.1 -16.1 8.1 14.0 89 91 X I E - 0 0 34 30,-2.6 -21,-2.5 1,-0.4 2,-0.3 0.716 59.6 -16.8-111.3 -39.5 -13.1 8.6 11.7 90 92 X Q E -GI 67 119B 32 29,-1.1 29,-2.9 -23,-0.2 -1,-0.4 -0.995 47.6-147.7-158.4 157.0 -12.3 5.1 10.5 91 93 X F E +GI 66 118B 0 -25,-2.1 -25,-2.9 -2,-0.3 2,-0.3 -0.978 22.2 160.4-127.0 158.3 -12.7 1.4 11.1 92 94 X H E - I 0 117B 22 25,-2.0 25,-2.9 -2,-0.3 2,-0.3 -0.925 23.2-128.7-157.9 176.2 -10.3 -1.5 10.4 93 95 X F E - I 0 116B 1 -29,-0.5 2,-0.3 -2,-0.3 -29,-0.3 -0.885 1.3-147.6-132.7 160.2 -9.7 -5.1 11.4 94 96 X H E + I 0 115B 3 21,-1.6 21,-2.3 -2,-0.3 2,-0.3 -0.976 30.3 170.6-124.3 138.0 -6.9 -7.4 12.7 95 97 X W E - I 0 114B 0 -2,-0.3 146,-1.2 19,-0.2 145,-0.7 -0.939 22.2-121.3-147.6 169.2 -6.9 -11.0 11.6 96 98 X G - 0 0 0 17,-1.2 6,-0.1 5,-0.6 3,-0.1 -0.460 25.0-118.3-108.3 175.2 -4.9 -14.2 11.6 97 99 X S S S+ 0 0 44 -2,-0.1 2,-0.3 142,-0.1 5,-0.1 0.655 106.0 30.7 -81.1 -20.0 -3.5 -16.8 9.2 98 100 X L S > S- 0 0 110 3,-0.2 3,-1.5 15,-0.1 -2,-0.2 -0.914 90.2-110.0-138.1 158.9 -5.8 -19.4 10.9 99 101 X D T 3 S+ 0 0 69 -2,-0.3 48,-0.2 1,-0.3 15,-0.1 0.732 109.6 67.6 -69.9 -19.0 -9.2 -19.2 12.5 100 102 X G T 3 S+ 0 0 57 13,-0.1 2,-0.3 2,-0.1 -1,-0.3 0.350 107.0 32.5 -82.0 5.2 -7.7 -19.8 16.0 101 103 X Q < + 0 0 52 -3,-1.5 -5,-0.6 12,-0.1 -3,-0.2 -0.977 65.6 97.3-150.2 164.0 -5.8 -16.5 16.2 102 104 X G + 0 0 0 1,-0.6 13,-0.3 -2,-0.3 11,-0.2 -0.008 56.0 105.0 148.4 -35.2 -6.3 -13.0 14.9 103 105 X S - 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