==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 26-APR-07 2UZ9 . COMPND 2 MOLECULE: GUANINE DEAMINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.MOCHE,M.WELIN,C.ARROWSMITH,H.BERGLUND,R.BUSAM,R.COLLINS, . 444 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18127.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 328 73.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 48 10.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 35 7.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, 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 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.5 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 . 0 0.0 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 . 30 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 44 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 136 30.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 3.4 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 4 2 2 1 2 0 0 0 2 0 0 2 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 3 3 1 3 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 . 1 0 1 2 1 0 0 1 0 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 . 1 0 0 0 0 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 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 8 A P 0 0 141 0, 0.0 30,-0.1 0, 0.0 51,-0.1 0.000 360.0 360.0 360.0-178.7 13.2 -25.4 -0.4 2 9 A L - 0 0 28 49,-0.3 28,-0.3 28,-0.1 3,-0.1 -0.196 360.0-142.5 -59.1 144.9 14.4 -22.8 -2.9 3 10 A A S S+ 0 0 45 26,-2.4 2,-0.3 1,-0.3 27,-0.2 0.843 80.6 4.5 -78.0 -36.7 13.2 -23.0 -6.5 4 11 A H E -A 29 0A 49 25,-1.6 25,-2.9 2,-0.0 2,-0.4 -0.996 48.9-168.2-149.2 144.0 16.5 -22.0 -8.0 5 12 A I E -Ab 28 58A 7 52,-0.5 54,-3.5 -2,-0.3 2,-0.4 -0.978 23.3-169.0-125.7 122.8 20.1 -21.3 -7.1 6 13 A F E -Ab 27 59A 3 21,-2.6 21,-2.1 -2,-0.4 2,-0.4 -0.872 10.3-163.2-112.9 144.3 22.1 -19.7 -9.9 7 14 A R E +Ab 26 60A 55 52,-2.7 54,-3.6 -2,-0.4 2,-0.3 -0.998 47.8 64.7-124.9 132.9 25.8 -19.1 -10.2 8 15 A G E S-A 25 0A 8 17,-1.8 17,-2.4 -2,-0.4 2,-0.3 -0.963 84.9 -29.6 152.0-170.2 27.3 -16.7 -12.7 9 16 A T E - c 0 66A 26 56,-0.7 58,-2.5 -2,-0.3 2,-0.4 -0.586 47.4-162.9 -87.0 140.5 27.4 -13.1 -13.8 10 