==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 08-MAR-10 3M2Z . COMPND 2 MOLECULE: CARBONIC ANHYDRASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.SCHULZE WISCHELER,A.HEINE,G.KLEBE . 257 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11710.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 162 63.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 18 7.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 56 21.8 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 . 20 7.8 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 . 1 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 0 146 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 145.7 28.7 4.9 7.8 2 4 A H + 0 0 148 2,-0.0 0, 0.0 0, 0.0 0, 0.0 0.865 360.0 85.9 -70.6 -39.9 31.3 2.4 9.1 3 5 A W + 0 0 33 1,-0.1 2,-0.2 11,-0.1 7,-0.2 -0.227 47.7 138.2 -68.3 155.7 29.1 0.6 11.6 4 6 A G - 0 0 9 5,-2.2 10,-0.1 2,-0.2 -1,-0.1 -0.748 61.3 -80.9-160.8-148.6 26.9 -2.4 10.7 5 7 A Y S S+ 0 0 41 -2,-0.2 5,-0.2 5,-0.2 237,-0.1 0.156 83.4 107.3-119.6 13.6 25.8 -5.8 12.0 6 8 A G S >> S- 0 0 37 4,-0.1 4,-2.6 1,-0.1 3,-0.6 -0.344 84.7 -95.5 -94.9 176.8 28.8 -8.0 11.0 7 9 A K T 34 S+ 0 0 85 1,-0.2 -1,-0.1 2,-0.2 5,-0.0 0.829 124.0 39.6 -54.4 -35.1 31.6 -9.6 12.8 8 10 A H T 34 S+ 0 0 168 1,-0.1 -1,-0.2 5,-0.0 -3,-0.0 0.571 133.4 18.5 -97.6 -10.5 33.9 -6.7 12.1 9 11 A N T <4 S+ 0 0 51 -3,-0.6 -5,-2.2 -6,-0.1 -2,-0.2 0.319 96.6 118.8-139.2 10.1 31.6 -3.7 12.5 10 12 A G S >X S- 0 0 2 -4,-2.6 3,-3.2 -5,-0.2 4,-0.9 0.144 83.3 -67.4 -72.0-178.9 28.7 -5.1 14.6 11 13 A P T 34 S+ 0 0 29 0, 0.0 4,-0.4 0, 0.0 3,-0.3 0.743 128.7 59.9 -43.6 -33.5 27.2 -4.3 17.9 12 14 A E T 34 S+ 0 0 146 1,-0.2 3,-0.1 2,-0.1 -5,-0.1 0.651 110.2 44.2 -75.7 -10.6 30.3 -5.5 19.8 13 15 A H T X4 S+ 0 0 60 -3,-3.2 3,-1.6 1,-0.1 4,-0.5 0.627 87.2 88.9-102.0 -15.6 32.3 -3.0 17.9 14 16 A W G >X S+ 0 0 6 -4,-0.9 4,-2.6 -3,-0.3 3,-0.8 0.774 72.7 72.2 -58.5 -28.8 30.1 0.1 18.2 15 17 A H G 34 S+ 0 0 65 -4,-0.4 -1,-0.3 1,-0.2 7,-0.1 0.757 85.5 66.3 -64.7 -22.9 31.5 1.4 21.5 16 18 A K G <4 S+ 0 0 140 -3,-1.6 -1,-0.2 1,-0.2 -2,-0.2 0.908 118.0 22.8 -68.0 -38.0 34.8 2.5 19.9 17 19 A D T <4 S+ 0 0 109 -3,-0.8 -2,-0.2 -4,-0.5 -1,-0.2 0.729 136.4 36.9 -93.4 -24.7 33.1 5.2 17.9 18 20 A F >< + 0 0 56 -4,-2.6 3,-2.5 1,-0.1 -1,-0.2 -0.768 66.2 179.4-126.2 79.9 30.1 5.6 20.1 19 21 A P G > S+ 0 0 98 0, 0.0 3,-2.0 0, 0.0 -4,-0.1 0.732 74.6 76.4 -59.1 -19.8 31.2 5.1 23.7 20 22 A I G > S+ 0 0 60 1,-0.3 3,-2.4 179,-0.2 5,-0.2 0.690 71.3 86.8 -66.9 -11.2 27.7 5.7 25.0 21 23 A A G < S+ 0 0 6 -3,-2.5 -1,-0.3 1,-0.3 -6,-0.1 0.744 90.9 47.0 -52.4 -25.3 27.1 2.1 23.7 22 24 A K G < S+ 0 0 140 -3,-2.0 -1,-0.3 -4,-0.1 -2,-0.2 0.004 97.6 128.8-105.2 23.7 28.4 1.1 27.2 23 25 A G S < S- 0 0 11 -3,-2.4 3,-0.5 1,-0.1 -3,-0.1 0.075 72.4-101.0 -77.4-173.1 26.1 3.7 28.9 24 26 A E S S+ 0 0 120 1,-0.2 226,-0.3 225,-0.1 -1,-0.1 0.502 112.0 34.1 -90.6 -13.2 23.6 3.6 31.7 25 27 A R S S+ 0 0 46 -5,-0.2 -1,-0.2 224,-0.1 2,-0.2 -0.210 79.1 154.5-141.8 56.9 20.4 3.6 29.7 26 28 A Q - 0 0 0 -3,-0.5 220,-0.2 221,-0.4 170,-0.1 -0.489 33.2 -99.9 -86.8 152.7 21.0 1.5 26.5 27 29 A S S S+ 0 0 0 168,-0.5 2,-0.2 -2,-0.2 -2,-0.0 -0.865 78.3 37.8-126.7 153.5 18.4 -0.3 24.5 28 30 A P + 0 0 0 0, 0.0 218,-2.7 0, 0.0 2,-0.3 0.615 66.3 175.5 -81.6-178.2 17.1 -2.9 23.8 29 31 A V - 0 0 1 216,-0.3 77,-1.3 -2,-0.2 2,-0.4 -0.915 36.6 -97.3-138.4 165.7 16.8 -4.9 27.0 30 32 A D E -a 106 0A 32 216,-0.4 2,-0.8 -2,-0.3 77,-0.2 -0.730 33.9-139.4 -81.5 134.4 15.3 -8.1 28.2 31 33 A I E -a 107 0A 0 75,-3.3 77,-2.5 -2,-0.4 2,-0.9 -0.895 11.0-158.4-100.1 106.5 11.9 -7.6 29.7 32 34 A D >> - 0 0 60 -2,-0.8 4,-2.2 75,-0.2 3,-1.4 -0.766 1.3-162.3 -85.8 106.9 11.6 -9.9 32.8 33 35 A T T 34 S+ 0 0 45 -2,-0.9 -1,-0.2 1,-0.3 222,-0.0 0.709 85.4 58.8 -67.7 -19.0 7.8 -10.2 33.2 34 36 A H T 34 S+ 0 0 147 1,-0.1 -1,-0.3 3,-0.0 -2,-0.0 0.625 113.6 35.7 -87.5 -13.1 8.2 -11.4 36.7 35 37 A T T <4 S+ 0 0 99 -3,-1.4 -2,-0.2 2,-0.1 2,-0.2 0.655 89.7 102.4-113.9 -18.2 10.0 -8.4 37.9 36 38 A A < - 0 0 19 -4,-2.2 2,-0.4 218,-0.1 218,-0.2 -0.485 67.3-140.0 -59.9 132.8 8.3 -5.7 35.8 37 39 A K E -c 254 0B 138 216,-1.5 218,-2.4 -2,-0.2 2,-0.1 -0.840 9.2-116.7-106.6 133.5 5.9 -3.9 38.1 38 40 A Y E -c 255 0B 118 -2,-0.4 218,-0.2 216,-0.2 3,-0.1 -0.386 27.5-156.5 -58.7 134.5 2.4 -2.7 37.4 39 41 A D > - 0 0 36 216,-2.4 3,-1.7 1,-0.1 -1,-0.1 -0.916 13.7-172.3-121.2 104.1 2.2 1.1 37.7 40 42 A P T 3 S+ 0 0 96 0, 0.0 -1,-0.1 0, 0.0 216,-0.0 0.662 82.7 71.3 -73.6 -11.1 -1.3 2.5 38.5 41 43 A S T 3 S+ 0 0 92 -3,-0.1 2,-0.1 2,-0.1 215,-0.1 0.690 72.0 108.3 -76.4 -12.7 0.0 6.0 38.0 42 44 A L < - 0 0 34 -3,-1.7 3,-0.1 213,-0.2 38,-0.0 -0.448 66.0-141.1 -66.1 132.9 0.3 5.3 34.2 43 45 A K - 0 0 51 37,-1.4 37,-0.4 1,-0.1 39,-0.1 -0.500 38.1 -73.3 -83.7 161.3 -2.3 7.3 32.4 44 46 A P - 0 0 117 0, 0.0 36,-1.5 0, 