==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=18-DEC-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 26-MAY-11 3S78 . COMPND 2 MOLECULE: CARBONIC ANHYDRASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR P.W.SNYDER,A.HEROUX,G.W.WHITESIDES . 258 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11896.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 165 64.0 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 . 26 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 12.8 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 B H 0 0 148 0, 0.0 2,-0.3 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 148.7 31.9 -1.1 5.3 2 4 B H - 0 0 75 7,-0.0 2,-0.1 0, 0.0 0, 0.0 -0.778 360.0 -26.6 153.1-164.9 30.8 0.7 8.5 3 5 B W S S+ 0 0 54 -2,-0.3 2,-0.2 2,-0.0 7,-0.2 -0.456 75.2 142.1 -77.8 156.9 28.8 -1.2 11.2 4 6 B G - 0 0 7 5,-3.2 10,-0.1 2,-0.2 58,-0.1 -0.758 59.9 -85.0-159.9-148.5 26.6 -4.2 10.2 5 7 B Y S S+ 0 0 33 -2,-0.2 5,-0.2 5,-0.2 237,-0.1 0.429 82.8 106.8-116.4 -1.1 25.5 -7.6 11.4 6 8 B G S > S- 0 0 41 4,-0.1 4,-1.7 1,-0.1 3,-0.3 -0.020 87.3 -93.0 -70.3 177.4 28.4 -9.8 10.2 7 9 B K T 4 S+ 0 0 189 1,-0.2 -1,-0.1 2,-0.2 5,-0.0 0.839 124.6 42.2 -63.8 -25.3 31.2 -11.5 12.2 8 10 B H T 4 S+ 0 0 161 1,-0.1 -1,-0.2 4,-0.0 -3,-0.0 0.711 131.3 17.5 -97.2 -17.8 33.5 -8.5 11.5 9 11 B N T 4 S+ 0 0 53 -3,-0.3 -5,-3.2 -6,-0.1 -2,-0.2 0.165 95.8 120.8-136.6 14.6 31.2 -5.5 12.0 10 12 B G S >X S- 0 0 3 -4,-1.7 3,-2.3 -5,-0.2 4,-0.7 0.037 83.9 -66.8 -76.0-174.0 28.2 -7.0 14.0 11 13 B P T 34 S+ 0 0 28 0, 0.0 3,-0.4 0, 0.0 4,-0.4 0.672 128.3 61.5 -51.5 -29.0 26.9 -6.1 17.5 12 14 B E T 34 S+ 0 0 144 1,-0.2 3,-0.1 2,-0.1 -5,-0.0 0.690 109.0 44.1 -74.3 -17.5 30.0 -7.3 19.4 13 15 B H T X> S+ 0 0 55 -3,-2.3 3,-1.8 1,-0.1 4,-0.6 0.554 86.8 91.6 -94.1 -19.1 32.1 -4.7 17.5 14 16 B W H >X S+ 0 0 5 -4,-0.7 4,-1.8 -3,-0.4 3,-0.5 0.802 73.5 69.5 -58.0 -29.4 29.6 -1.7 17.8 15 17 B H H 34 S+ 0 0 68 -4,-0.4 -1,-0.3 1,-0.2 7,-0.1 0.700 85.8 66.0 -61.1 -25.5 31.2 -0.4 20.9 16 18 B K H <4 S+ 0 0 130 -3,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.921 