==== 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 PROTON TRANSPORT 21-APR-10 3MNK . COMPND 2 MOLECULE: CARBONIC ANHYDRASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.F.DOMSIC,R.MCKENNA . 258 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11942.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 162 62.8 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 . 21 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 14.0 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 0 119 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 139.9 -16.2 2.0 28.0 2 4 A H + 0 0 155 2,-0.1 2,-0.0 0, 0.0 0, 0.0 0.803 360.0 84.0 -66.5 -32.2 -19.1 -0.3 26.8 3 5 A W + 0 0 28 1,-0.1 2,-0.2 2,-0.1 7,-0.2 -0.362 54.0 132.4 -73.5 155.2 -16.9 -1.9 24.0 4 6 A G - 0 0 8 5,-2.5 10,-0.1 2,-0.1 58,-0.1 -0.795 65.0 -77.8-169.8-149.3 -14.6 -4.8 24.8 5 7 A Y S S+ 0 0 33 -2,-0.2 5,-0.2 5,-0.2 237,-0.1 0.119 83.6 107.3-123.2 17.0 -13.6 -8.2 23.6 6 8 A G S > S- 0 0 37 4,-0.1 4,-1.6 1,-0.1 3,-0.3 -0.308 84.5 -91.9 -86.7-178.4 -16.5 -10.4 24.8 7 9 A K T 4 S+ 0 0 180 1,-0.2 -1,-0.1 2,-0.2 5,-0.0 0.841 123.5 36.5 -57.8 -36.8 -19.4 -12.1 23.0 8 10 A H T 4 S+ 0 0 144 1,-0.1 -1,-0.2 4,-0.0 -5,-0.0 0.646 131.7 22.7-102.5 -9.4 -21.7 -9.2 23.5 9 11 A N T 4 S+ 0 0 49 -3,-0.3 -5,-2.5 -6,-0.0 -2,-0.2 0.222 92.8 122.7-139.4 15.1 -19.5 -6.2 23.1 10 12 A G S >X S- 0 0 0 -4,-1.6 3,-2.8 -7,-0.2 4,-0.7 0.092 81.3 -71.5 -81.8-175.0 -16.5 -7.6 21.0 11 13 A P G >4 S+ 0 0 20 0, 0.0 3,-0.5 0, 0.0 4,-0.4 0.712 126.4 63.0 -55.2 -28.7 -15.1 -6.5 17.7 12 14 A E G 34 S+ 0 0 123 1,-0.2 3,-0.1 2,-0.1 -5,-0.0 0.666 109.1 45.1 -74.5 -8.2 -18.0 -7.8 15.6 13 15 A H G X> S+ 0 0 52 -3,-2.8 3,-1.7 1,-0.1 4,-0.5 0.552 86.2 90.9 -98.6 -16.3 -20.2 -5.2 17.5 14 16 A W H XX S+ 0 0 4 -4,-0.7 4,-2.2 -3,-0.5 3,-0.8 0.790 72.8 69.9 -58.5 -29.1 -17.9 -2.2 17.3 15 17 A H H 34 S+ 0 0 63 -4,-0.4 -1,-0.3 1,-0.2 7,-0.1 0.727 87.6 66.0 -63.0 -24.4 -19.4 -0.8 14.1 16 18 A K H <4 S+ 0 0 136 -3,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.897 117.3 24.5 -67.6 -37.4 -22.7 0.1 15.8 17 19 A D H << S+ 0 0 106 -3,-0.8 -2,-0.2 -4,-0.5 -1,-0.2 0.704 135.4 