0.0 2,-0.3 -0.243 50.7-116.4 -53.2 144.4 -4.1 5.7 29.4 45 47 A L E -D 79 0B 25 34,-0.3 2,-0.5 141,-0.1 34,-0.2 -0.684 24.7-158.6 -87.0 137.8 -2.1 5.4 26.2 46 48 A S E -D 78 0B 46 32,-3.0 32,-2.8 -2,-0.3 2,-0.7 -0.952 12.9-179.8-127.2 108.2 -3.3 7.4 23.1 47 49 A V E -D 77 0B 33 -2,-0.5 2,-0.8 30,-0.2 30,-0.2 -0.931 9.5-178.6-104.5 101.9 -2.2 6.3 19.6 48 50 A S E +D 76 0B 38 28,-2.8 28,-2.2 -2,-0.7 3,-0.2 -0.816 22.3 144.6-113.3 87.8 -3.9 8.8 17.3 49 51 A Y > + 0 0 2 -2,-0.8 3,-1.9 26,-0.2 130,-0.2 0.213 31.7 110.0-109.7 10.4 -3.0 7.9 13.8 50 52 A D T 3 S+ 0 0 85 1,-0.3 -1,-0.1 128,-0.1 25,-0.1 0.887 85.7 40.0 -62.4 -34.0 -6.1 8.8 11.9 51 53 A Q T 3 S+ 0 0 130 23,-0.8 -1,-0.3 -3,-0.2 24,-0.2 0.194 82.9 150.2-101.0 24.7 -4.6 11.7 10.0 52 54 A A < - 0 0 22 -3,-1.9 2,-0.5 1,-0.1 23,-0.1 -0.245 30.0-161.0 -57.7 140.9 -1.3 10.1 9.4 53 55 A T - 0 0 48 16,-0.3 16,-2.7 122,-0.1 2,-0.1 -0.851 6.6-167.5-127.3 93.4 0.4 11.3 6.2 54 56 A S E +E 68 0B 2 -2,-0.5 121,-0.6 122,-0.4 14,-0.3 -0.471 8.5 178.5 -80.3 157.6 3.1 8.9 4.9 55 57 A L E - 0 0 75 12,-3.0 118,-2.3 1,-0.4 2,-0.3 0.718 49.5 -11.5-121.1 -53.4 5.5 10.0 2.2 56 58 A R E -EF 67 172B 86 11,-0.7 11,-2.8 116,-0.3 2,-0.4 -0.968 45.4-129.2-157.0 155.6 8.1 7.6 1.1 57 59 A I E -EF 66 171B 0 114,-2.6 114,-2.2 -2,-0.3 2,-0.4 -0.978 28.3-169.7-120.0 136.3 9.9 4.3 1.8 58 60 A L E -EF 65 170B 33 7,-2.6 7,-2.4 -2,-0.4 2,-0.8 -0.982 24.3-145.9-130.0 130.9 13.7 4.2 1.9 59 61 A N E -E 64 0B 0 110,-2.9 109,-3.0 -2,-0.4 5,-0.2 -0.856 21.8-178.0 -87.5 111.3 16.3 1.4 2.0 60 62 A N - 0 0 60 3,-1.9 4,-0.1 -2,-0.8 -1,-0.1 0.233 51.1 -99.7-100.2 15.6 18.9 3.0 4.1 61 63 A G S S+ 0 0 8 2,-0.4 106,-0.1 166,-0.2 3,-0.1 0.162 118.0 48.7 93.0 -19.1 21.5 0.2 3.9 62 64 A C S S- 0 0 13 1,-0.4 2,-0.2 -58,-0.1 -1,-0.1 0.611 125.6 -23.7-122.8 -36.0 20.5 -1.2 7.4 63 65 A A S S- 0 0 8 -5,-0.1 -3,-1.9 165,-0.1 2,-0.4 -0.815 71.9 -92.7-152.7-167.2 16.7 -1.4 7.3 64 66 A F E -E 59 0B 0 29,-0.3 2,-0.5 -2,-0.2 29,-0.5 -0.994 33.2-153.3-121.7 136.5 13.9 0.3 5.4 65 67 A N E -E 58 0B 23 -7,-2.4 -7,-2.6 -2,-0.4 2,-0.6 -0.907 8.1-154.8-104.8 131.9 12.1 3.4 6.8 66 68 A V E -EG 57 91B 0 25,-2.6 25,-2.1 -2,-0.5 2,-0.3 -0.938 27.4-151.4 -97.7 122.7 8.6 4.5 6.0 67 69 A E E -EG 56 90B 39 -11,-2.8 -12,-3.0 -2,-0.6 -11,-0.7 -0.688 10.8-161.3-104.6 145.9 8.6 8.3 6.5 68 70 A F E -E 54 0B 7 21,-2.7 2,-0.7 -2,-0.3 -14,-0.2 -0.875 30.2-103.8-125.0 155.9 5.8 10.6 7.6 69 71 A D + 0 