117.0 26.4 -73.3 -40.8 34.5 0.7 19.3 17 19 B D H << S+ 0 0 128 -4,-0.6 -1,-0.2 -3,-0.5 -2,-0.2 0.694 134.7 34.8 -85.8 -18.3 32.7 3.4 17.3 18 20 B F >< - 0 0 61 -4,-1.8 3,-2.5 1,-0.1 -1,-0.2 -0.736 66.3-176.5-140.3 81.4 29.8 4.0 19.6 19 21 B P G > S+ 0 0 101 0, 0.0 3,-1.7 0, 0.0 -4,-0.1 0.671 77.2 75.7 -57.1 -22.0 31.0 3.6 23.2 20 22 B I G > + 0 0 68 1,-0.3 3,-2.8 179,-0.2 5,-0.2 0.659 69.9 90.9 -66.2 -14.9 27.5 4.0 24.6 21 23 B A G < S+ 0 0 6 -3,-2.5 -1,-0.3 1,-0.3 -6,-0.1 0.779 92.1 43.7 -39.0 -35.3 27.0 0.4 23.3 22 24 B K G < S+ 0 0 142 -3,-1.7 -1,-0.3 -7,-0.1 -2,-0.2 0.057 95.7 124.2-104.8 26.2 28.1 -0.6 26.9 23 25 B G S < S- 0 0 14 -3,-2.8 3,-0.5 1,-0.1 -3,-0.0 0.035 74.3 -98.3 -81.6-168.9 26.0 2.1 28.7 24 26 B E S S+ 0 0 122 1,-0.2 226,-0.2 225,-0.1 -1,-0.1 0.527 112.9 40.4 -90.1 -10.3 23.4 1.9 31.4 25 27 B R S S+ 0 0 47 -5,-0.2 -1,-0.2 224,-0.1 2,-0.2 -0.240 78.4 152.4-136.1 56.7 20.2 2.0 29.4 26 28 B Q - 0 0 1 -3,-0.5 220,-0.2 221,-0.3 170,-0.1 -0.503 33.4-102.0 -86.3 150.6 20.9 -0.2 26.2 27 29 B S S S+ 0 0 0 168,-0.5 2,-0.2 -2,-0.2 78,-0.1 -0.926 76.6 38.5-126.7 155.3 18.3 -2.1 24.2 28 30 B P + 0 0 0 0, 0.0 218,-2.8 0, 0.0 2,-0.3 0.555 66.0 178.3 -87.8-178.2 17.0 -4.6 23.5 29 31 B V - 0 0 1 216,-0.3 77,-1.3 -2,-0.2 2,-0.5 -0.916 36.1 -98.3-134.9 167.9 16.6 -6.6 26.8 30 32 B D E -a 106 0A 30 216,-0.4 2,-0.9 -2,-0.3 77,-0.2 -0.757 35.1-137.4 -84.9 134.2 15.2 -9.9 27.9 31 33 B I E -a 107 0A 0 75,-3.1 77,-2.9 -2,-0.5 2,-1.1 -0.836 11.0-159.4 -95.7 100.9 11.7 -9.3 29.4 32 34 B D >> - 0 0 70 -2,-0.9 4,-1.4 75,-0.2 3,-0.6 -0.735 5.9-162.6 -77.6 96.8 11.5 -11.5 32.5 33 35 B T T 34 S+ 0 0 42 -2,-1.1 -1,-0.2 1,-0.3 222,-0.0 0.708 85.7 53.1 -63.7 -20.3 7.7 -11.7 32.7 34 36 B H T 34 S+ 0 0 167 1,-0.1 -1,-0.3 -3,-0.1 -2,-0.1 0.806 111.8 44.5 -85.4 -27.8 7.8 -12.8 36.3 35 37 B T T <4 S+ 0 0 107 -3,-0.6 2,-0.3 2,-0.1 -2,-0.2 0.637 87.8 101.2 -89.1 -11.7 10.0 -9.9 37.4 36 38 B A S < S- 0 0 14 -4,-1.4 2,-0.5 216,-0.1 218,-0.2 -0.581 74.8-126.5 -75.9 130.8 8.2 -7.1 35.5 37 39 B K E -c 254 0B 146 216,-1.6 218,-2.7 -2,-0.3 2,-0.1 -0.683 11.4-124.3 -86.0 123.3 6.0 -5.2 38.0 38 40 B Y E -c 255 0B 110 -2,-0.5 218,-0.2 216,-0.2 220,-0.1 -0.401 26.6-160.3 -49.4 125.0 2.3 -4.8 37.3 39 41 B D > - 0 0 32 216,-2.6 3,-2.3 -2,-0.1 -1,-0.1 -0.806 15.6-174.0-121.9 96.3 1.7 -1.0 37.4 40 42 B P T 3 S+ 0 0 96 0, 0.0 -1,-0.1 0, 0.0 216,-0.0 0.630 83.5 66.7 -62.1 -14.8 -2.1 -0.1 38.0 41 43 B S T 3 S+ 0 0 81 2,-0.1 2,-0.2 0, 0.0 215,-0.1 0.513 75.6 109.0 -83.1 -6.2 -1.1 3.6 37.5 42 44 B L < - 0 0 30 -3,-2.3 3,-0.1 213,-0.2 38,-0.0 -0.543 66.1-132.7 -75.3 139.1 -0.2 3.1 33.8 43 45 B K - 0 0 107 37,-1.3 2,-0.1 -2,-0.2 39,-0.1 -0.387 31.2 -93.6 -78.9 158.3 -2.7 4.6 31.2 44 46 B P - 0 0 112 0, 0.0 36,-1.8 0, 0.0 2,-0.2 -0.508 48.9-103.4 -69.1 153.4 -3.9 2.7 28.3 45 47 B L E -D 79 0B 14 34,-0.3 2,-0.6 141,-0.3 34,-0.2 -0.488 29.9-146.7 -70.8 148.7 -1.8 3.3 25.3 46 48 B S E +D 78 0B 47 32,-3.0 32,-1.9 -2,-0.2 2,-0.7 -0.964 17.8 179.6-122.7 110.1 -3.4 5.5 22.7 47 49 B V E +D 77 0B 33 -2,-0.6 2,-0.7 30,-0.2 30,-0.2 -0.932 1.2 177.6-111.1 106.9 -2.5 4.7 19.1 48 50 B S E +D 76 0B 47 28,-3.0 28,-2.3 -2,-0.7 3,-0.2 -0.838 20.9 146.6-116.5 98.8 -4.1 7.0 16.7 49 51 B Y > + 0 0 3 -2,-0.7 3,-2.1 26,-0.3 130,-0.2 0.175 32.4 119.2-114.4 6.2 -3.0 6.1 13.2 50 52 B D T 3 S+ 0 0 100 1,-0.3 -1,-0.1 -3,-0.1 25,-0.1 0.897 85.0 31.8 -36.4 -53.1 -6.4 7.1 11.7 51 53 B Q T 3 S+ 0 0 111 23,-1.1 -1,-0.3 -3,-0.2 24,-0.2 0.107 84.6 151.5-101.8 25.0 -4.7 9.8 9.5 52 54 B A < - 0 0 22 -3,-2.1 2,-0.5 22,-0.1 18,-0.1 -0.290 29.3-157.7 -60.3 137.2 -1.3 8.2 8.9 53 55 B T - 0 0 46 16,-0.4 16,-3.2 122,-0.1 2,-0.1 -0.871 3.2-163.3-119.6 101.2 0.4 9.1 5.6 54 56 B S E +E 68 0B 0 -2,-0.5 121,-0.6 122,-0.3 14,-0.3 -0.453 12.4 173.4 -75.3 150.0 3.1 6.7 4.3 55 57 B L E - 0 0 72 12,-3.2 118,-2.5 1,-0.4 2,-0.3 0.675 52.6 -3.0-119.2 -46.0 5.4 8.1 1.6 56 58 B R E -EF 67 172B 97 11,-1.3 11,-2.8 116,-0.3 2,-0.4 -0.977 45.8-136.6-157.6 153.3 8.2 5.7 0.8 57 59 B I E -EF 66 171B 0 114,-2.9 114,-2.6 -2,-0.3 2,-0.4 -0.989 28.6-172.4-126.7 136.7 9.8 2.5 1.5 58 60 B L E -EF 65 170B 35 7,-2.7 7,-2.5 -2,-0.4 2,-0.6 -0.983 27.0-147.3-135.5 130.8 13.6 2.2 1.7 59 61 B