==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-OCT-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 05-OCT-11 3U3A . COMPND 2 MOLECULE: CARBONIC ANHYDRASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR D.WEST,R.MCKENNA . 258 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11881.0 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 . 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 . 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 . 23 8.9 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 X H 0 0 180 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 57.5 13.3 -1.5 7.7 2 4 X H - 0 0 162 1,-0.1 0, 0.0 0, 0.0 0, 0.0 -0.230 360.0 -86.3 -71.2 161.0 9.9 -0.2 8.8 3 5 X W + 0 0 48 1,-0.1 2,-0.2 11,-0.1 7,-0.2 -0.256 64.4 133.6 -62.8 154.4 7.8 -1.8 11.5 4 6 X G - 0 0 10 5,-2.6 10,-0.1 2,-0.1 -1,-0.1 -0.821 64.8 -79.0-169.2-148.4 5.5 -4.7 10.5 5 7 X Y S S+ 0 0 36 -2,-0.2 5,-0.2 5,-0.2 237,-0.1 0.153 83.5 109.5-124.6 17.9 4.4 -8.2 11.5 6 8 X G S > S- 0 0 37 1,-0.1 4,-1.3 4,-0.1 3,-0.4 -0.255 84.4 -93.2 -85.9 179.7 7.3 -10.2 10.1 7 9 X K T 4 S+ 0 0 170 1,-0.2 -1,-0.1 2,-0.2 5,-0.1 0.838 123.3 36.0 -59.9 -35.6 10.1 -12.1 12.0 8 10 X H T 4 S+ 0 0 116 1,-0.1 -1,-0.2 5,-0.0 -3,-0.0 0.532 130.3 27.7-103.3 -4.8 12.6 -9.2 11.8 9 11 X N T 4 S+ 0 0 42 -3,-0.4 -5,-2.6 -6,-0.1 -2,-0.2 0.225 92.0 122.2-138.1 14.2 10.2 -6.2 12.2 10 12 X G S >X S- 0 0 0 -4,-1.3 3,-3.0 -5,-0.2 4,-0.8 0.087 81.6 -68.4 -74.5-175.5 7.3 -7.6 14.3 11 13 X P G >4 S+ 0 0 25 0, 0.0 3,-0.6 0, 0.0 4,-0.4 0.758 128.2 60.2 -47.8 -34.8 5.8 -6.6 17.6 12 14 X E G 34 S+ 0 0 127 1,-0.2 3,-0.1 2,-0.1 -2,-0.0 0.624 108.9 45.8 -72.7 -9.2 8.9 -7.7 19.6 13 15 X H G X> S+ 0 0 53 -3,-3.0 3,-1.8 1,-0.1 4,-0.5 0.607 86.4 88.9-101.5 -17.6 11.0 -5.2 17.7 14 16 X W H XX S+ 0 0 4 -4,-0.8 4,-2.6 -3,-0.6 3,-0.9 0.784 73.2 70.4 -57.8 -31.7 8.7 -2.2 17.9 15 17 X H H 34 S+ 0 0 68 -4,-0.4 -1,-0.3 1,-0.2 7,-0.1 0.736 87.5 66.3 -60.4 -23.7 10.1 -0.9 21.1 16 18 X K H <4 S+ 0 0 129 -3,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.905 117.0 24.5 -67.9 -40.7 13.4 0.1 19.4 17 19 X D H << S+ 0 0 114 -3,-0.9 -2,-0.2 -4,-0.5 -1,-0.2 