17 A F E -Ac 22 67A 0 12,-1.9 12,-3.7 -2,-0.3 2,-0.5 -0.987 0.4-163.9-124.3 128.3 24.4 -10.8 -13.1 11 18 A V E +A 21 0A 0 56,-2.7 2,-0.3 -2,-0.4 10,-0.2 -0.976 29.8 131.6-121.2 118.4 24.0 -7.5 -14.9 12 19 A H E -A 20 0A 4 8,-2.2 8,-3.5 -2,-0.5 2,-0.3 -0.893 44.8-106.3-153.6-179.8 21.6 -5.0 -13.5 13 20 A S - 0 0 0 367,-0.4 2,-0.2 -2,-0.3 369,-0.2 -0.882 20.5-170.4-118.9 149.8 21.0 -1.4 -12.5 14 21 A T - 0 0 21 3,-2.4 353,-0.1 -2,-0.3 349,-0.0 -0.715 42.8 -99.9-121.5-179.9 20.7 0.4 -9.2 15 22 A W S S+ 0 0 120 -2,-0.2 -2,-0.0 1,-0.2 348,-0.0 0.614 125.2 36.9 -77.0 -11.4 19.6 4.0 -8.3 16 23 A T S S+ 0 0 138 1,-0.2 -1,-0.2 2,-0.0 -3,-0.0 0.462 119.4 47.8-116.9 -8.0 23.3 5.0 -8.0 17 24 A C - 0 0 43 1,-0.1 -3,-2.4 342,-0.0 3,-0.3 -0.929 61.1-154.9-140.8 115.7 24.8 2.9 -10.8 18 25 A P S S+ 0 0 36 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.863 91.5 14.1 -55.8 -40.5 23.4 2.6 -14.4 19 26 A M - 0 0 16 -6,-0.1 2,-0.6 343,-0.1 -6,-0.2 -0.858 66.8-175.5-141.4 107.7 25.0 -0.9 -15.0 20 27 A E E -A 12 0A 69 -8,-3.5 -8,-2.2 -3,-0.3 2,-0.6 -0.891 12.0-157.6 -97.1 120.3 26.4 -3.0 -12.1 21 28 A V E -A 11 0A 31 -2,-0.6 2,-0.8 -10,-0.2 -10,-0.2 -0.900 5.2-166.0-102.0 115.3 28.1 -6.2 -13.3 22 29 A L E -A 10 0A 29 -12,-3.7 -12,-1.9 -2,-0.6 3,-0.4 -0.856 11.4-158.0-108.3 98.5 28.2 -8.8 -10.6 23 30 A R E - 0 0 146 -2,-0.8 18,-0.2 1,-0.2 -14,-0.2 -0.522 64.0 -1.6 -87.7 144.5 30.6 -11.6 -11.6 24 31 A D E S+ 0 0 77 -2,-0.2 17,-2.4 1,-0.1 18,-0.3 0.937 91.7 154.0 39.7 65.9 30.6 -15.1 -10.2 25 32 A H E -AD 8 40A 24 -17,-2.4 -17,-1.8 -3,-0.4 2,-0.5 -0.698 42.4-130.0-112.7 167.1 27.7 -14.6 -7.8 26 33 A L E -AD 7 39A 0 13,-4.0 13,-2.7 -2,-0.2 2,-0.4 -0.992 21.8-175.0-119.5 127.5 25.1 -16.8 -6.3 27 34 A L E -AD 6 38A 0 -21,-2.1 -21,-2.6 -2,-0.5 2,-0.4 -0.993 7.8-157.8-122.9 127.5 21.4 -15.8 -6.5 28 35 A G E -AD 5 37A 0 9,-2.5 8,-3.4 -2,-0.4 9,-1.0 -0.883 1.4-161.3-107.8 137.3 18.7 -17.8 -4.7 29 36 A V E -AD 4 35A 0 -25,-2.9 -26,-2.4 -2,-0.4 -25,-1.6 -0.965 16.2-135.1-118.5 125.6 15.0 -17.7 -5.7 30 37 A S > - 0 0 19 4,-3.0 3,-0.9 -2,-0.5 -28,-0.1 -0.126 28.4-103.7 -74.0 171.7 12.3 -18.9 -3.3 31 38 A D T 3 S+ 0 0 137 1,-0.2 -1,-0.1 2,-0.1 -29,-0.1 0.720 124.1 55.6 -67.1 -22.0 9.3 -21.1 -4.1 