35.8 -90.5 -23.1 -20.9 2.8 17.9 18 20 A F >< - 0 0 58 -4,-2.2 3,-2.7 1,-0.1 -1,-0.2 -0.789 64.4-176.6-135.6 80.5 -17.9 3.4 15.6 19 21 A P G > S+ 0 0 103 0, 0.0 3,-1.8 0, 0.0 -4,-0.1 0.721 77.1 76.1 -61.1 -20.5 -19.2 3.2 12.0 20 22 A I G > S+ 0 0 56 1,-0.3 3,-2.6 179,-0.2 -5,-0.1 0.664 71.7 89.1 -62.7 -13.1 -15.6 3.7 10.7 21 23 A A G < S+ 0 0 6 -3,-2.7 -1,-0.3 1,-0.3 -6,-0.1 0.724 90.6 44.4 -53.5 -25.1 -15.1 0.0 11.8 22 24 A K G < S+ 0 0 138 -3,-1.8 -1,-0.3 -4,-0.1 -2,-0.1 0.021 95.3 129.7-108.6 28.8 -16.2 -1.0 8.3 23 25 A G S X S- 0 0 17 -3,-2.6 3,-0.5 1,-0.1 -3,-0.0 -0.002 71.9-101.1 -75.0-176.0 -14.0 1.8 6.6 24 26 A E T 3 S+ 0 0 111 1,-0.2 226,-0.2 225,-0.1 -1,-0.1 0.512 112.5 38.4 -85.5 -9.2 -11.5 1.5 3.8 25 27 A R T 3 S+ 0 0 49 224,-0.1 -1,-0.2 168,-0.1 2,-0.1 -0.183 78.6 151.5-143.4 52.5 -8.3 1.5 5.7 26 28 A Q < - 0 0 4 -3,-0.5 220,-0.1 221,-0.3 170,-0.1 -0.437 34.1-101.0 -85.9 153.2 -8.9 -0.6 8.9 27 29 A S S S+ 0 0 0 168,-0.4 2,-0.2 -2,-0.1 -2,-0.1 -0.893 76.2 42.4-124.1 160.5 -6.3 -2.6 10.8 28 30 A P + 0 0 0 0, 0.0 218,-2.7 0, 0.0 2,-0.3 0.582 64.6 177.3 -79.5 178.4 -5.0 -5.2 11.5 29 31 A V - 0 0 1 216,-0.3 77,-1.2 -2,-0.2 2,-0.5 -0.933 36.0-101.5-135.0 165.1 -4.6 -7.1 8.2 30 32 A D E -a 106 0A 36 216,-0.4 2,-0.8 -2,-0.3 77,-0.2 -0.762 33.4-139.6 -83.7 132.0 -3.1 -10.4 7.1 31 33 A I E -a 107 0A 0 75,-2.9 77,-3.1 -2,-0.5 2,-0.8 -0.859 10.8-157.4 -95.7 109.2 0.3 -9.8 5.5 32 34 A D >> - 0 0 67 -2,-0.8 3,-1.2 75,-0.2 4,-1.1 -0.861 5.3-157.6 -89.3 109.3 0.5 -12.1 2.4 33 35 A T T 34 S+ 0 0 46 -2,-0.8 -1,-0.1 1,-0.3 222,-0.0 0.717 87.5 51.3 -70.0 -20.5 4.3 -12.3 2.0 34 36 A H T 34 S+ 0 0 167 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.0 0.521 111.9 45.8 -93.8 -8.0 4.1 -13.3 -1.7 35 37 A T T <4 S+ 0 0 97 -3,-1.2 -2,-0.2 2,-0.1 -1,-0.2 0.527 87.9 105.7-103.2 -13.9 1.8 -10.4 -2.7 36 38 A A S < S- 0 0 20 -4,-1.1 2,-0.6 216,-0.1 218,-0.2 -0.481 71.0-130.7 -70.5 133.8 3.8 -7.8 -0.7 37 39 A K E -c 254 0B 123 216,-2.3 218,-2.7 -2,-0.1 2,-0.3 -0.836 9.0-130.2 -94.2 122.2 5.8 -5.6 -3.1 38 40 A Y E -c 255 0B 85 -2,-0.6 218,-0.2 216,-0.2 220,-0.1 -0.529 23.2-162.7 -63.8 128.0 9.5 -5.0 -2.4 39 