0.742 136.1 36.0 -87.8 -26.3 11.6 2.8 17.3 18 20 X F >< - 0 0 55 -4,-2.6 3,-2.7 1,-0.1 -1,-0.2 -0.755 64.2-177.8-133.4 80.3 8.7 3.3 19.8 19 21 X P G > S+ 0 0 101 0, 0.0 3,-1.9 0, 0.0 -1,-0.1 0.717 77.5 75.3 -56.9 -23.8 9.9 3.0 23.4 20 22 X I G > S+ 0 0 54 1,-0.3 3,-2.5 179,-0.2 -5,-0.1 0.622 71.3 89.5 -64.1 -10.7 6.4 3.5 24.6 21 23 X A G < S+ 0 0 5 -3,-2.7 -1,-0.3 1,-0.3 -6,-0.1 0.775 91.1 43.8 -53.8 -27.6 5.9 -0.1 23.5 22 24 X K G < S+ 0 0 137 -3,-1.9 -1,-0.3 -4,-0.1 -2,-0.2 0.006 97.0 129.6-105.9 24.7 7.0 -1.0 27.0 23 25 X G S < S- 0 0 15 -3,-2.5 3,-0.5 1,-0.1 -3,-0.1 0.106 72.0 -97.5 -75.0-171.8 4.8 1.6 28.6 24 26 X E S S+ 0 0 125 1,-0.2 226,-0.3 225,-0.1 -1,-0.1 0.595 113.1 32.1 -87.2 -14.5 2.3 1.6 31.5 25 27 X R S S+ 0 0 49 224,-0.1 -1,-0.2 168,-0.1 2,-0.2 -0.337 79.2 156.3-142.2 57.3 -1.0 1.4 29.5 26 28 X Q - 0 0 3 -3,-0.5 220,-0.2 221,-0.4 170,-0.1 -0.511 31.9 -99.9 -85.8 153.8 -0.3 -0.6 26.3 27 29 X S S S+ 0 0 0 168,-0.5 2,-0.2 -2,-0.2 -2,-0.0 -0.893 77.6 39.0-127.7 158.4 -2.8 -2.6 24.3 28 30 X P + 0 0 0 0, 0.0 218,-2.6 0, 0.0 2,-0.3 0.601 66.5 177.3 -78.6-179.1 -4.1 -5.1 23.6 29 31 X V - 0 0 1 216,-0.3 77,-1.3 -2,-0.2 2,-0.4 -0.929 36.0 -98.4-137.7 164.0 -4.5 -7.1 26.8 30 32 X D E -a 106 0A 27 216,-0.4 2,-0.8 -2,-0.3 77,-0.2 -0.710 34.3-139.8 -77.4 133.8 -5.9 -10.4 28.0 31 33 X I E -a 107 0A 0 75,-3.1 77,-2.6 -2,-0.4 2,-0.9 -0.873 10.1-158.4 -98.4 105.3 -9.4 -9.9 29.5 32 34 X D >> - 0 0 70 -2,-0.8 4,-1.5 75,-0.2 3,-1.0 -0.784 4.4-160.7 -84.6 106.2 -9.6 -12.1 32.5 33 35 X T T 34 S+ 0 0 45 -2,-0.9 -1,-0.2 1,-0.3 222,-0.0 0.748 86.1 53.0 -65.7 -25.6 -13.4 -12.4 32.9 34 36 X H T 34 S+ 0 0 171 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.0 0.736 112.4 43.9 -82.9 -19.9 -13.3 -13.5 36.5 35 37 X T T <4 S+ 0 0 113 -3,-1.0 -2,-0.2 2,-0.1 -1,-0.2 0.612 87.2 105.3 -98.5 -16.5 -11.1 -10.6 37.6 36 38 X A < - 0 0 19 -4,-1.5 2,-0.5 218,-0.1 218,-0.2 -0.452 69.2-133.8 -64.3 136.4 -13.0 -7.9 35.6 37 39 X K E -c 254 0B 129 216,-2.1 218,-2.5 -2,-0.1 2,-0.2 -0.832 9.0-124.9-100.3 123.6 -15.1 -5.8 38.0 38 40 X Y E -c 255 0B 89 -2,-0.5 218,-0.2 216,-0.2 220,-0.1 -0.470 26.2-155.7 -59.1 132.1 -18.7 -4.9 37.3 39 41 X D > - 0 0 34 216,-2.5 3,-1.7 -2,-0.2 -1,-0.1 -0.904 14.7-170.4-120.0 103.0 -19.0 -1.2 37.5 40 42 X P T 3 S+ 0 0 97 0, 0.0 -1,-0.1 0, 0.0 216,-0.0 0.667 84.1 67.4 -66.3 -15.9 -22.5 0.1 38.3 41 43 X S T 3 S+ 0 0 90 2,-0.1 2,-0.3 40,-0.0 215,-0.1 0.560 76.4 105.5 -82.3 -8.7 -21.4 3.7 37.6 42 44 X L < - 0 0 31 -3,-1.7 3,-0.1 213,-0.2 38,-0.0 -0.561 65.7-141.0 -71.3 132.0 -21.0 2.9 33.9 43 45 X K - 0 0 114 37,-1.3 39,-0.1 -2,-0.3 3,-0.1 -0.460 33.1 -82.8 -86.2 163.5 -23.7 4.3 31.7 44 46 X P - 0 0 116 0, 0.0 36,-1.2 0, 0.0 2,-0.2 -0.413 52.3-107.0 -65.0 145.5 -25.2 2.4 28.7 45 47 X L E -D 79 0B 19 34,-0.3 2,-0.5 141,-0.2 34,-0.2 -0.474 27.8-149.5 -70.4 142.6 -23.1 2.8 25.6 46 48 X S E +D 78 0B 42 32,-2.9 32,-2.2 -2,-0.2 2,-0.6 -0.952 15.8 179.6-118.5 111.5 -24.6 5.0 22.9 47 49 X V E -D 77 0B 34 -2,-0.5 2,-0.7 30,-0.2 30,-0.2 -0.934 2.1-179.7-111.7 107.0 -23.7 4.1 19.3 48 50 X S E +D 76 0B 43 28,-2.9 28,-2.2 -2,-0.6 3,-0.2 -0.839 22.4 144.0-113.6 94.4 -25.3 6.5 16.9 49 51 X Y > + 0 0 3 -2,-0.7 3,-1.8 26,-0.2 130,-0.2 0.264 34.2 108.0-112.1 7.2 -24.3 5.5 13.3 50 52 X D T 3 S+ 0 0 94 1,-0.3 -1,-0.1 127,-0.1 25,-0.1 0.795 86.9 40.7 -61.3 -28.4 -27.5 6.3 11.4 51 53 X Q T 3 S+ 0 0 128 23,-0.9 -1,-0.3 -3,-0.2 24,-0.2 0.193 84.0 145.8-104.9 15.3 -26.0 9.3 9.7 52 54 X A < - 0 0 24 -3,-1.8 2,-0.5 22,-0.1 123,-0.1 -0.206 33.6-159.0 -55.6 140.0 -22.6 7.7 9.0 53 55 X T - 0 0 44 16,-0.3 16,-2.8 122,-0.1 2,-0.2 -0.868 5.4-165.3-124.5 96.1 -20.9 8.7 5.8 54 56 X S E +E 68 0B 1 -2,-0.5 121,-0.6 122,-0.3 14,-0.3 -0.513 11.4 173.8 -74.4 148.3 -18.3 6.3 4.6 55 57 X L E - 0 0 80 12,-3.1 118,-2.4 1,-0.4 2,-0.3 0.720 49.3 -5.1-119.6 -44.7 -15.9 7.6 1.9 56 58 X R E -EF 67 172B 83 11,-1.0 11,-2.9 116,-0.3 -1,-0.4 -0.964 46.6-134.9-157.3 155.6 -13.1 5.3 0.9 57 59 X I E -EF 66 171B 0 114,-2.4 114,-2.2 -2,-0.3 2,-0.4 -0.993 27.6-170.2-123.3 134.5 -11.4 2.0 1.7 58 60 X L E -EF 65 170B 33 7,-2.2 7,-2.5 -2,-0.4 2,-0.8 -0.986 24.6-146.9-132.1 129.2 -7.6 1.9 1.8 59 61 X N E +E 64 0B 0 110,-2.8 109,-3.1 -2,-0.4 5,-0.2 -0.869 22.3 179.4 -87.1 110.0 -4.9 -0.8 2.0 60 62 X N - 0 0 39 3,-1.9 4,-0.1 -2,-0.8 -1,-0.1 0.276 52.9 -98.4 -99.3 11.6 -2.3 0.9 4.1 61 63 X G S S+ 0 0 16 2,-0.5 106,-0.1 166,-0.2 3,-0.1 0.271 117.9 49.9 92.5 -13.4 0.2 -1.9 4.2 62 64 X H S S- 0 0 50 1,-0.5 2,-0.3 -58,-0.1 166,-0.1 0.525 124.9 -23.3-127.4 -17.4 -0.8 -3.2 7.7 63 65 X A S S- 0 0 2 -5,-0.1 -3,-1.9 165,-0.1 -2,-0.5 -0.902 70.6 -93.2-164.2-173.3 -4.6 -3.5 7.4 64 66 X F E -E 59 0B 0 -2,-0.3 2,-0.5 29,-0.2 29,-0.5 -0.988 33.7-152.6-115.8 138.4 -7.4 -2.0 5.4 65 67 X N E -E 58 0B 23 -7,-2.5 -7,-2.2 -2,-0.4 2,-0.7 -0.921 9.0-153.5-110.1 127.5 -9.2 1.1 6.7 66 68 X V E -EG 57 91B 0 25,-2.8 25,-1.8 -2,-0.5 2,-0.3 -0.909 30.2-152.2 -92.1 114.9 -12.8 2.0 5.8 67 69 X E E -EG 56 90B 47 -11,-2.9 -12,-3.1 -2,-0.7 -11,-1.0 -0.654 10.9-159.9 -99.2 148.3 -12.7 5.8 6.3 68 70 X F E -E 54 0B 9 21,-2.5 2,-0.8 -14,-0.3 -14,-0.2 -0.842 31.4 -99.8-123.9 155.5 -15.6 8.1 7.2 69 71 X D + 0 0 35 -16,-2.8 -16,-0.3 -2,-0.3 3,-0.2 -0.677 42.3 171.4 -70.6 110.2 -16.4 11.8 6.9 70 72 X D + 0 0 41 -2,-0.8 -1,-0.1 1,-0.1 17,-0.1 0.002 47.6 102.5-112.7 26.9 -15.5 13.0 10.4 71 73 X S S S+ 0 0 82 56,-0.0 2,-0.3 2,-0.0 -1,-0.1 0.380 89.7 27.8 -89.6 3.0 -15.9 16.7 9.7 72 74 X Q S S- 0 0 118 -3,-0.2 2,-1.5 3,-0.1 3,-0.4 -0.964 99.2 -88.3-152.2 161.3 -19.3 16.7 11.4 73 75 X D S S+ 0 0 90 -2,-0.3 3,-0.1 1,-0.2 -3,-0.1 -0.617 76.8 126.7 -73.9 91.7 -21.1 14.8 14.2 74 76 X K S S+ 0 0 48 -2,-1.5 -23,-0.9 1,-0.3 2,-0.4 0.685 72.7 23.5-117.4 -40.8 -22.5 12.1 11.9 75 77 X A S S+ 0 0 6 -3,-0.4 13,-3.0 -6,-0.2 2,-0.3 -0.931 84.0 170.3-133.2 105.1 -21.4 8.8 13.4 76 78 X V E -DH 48 87B 15 -28,-2.2 -28,-2.9 -2,-0.4 2,-0.4 -0.906 30.4-151.1-129.7 150.8 -20.7 9.1 17.1 77 79 X L E +DH 47 86B 0 9,-2.8 9,-2.4 -2,-0.3 2,-0.3 -0.949 31.2 153.2-114.2 134.9 -19.9 7.1 20.2 78 80 X K E +D 46 0B 89 -32,-2.2 -32,-2.9 -2,-0.4 7,-0.1 -0.904 34.9 33.8-148.1 173.0 -21.0 8.4 23.6 79 81 X G E > S+D 45 0B 18 5,-0.4 3,-2.4 3,-0.3 -34,-0.3 -0.275 72.9 83.2 74.5-157.4 -21.9 7.2 27.1 80 82 X G T 3 S- 0 0 3 -36,-1.2 -37,-1.3 1,-0.3 -1,-0.2 -0.411 121.7 -21.1 55.7-128.0 -20.5 4.1 28.7 81 83 X P T 3 S+ 0 0 40 0, 0.0 -1,-0.3 0, 0.0 2,-0.2 0.515 117.1 107.7 -84.5 -3.8 -17.1 5.1 30.3 82 84 X L < - 0 0 6 -3,-2.4 2,-0.5 -39,-0.1 -3,-0.3 -0.493 55.4-154.5 -88.4 143.2 -16.9 8.2 28.0 83 85 X D - 0 0 116 -2,-0.2 2,-0.1 53,-0.1 -1,-0.0 -0.947 68.7 -6.1-104.5 130.5 -17.2 11.8 28.8 84 86 X G S S- 0 0 50 -2,-0.5 -5,-0.4 38,-0.1 2,-0.4 -0.338 99.1 -44.0 84.3-162.9 -18.3 13.8 25.7 85 87 X T - 0 0 30 -7,-0.1 38,-2.7 -2,-0.1 2,-0.5 -0.898 41.0-163.5-118.8 129.2 -18.6 12.9 22.1 86 88 X Y E -HI 77 122B 5 -9,-2.4 -9,-2.8 -2,-0.4 2,-0.4 -0.968 14.4-142.8-115.8 129.1 -16.3 10.7 20.0 87 89 X R E -HI 76 121B 47 34,-2.7 34,-2.1 -2,-0.5 2,-0.3 -0.741 18.3-117.3 -95.2 135.1 -16.5 10.8 16.1 88 90 X L E + I 0 120B 2 -13,-3.0 32,-0.2 -2,-0.4 -13,-0.2 -0.494 37.9 165.8 -68.0 125.2 -16.0 7.7 14.0 89 91 X I E - 0 0 34 30,-2.8 -21,-2.5 1,-0.4 2,-0.3 0.742 60.7 -24.3-108.0 -39.2 -13.0 8.2 11.7 90 92 X Q E -GI 67 119B 29 29,-1.2 29,-2.8 -23,-0.2 -1,-0.4 -0.981 47.9-144.5-163.2 159.1 -12.3 4.7 10.4 91 93 X F E +GI 66 118B 0 -25,-1.8 -25,-2.8 -2,-0.3 2,-0.3 -0.963 23.9 161.7-125.8 156.8 -12.7 1.0 11.1 92 94 X H E - I 0 117B 20 25,-1.8 25,-3.1 -2,-0.3 2,-0.3 -0.937 23.6-125.8-156.3 174.7 -10.3 -1.8 10.3 93 95 X F E - I 0 116B 0 -29,-0.5 2,-0.4 -2,-0.3 -29,-0.2 -0.842 0.4-149.1-127.1 163.0 -9.6 -5.4 11.3 94 96 X H E + I 0 115B 2 21,-1.9 21,-2.2 -2,-0.3 2,-0.3 -0.982 31.4 168.7-124.6 139.0 -6.8 -7.7 12.6 95 97 X W E - I 0 114B 2 -2,-0.4 146,-1.2 19,-0.2 145,-0.9 -0.953 24.1-117.9-151.1 169.4 -6.9 -11.3 11.6 96 98 X G - 0 0 0 17,-1.5 6,-0.1 5,-0.6 3,-0.1 -0.430 23.1-122.2-106.4 174.3 -4.9 -14.5 11.5 97 99 X S S S+ 0 0 45 142,-0.2 2,-0.3 -2,-0.1 5,-0.1 0.564 105.8 34.6 -83.0 -13.3 -3.5 -17.0 9.0 98 100 X L S > S- 0 0 107 3,-0.2 3,-1.7 15,-0.1 -2,-0.2 -0.960 89.5-114.0-139.9 152.1 -5.6 -19.6 10.8 99 101 X D T 3 S+ 0 0 75 -2,-0.3 48,-0.2 1,-0.3 15,-0.1 0.756 109.8 68.1 -62.3 -22.2 -9.1 -19.5 12.4 100 102 X G T 3 S+ 0 0 57 13,-0.1 2,-0.3 2,-0.1 -1,-0.3 0.414 107.2 30.0 -82.0 3.3 -7.5 -20.1 15.8 101 103 X Q < + 0 0 51 -3,-1.7 -5,-0.6 12,-0.1 -3,-0.2 -0.964 65.5 97.2-151.2 165.0 -5.7 -16.8 16.0 102 104 X G + 0 0 0 1,-0.5 13,-0.3 -2,-0.3 11,-0.2 -0.000 55.2 106.7 144.1 -32.3 -6.0 -13.2 14.8 103 105 X S - 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