32 39 A S T 3 S- 0 0 80 2,-0.1 -1,-0.2 405,-0.0 -30,-0.0 0.587 124.2-102.5 -87.5 -15.9 7.2 -18.0 -4.0 33 40 A G S < S+ 0 0 2 -3,-0.9 355,-2.6 1,-0.3 2,-0.3 0.416 74.7 131.6 115.5 2.0 9.3 -16.3 -6.7 34 41 A K B -H 387 0B 75 353,-0.2 -4,-3.0 402,-0.1 2,-0.5 -0.608 65.3-110.9 -95.1 145.0 11.5 -13.8 -4.7 35 42 A I E -D 29 0A 2 351,-3.2 350,-3.3 348,-0.3 -6,-0.2 -0.615 37.5-178.8 -66.8 120.9 15.2 -13.2 -4.8 36 43 A V E - 0 0 29 -8,-3.4 2,-0.3 1,-0.5 -1,-0.2 0.708 61.6 -5.4-109.8 -28.5 16.1 -14.6 -1.4 37 44 A F E -D 28 0A 6 -9,-1.0 -9,-2.5 -3,-0.1 -1,-0.5 -0.957 51.7-169.8-156.5 158.4 19.8 -13.9 -1.5 38 45 A L E +D 27 0A 27 -2,-0.3 2,-0.3 -11,-0.2 -11,-0.2 -0.867 31.3 138.2-148.0 113.8 22.4 -12.5 -3.9 39 46 A E E -D 26 0A 78 -13,-2.7 -13,-4.0 -2,-0.3 -2,-0.0 -0.964 55.8 -72.6-148.5 165.1 26.1 -12.8 -3.0 40 47 A E E > -D 25 0A 118 -2,-0.3 3,-1.9 -15,-0.3 -15,-0.3 -0.238 49.1-114.8 -51.2 145.6 29.6 -13.6 -4.2 41 48 A A G > S+ 0 0 9 -17,-2.4 3,-1.9 1,-0.3 4,-0.2 0.680 110.0 79.8 -63.4 -17.0 30.2 -17.3 -4.8 42 49 A S G 3 S+ 0 0 82 1,-0.3 3,-0.5 -18,-0.3 -1,-0.3 0.733 86.9 59.1 -58.1 -25.0 32.7 -17.2 -1.9 43 50 A Q G <> S+ 0 0 77 -3,-1.9 4,-2.3 1,-0.2 -1,-0.3 0.256 70.2 110.2 -88.2 11.8 29.7 -17.3 0.4 44 51 A Q H <> S+ 0 0 46 -3,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.864 78.1 49.8 -56.4 -37.8 28.5 -20.7 -1.0 45 52 A E H > S+ 0 0 140 -3,-0.5 4,-1.7 2,-0.2 -1,-0.2 0.985 113.0 43.5 -62.5 -60.9 29.4 -22.4 2.2 46 53 A K H > S+ 0 0 127 -4,-0.3 4,-2.1 1,-0.2 -2,-0.2 0.785 117.0 48.5 -55.3 -33.1 27.6 -20.0 4.6 47 54 A L H X S+ 0 0 2 -4,-2.3 4,-3.1 2,-0.2 5,-0.3 0.864 105.4 55.2 -80.9 -39.1 24.6 -19.9 2.2 48 55 A A H X>S+ 0 0 20 -4,-2.3 5,-1.1 -5,-0.3 4,-0.6 0.848 113.2 45.1 -59.6 -34.8 24.3 -23.7 1.8 49 56 A K H <5S+ 0 0 146 -4,-1.7 3,-0.3 3,-0.2 -2,-0.2 0.960 117.8 42.2 -69.0 -58.7 24.1 -23.9 5.7 50 57 A E H <5S+ 0 0 115 -4,-2.1 -2,-0.2 1,-0.2 -3,-0.2 0.931 125.5 32.6 -48.8 -56.6 21.6 -21.0 6.0 51 58 A W H <5S- 0 0 83 -4,-3.1 -49,-0.3 -5,-0.1 -1,-0.2 0.441 102.9-126.9 -96.2 -1.0 19.3 -21.9 3.2 52 59 A C T <5 + 0 0 103 -4,-0.6 2,-0.3 -5,-0.3 -3,-0.2 0.947 57.3 138.3 55.8 59.0 19.7 -25.7 3.4 53 60 A F < - 0 0 13 -5,-1.1 -1,-0.2 -6,-0.1 -2,-0.1 -0.962 49.5-127.1-127.9 