0 39 -16,-2.7 -16,-0.3 -2,-0.3 3,-0.2 -0.760 38.2 172.6 -78.4 113.0 5.0 14.3 7.4 70 72 A D + 0 0 42 -2,-0.7 -1,-0.1 1,-0.1 17,-0.1 -0.113 45.2 109.6-116.2 26.8 5.6 15.5 10.9 71 73 A S S S+ 0 0 72 56,-0.0 2,-0.3 2,-0.0 -1,-0.1 0.718 89.6 17.2 -72.3 -28.7 5.3 19.2 10.1 72 74 A Q S S- 0 0 117 -3,-0.2 2,-1.7 3,-0.0 3,-0.4 -0.872 101.4 -80.2-137.3 172.8 2.0 19.2 12.0 73 75 A D S S+ 0 0 93 -2,-0.3 3,-0.2 1,-0.2 -3,-0.1 -0.553 75.9 129.5 -73.9 82.8 0.2 17.1 14.6 74 76 A K S S+ 0 0 49 -2,-1.7 -23,-0.8 1,-0.4 2,-0.4 0.727 75.1 19.2-109.9 -33.8 -1.2 14.5 12.2 75 77 A A S S+ 0 0 5 -3,-0.4 13,-2.9 -24,-0.2 -1,-0.4 -0.919 84.7 166.3-137.0 111.1 -0.1 11.2 13.7 76 78 A V E -DH 48 87B 11 -28,-2.2 -28,-2.8 -2,-0.4 2,-0.5 -0.935 32.7-143.5-135.3 156.1 0.7 11.4 17.4 77 79 A L E +DH 47 86B 0 9,-2.8 9,-2.1 -2,-0.3 2,-0.3 -0.968 30.7 163.1-114.1 128.9 1.4 9.4 20.5 78 80 A K E +D 46 0B 98 -32,-2.8 -32,-3.0 -2,-0.5 7,-0.1 -0.840 36.1 22.9-134.7 169.9 0.2 10.8 23.9 79 81 A G E > S+D 45 0B 20 5,-0.4 3,-2.4 3,-0.3 -34,-0.3 -0.206 71.6 88.3 71.0-155.2 -0.5 9.5 27.4 80 82 A G T 3 S- 0 0 6 -36,-1.5 -37,-1.4 -37,-0.4 -1,-0.1 -0.465 120.0 -22.9 59.7-132.3 1.0 6.5 29.0 81 83 A P T 3 S+ 0 0 48 0, 0.0 -1,-0.3 0, 0.0 2,-0.2 0.471 119.7 104.7 -81.0 -5.3 4.2 7.5 30.6 82 84 A L < - 0 0 8 -3,-2.4 2,-0.5 -39,-0.1 -3,-0.3 -0.520 55.5-156.7 -88.5 141.1 4.5 10.5 28.3 83 85 A D + 0 0 149 -2,-0.2 2,-0.1 -5,-0.1 -1,-0.0 -0.952 66.6 0.4-109.9 139.8 3.8 14.1 28.9 84 86 A G S S- 0 0 51 -2,-0.5 -5,-0.4 38,-0.1 2,-0.4 -0.398 101.4 -50.8 84.6-161.9 3.0 16.3 26.0 85 87 A T - 0 0 32 -7,-0.1 38,-2.4 -2,-0.1 2,-0.5 -0.907 39.1-156.6-125.5 144.5 2.7 15.1 22.4 86 88 A Y E -HI 77 122B 5 -9,-2.1 -9,-2.8 -2,-0.4 2,-0.4 -0.955 14.1-142.2-119.0 124.8 4.9 13.0 20.2 87 89 A R E -HI 76 121B 46 34,-2.7 34,-1.9 -2,-0.5 2,-0.3 -0.704 17.8-120.5 -92.7 131.6 4.8 13.2 16.5 88 90 A L E + I 0 120B 2 -13,-2.9 32,-0.3 -2,-0.4 -13,-0.2 -0.544 37.2 164.7 -66.6 125.9 5.3 10.1 14.3 89 91 A I E - 0 0 34 30,-2.7 -21,-2.7 1,-0.4 2,-0.3 0.709 59.9 -22.9-110.8 -35.9 8.3 10.6 12.0 90 92 A Q E -GI 67 119B 36 29,-1.3 29,-3.0 -23,-0.2 -1,-0.4 -0.992 46.4-142.7-164.4 161.3 9.0 7.1 10.7 91 93 A F E +GI 66 118B 0 -25,-2.1 -25,-2.6 -2,-0.3 2,-0.3 -0.985 22.7 163.0-128.6 156.4 8.7 3.4 11.3 92 94 A H E - I 0 117B 23 25,-1.9 25,-3.1 -2,-0.4 2,-0.3 -0.927 22.4-128.8-153.4 173.4 11.1 0.6 10.6 93 95 A F E - 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