41 A D > - 0 0 32 216,-2.5 3,-2.1 -2,-0.3 -1,-0.1 -0.894 12.1-169.1-121.4 102.3 10.1 -1.2 -2.6 40 42 A P T 3 S+ 0 0 99 0, 0.0 -1,-0.1 0, 0.0 216,-0.1 0.626 83.7 67.5 -69.5 -10.0 13.7 -0.3 -3.1 41 43 A S T 3 S+ 0 0 88 2,-0.1 2,-0.5 -3,-0.1 215,-0.1 0.450 74.9 105.2 -84.1 -2.5 12.9 3.3 -2.4 42 44 A L < - 0 0 29 -3,-2.1 3,-0.1 213,-0.2 38,-0.0 -0.684 66.4-139.5 -80.6 129.4 12.0 2.7 1.3 43 45 A K - 0 0 126 37,-0.9 39,-0.1 -2,-0.5 3,-0.1 -0.398 27.4 -87.7 -76.8 160.9 14.8 3.8 3.7 44 46 A P - 0 0 114 0, 0.0 36,-2.0 0, 0.0 2,-0.2 -0.328 50.4-104.9 -59.1 149.3 16.0 2.0 6.8 45 47 A L E -D 79 0B 14 34,-0.3 2,-0.5 141,-0.3 34,-0.2 -0.515 27.2-147.1 -66.6 150.5 14.0 2.8 9.9 46 48 A S E -D 78 0B 51 32,-2.5 32,-2.2 -2,-0.2 2,-0.6 -0.957 16.2-175.2-121.7 109.6 15.8 5.2 12.3 47 49 A V E -D 77 0B 34 -2,-0.5 2,-0.6 30,-0.2 30,-0.2 -0.918 3.7-177.5-108.8 114.8 14.9 4.3 15.9 48 50 A S E +D 76 0B 43 28,-2.8 28,-2.2 -2,-0.6 3,-0.1 -0.860 25.8 141.3-114.6 95.7 16.3 6.8 18.5 49 51 A Y > + 0 0 4 -2,-0.6 3,-2.0 26,-0.2 130,-0.2 0.309 34.7 106.7-118.5 7.9 15.4 5.6 21.9 50 52 A D T 3 S+ 0 0 98 1,-0.3 25,-0.1 127,-0.1 -1,-0.1 0.776 88.4 41.3 -60.6 -27.6 18.6 6.3 23.9 51 53 A Q T 3 S+ 0 0 134 23,-0.9 -1,-0.3 -3,-0.1 24,-0.2 0.251 83.4 145.8-105.4 15.4 17.0 9.3 25.7 52 54 A A < - 0 0 24 -3,-2.0 2,-0.5 22,-0.1 123,-0.1 -0.139 33.2-159.0 -56.8 137.0 13.6 7.7 26.3 53 55 A T - 0 0 46 16,-0.3 16,-2.7 122,-0.1 2,-0.1 -0.867 5.1-163.7-118.1 100.5 11.8 8.7 29.6 54 56 A S E +E 68 0B 1 -2,-0.5 121,-0.5 122,-0.3 14,-0.3 -0.510 12.3 173.6 -79.0 147.2 9.2 6.2 30.8 55 57 A L E - 0 0 80 12,-3.3 118,-2.5 1,-0.4 2,-0.3 0.698 49.7 -3.6-114.2 -46.6 6.8 7.5 33.4 56 58 A R E -EF 67 172B 85 11,-1.1 11,-3.0 116,-0.3 -1,-0.4 -0.984 44.5-141.0-157.2 150.4 3.9 5.2 34.3 57 59 A I E -EF 66 171B 0 114,-2.4 114,-2.6 -2,-0.3 2,-0.4 -0.985 29.9-176.3-122.3 140.8 2.3 1.9 33.6 58 60 A L E -EF 65 170B 29 7,-2.4 7,-2.6 -2,-0.4 2,-0.7 -0.990 30.3-136.9-142.7 138.9 -1.5 1.8 33.6 59 61 A N E -E 64 0B 0 110,-2.8 109,-3.1 -2,-0.4 5,-0.2 -0.867 22.5-179.7 -90.5 112.8 -4.3 -0.8 33.2 60 62 A N - 0 0 25 3,-1.8 4,-0.1 -2,-0.7 -1,-0.1 0.282 53.1-100.9-103.0 13.8 -6.9 