N E +E 64 0B 1 110,-2.8 109,-3.0 -2,-0.4 5,-0.2 -0.871 20.6 179.6 -90.2 118.5 16.3 -0.4 1.9 60 62 B N - 0 0 50 3,-2.1 4,-0.1 -2,-0.6 -1,-0.1 0.357 54.7 -99.1-107.8 8.7 19.0 1.3 4.0 61 63 B G S S+ 0 0 7 2,-0.6 106,-0.1 166,-0.2 3,-0.1 0.356 118.6 55.8 92.2 -10.1 21.4 -1.6 4.0 62 64 B H S S- 0 0 41 1,-0.6 2,-0.2 -58,-0.1 166,-0.1 0.654 123.3 -33.3-118.9 -35.7 20.4 -2.7 7.5 63 65 B A S S- 0 0 6 -5,-0.1 -3,-2.1 165,-0.1 -2,-0.6 -0.818 71.0 -87.4-158.7-168.7 16.6 -3.2 7.2 64 66 B F E -E 59 0B 0 29,-0.3 29,-0.5 -2,-0.2 2,-0.5 -0.980 34.5-154.2-118.0 142.8 13.8 -1.6 5.2 65 67 B N E -E 58 0B 20 -7,-2.5 -7,-2.7 -2,-0.4 2,-0.7 -0.927 9.6-154.1-111.3 133.6 12.0 1.4 6.5 66 68 B V E -EG 57 91B 0 25,-3.1 25,-2.0 -2,-0.5 2,-0.3 -0.960 28.4-153.4 -98.6 118.6 8.5 2.4 5.7 67 69 B E E -EG 56 90B 53 -11,-2.8 -12,-3.2 -2,-0.7 -11,-1.3 -0.740 7.7-156.3-101.9 143.7 8.5 6.3 6.2 68 70 B F E -E 54 0B 7 21,-3.0 2,-0.7 -2,-0.3 -14,-0.2 -0.717 29.5-103.2-115.7 153.4 5.6 8.5 7.1 69 71 B D + 0 0 39 -16,-3.2 -16,-0.4 -2,-0.3 3,-0.3 -0.757 41.0 173.5 -76.8 113.5 4.9 12.2 6.6 70 72 B D + 0 0 40 -2,-0.7 -1,-0.1 1,-0.2 17,-0.1 0.009 45.8 106.5-114.9 23.3 5.5 13.5 10.1 71 73 B S S S+ 0 0 82 2,-0.0 2,-0.3 56,-0.0 -1,-0.2 0.491 85.9 32.2 -81.9 -3.1 5.1 17.2 9.3 72 74 B Q S S- 0 0 108 -3,-0.3 2,-1.9 3,-0.0 3,-0.4 -0.966 98.9 -91.6-142.4 167.8 1.7 17.2 11.1 73 75 B D S S+ 0 0 87 -2,-0.3 3,-0.2 1,-0.2 -3,-0.1 -0.536 77.4 126.4 -79.2 81.0 0.0 15.4 14.0 74 76 B K S S+ 0 0 54 -2,-1.9 -23,-1.1 1,-0.3 2,-0.4 0.717 70.6 25.6-110.2 -34.7 -1.5 12.6 11.9 75 77 B A S S+ 0 0 6 -3,-0.4 13,-2.6 -24,-0.2 2,-0.4 -0.908 82.3 171.4-137.2 96.7 -0.3 9.3 13.4 76 78 B V E -DH 48 87B 7 -28,-2.3 -28,-3.0 -2,-0.4 2,-0.4 -0.908 28.4-153.7-120.4 149.3 0.4 9.7 17.1 77 79 B L E +DH 47 86B 0 9,-2.9 9,-2.3 -2,-0.4 2,-0.3 -0.933 32.4 146.7-110.1 139.6 1.2 7.6 20.1 78 80 B K E +D 46 0B 83 -32,-1.9 -32,-3.0 -2,-0.4 2,-0.2 -0.929 36.3 40.4-155.3 176.0 0.3 8.9 23.6 79 81 B G E > S+D 45 0B 18 5,-0.5 3,-2.6 3,-0.4 -34,-0.3 -0.491 73.0 88.2 73.8-146.9 -0.8 7.7 26.9 80 82 B G T 3 S- 0 0 0 -36,-1.8 -37,-1.3 1,-0.3 -1,-0.1 -0.362 121.4 -28.3 53.0-133.2 0.7 4.5 28.3 81 83 B P T 3 S+ 0 0 37 0, 0.0 -1,-0.3 0, 0.0 2,-0.2 0.428 115.8 112.4 -82.9 2.0 3.9 5.6 30.2 82 84 B L < - 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I 0 116B 0 -29,-0.5 2,-0.4 -2,-0.3 -29,-0.3 -0.863 1.6-146.7-128.1 159.0 11.5 -5.0 11.3 94 96 B H E + I 0 115B 4 21,-2.2 21,-2.4 -2,-0.3 2,-0.3 -0.991 33.0 172.5-118.5 133.1 14.3 -7.1 12.6 95 97 B W E - I 0 114B 0 -2,-0.4 146,-1.2 19,-0.2 145,-0.9 -0.929 23.4-116.3-141.6 173.0 14.3 -10.8 11.5 96 98 B G - 0 0 0 17,-1.4 6,-0.1 5,-0.6 3,-0.1 -0.331 23.3-123.2-103.4 170.4 16.1 -14.1 11.5 97 99 B S S S+ 0 0 42 142,-0.2 2,-0.3 1,-0.1 -1,-0.1 0.652 106.8 25.1 -79.9 -19.0 17.7 -16.5 9.0 98 100 B L S > S- 0 0 102 3,-0.2 3,-1.5 15,-0.1 -2,-0.2 -0.935 90.2-108.6-140.6 162.1 15.4 -19.1 10.6 99 101 B D T 3 S+ 0 0 74 -2,-0.3 48,-0.1 1,-0.3 15,-0.1 0.726 109.7 74.9 -65.2 -21.8 12.0 -18.9 12.4 100 102 B G T 3 S+ 0 0 58 13,-0.1 2,-0.3 2,-0.1 -1,-0.3 0.508 107.2 17.6 -70.4 -2.0 13.7 -19.8 15.6 101 103 B Q < + 0 0 47 -3,-1.5 -5,-0.6 12,-0.1 -3,-0.2 -0.979 66.1 105.2-159.3 168.7 15.3 -16.3 15.9 102 104 B G + 0 0 0 1,-0.5 13,-0.3 -2,-0.3 11,-0.2 -0.036 53.4 107.9 140.8 -37.6 15.0 -12.7 14.7 103 105 B S - 0 0 1 9,-2.3 -1,-0.5 11,-0.3 12,-0.1 -0.316 52.7-152.3 -68.0 157.4 13.4 -10.7 17.5 104 106 B E S S+ 0 0 1 -10,-0.1 141,-0.1 140,-0.1 -1,-0.1 0.893 83.6 52.4 -93.2 -56.4 15.5 -8.2 19.5 105 107 B H S S- 0 0 0 -77,-0.1 7,-0.5 139,-0.1 2,-0.3 -0.453 76.7-157.7 -71.6 154.1 13.6 -8.3 22.7 106 108 B T E -a 30 0A 11 -77,-1.3 -75,-3.1 5,-0.1 2,-0.5 -0.922 11.2-138.7-128.4 155.4 13.0 -11.7 24.1 107 109 B V E > S-aB 31 110A 17 3,-1.7 3,-1.9 -2,-0.3 -75,-0.2 -0.966 88.4 -21.2-120.9 113.1 10.3 -12.8 26.6 108 110 B D T 3 S- 0 0 67 -77,-2.9 -1,-0.2 -2,-0.5 -76,-0.1 0.908 128.8 -53.1 44.3 49.7 11.7 -15.2 29.3 109 111 B K T 3 S+ 0 0 158 1,-0.3 2,-0.3 -78,-0.1 -1,-0.3 0.295 105.8 139.1 74.3 -6.4 14.5 -15.9 26.9 110 112 B K B < -B 107 0A 109 -3,-1.9 -3,-1.7 -9,-0.0 2,-0.5 -0.559 41.2-151.0 -69.3 128.8 12.0 -16.8 24.1 111 113 B K - 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