1.0 31.0 61 63 A G S S+ 0 0 7 2,-0.5 3,-0.1 166,-0.2 106,-0.1 0.355 116.6 51.0 86.2 -6.4 -9.4 -1.9 31.0 62 64 A H S S- 0 0 34 1,-0.5 2,-0.3 -58,-0.1 166,-0.1 0.515 124.8 -21.6-131.3 -18.2 -8.4 -3.2 27.6 63 65 A A S S- 0 0 2 165,-0.1 -3,-1.8 -5,-0.1 -1,-0.5 -0.872 71.0 -95.8-163.0-173.7 -4.6 -3.5 27.8 64 66 A F E -E 59 0B 0 -2,-0.3 29,-0.5 29,-0.3 2,-0.4 -0.993 34.9-154.9-116.7 134.7 -1.8 -2.1 29.9 65 67 A N E -E 58 0B 20 -7,-2.6 -7,-2.4 -2,-0.4 2,-0.6 -0.917 10.7-151.2-106.0 139.5 0.1 1.0 28.5 66 68 A V E -EG 57 91B 0 25,-2.6 25,-1.9 -2,-0.4 2,-0.3 -0.951 28.2-151.2 -98.5 125.5 3.6 2.0 29.4 67 69 A E E -EG 56 90B 49 -11,-3.0 -12,-3.3 -2,-0.6 -11,-1.1 -0.709 10.1-160.6-108.4 143.5 3.6 5.8 29.0 68 70 A F E -E 54 0B 8 21,-2.5 2,-0.6 -2,-0.3 -14,-0.2 -0.838 31.0-100.6-117.7 156.6 6.6 8.0 28.0 69 71 A D + 0 0 37 -16,-2.7 -16,-0.3 -2,-0.3 5,-0.2 -0.686 40.6 172.9 -76.3 116.7 7.3 11.8 28.4 70 72 A D + 0 0 45 -2,-0.6 -1,-0.1 1,-0.1 17,-0.1 -0.147 45.1 108.2-119.6 34.9 6.6 13.1 24.8 71 73 A S S S+ 0 0 80 56,-0.0 2,-0.3 1,-0.0 -1,-0.1 0.491 89.0 19.8 -91.4 -3.5 7.0 16.8 25.7 72 74 A Q S S- 0 0 118 -3,-0.2 2,-2.1 3,-0.0 3,-0.4 -0.939 100.2 -82.8-151.1 169.7 10.3 16.9 23.7 73 75 A D S S+ 0 0 87 -2,-0.3 3,-0.2 1,-0.2 -22,-0.1 -0.292 77.0 128.1 -72.6 63.9 12.1 14.8 21.0 74 76 A K S S+ 0 0 53 -2,-2.1 -23,-0.9 1,-0.3 2,-0.4 0.794 75.1 21.5 -94.9 -37.0 13.6 12.2 23.4 75 77 A A S S+ 0 0 7 -3,-0.4 13,-2.5 -24,-0.2 2,-0.3 -0.923 85.5 164.8-132.3 108.0 12.5 8.9 21.9 76 78 A V E -DH 48 87B 10 -28,-2.2 -28,-2.8 -2,-0.4 2,-0.4 -0.915 32.0-147.3-133.0 156.6 11.7 9.3 18.2 77 79 A L E +DH 47 86B 0 9,-2.7 9,-2.3 -2,-0.3 2,-0.3 -0.959 29.1 158.7-119.1 131.8 11.1 7.2 15.0 78 80 A K E +D 46 0B 99 -32,-2.2 -32,-2.5 -2,-0.4 7,-0.1 -0.892 37.7 34.1-138.3 171.3 12.2 8.6 11.6 79 81 A G E > S+D 45 0B 20 5,-0.3 3,-2.4 -2,-0.3 -34,-0.3 -0.298 71.4 86.5 82.6-154.8 13.0 7.2 8.2 80 82 A G T 3 S- 0 0 2 -36,-2.0 -37,-0.9 1,-0.3 -1,-0.2 -0.371 119.9 -25.9 53.4-135.6 11.4 4.2 6.7 81 83 A P T 3 S+ 0 0 43 0, 0.0 -1,-0.3 0, 0.0 2,-0.2 0.407 115.7 111.3 -86.3 7.4 8.2 5.3 4.9 82 84 A L < - 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