149.3 20.7 -26.6 -0.1 54 61 A K > - 0 0 144 -2,-0.3 3,-3.2 1,-0.1 4,-0.4 -0.790 27.2-116.9 -91.1 138.5 23.4 -29.0 -1.5 55 62 A P G > S+ 0 0 78 0, 0.0 3,-1.1 0, 0.0 -1,-0.1 0.724 113.4 65.9 -43.1 -32.8 26.0 -27.6 -4.0 56 63 A C G 3 S+ 0 0 113 1,-0.2 0, 0.0 3,-0.0 0, 0.0 0.490 93.3 62.2 -70.9 -5.3 24.6 -30.0 -6.7 57 64 A E G < S+ 0 0 97 -3,-3.2 -52,-0.5 2,-0.1 -1,-0.2 0.622 82.2 98.5 -92.2 -17.3 21.4 -28.0 -6.6 58 65 A I E < -b 5 0A 23 -3,-1.1 2,-0.6 -4,-0.4 -52,-0.2 -0.503 69.3-142.9 -66.3 132.1 23.2 -24.8 -7.7 59 66 A R E -b 6 0A 88 -54,-3.5 -52,-2.7 -2,-0.2 2,-0.5 -0.920 14.6-152.6 -96.5 118.4 22.9 -24.2 -11.5 60 67 A E E -b 7 0A 126 -2,-0.6 -52,-0.2 -54,-0.2 2,-0.1 -0.810 9.2-138.7 -96.2 125.7 26.1 -22.8 -12.8 61 68 A L - 0 0 12 -54,-3.6 6,-0.0 -2,-0.5 -1,-0.0 -0.419 32.9 -87.5 -76.2 154.6 25.8 -20.5 -15.9 62 69 A S > - 0 0 43 1,-0.1 3,-1.6 -2,-0.1 -1,-0.1 -0.274 38.8-113.4 -54.7 148.9 28.2 -20.7 -18.8 63 70 A H T 3 S+ 0 0 184 1,-0.3 -1,-0.1 -55,-0.1 -39,-0.1 0.721 119.0 44.2 -60.3 -24.7 31.3 -18.6 -18.3 64 71 A H T 3 S+ 0 0 57 2,-0.0 2,-0.3 353,-0.0 -1,-0.3 0.292 100.1 90.1-105.3 9.4 30.1 -16.4 -21.3 65 72 A E < - 0 0 21 -3,-1.6 -56,-0.7 329,-0.2 2,-0.3 -0.739 52.5-174.8-100.6 154.0 26.4 -16.2 -20.1 66 73 A F E -cE 9 393A 8 327,-1.9 327,-3.2 -2,-0.3 2,-0.3 -0.994 20.7-131.4-147.8 148.7 24.8 -13.6 -17.9 67 74 A F E +cE 10 392A 0 -58,-2.5 -56,-2.7 -2,-0.3 325,-0.2 -0.762 28.5 175.0 -90.3 140.5 21.4 -13.0 -16.2 68 75 A M E - E 0 391A 1 323,-2.2 323,-2.8 -2,-0.3 -56,-0.2 -0.951 39.0 -83.6-134.8 163.0 19.8 -9.5 -16.5 69 76 A P E - E 0 390A 1 0, 0.0 321,-0.3 0, 0.0 3,-0.1 -0.330 54.4 -95.0 -60.1 146.7 16.4 -8.2 -15.4 70 77 A G - 0 0 2 319,-1.6 2,-0.2 364,-0.2 59,-0.2 -0.301 47.0-103.5 -57.3 144.4 13.5 -8.7 -17.7 71 78 A L E -i 129 0C 0 57,-2.6 59,-1.3 -3,-0.1 60,-1.2 -0.553 29.1-140.2 -75.7 137.5 12.8 -5.7 -20.0 72 79 A V E -i 131 0C 1 293,-2.8 2,-0.9 -2,-0.2 248,-0.5 -0.888 8.4-161.1-110.5 105.6 9.9 -3.5 -19.0 73 80 A D E -ij 132 320C 0 58,-2.4 60,-2.5 -2,-0.6 248,-0.2 -0.739 7.9-176.7 -84.7 102.9 7.7 -2.2 -21.9 74 81 A T E S+ 0 0 1 246,-2.2 247,-0.2 -2,-0.9 2,-0.2 0.531 71.4 28.0 -86.0 -2.5 5.9 0.8 -20.5 75 82 A H E + 0 0 3 245,-0.2 248,-4.2 218,-0.1 247,-0.5 -0.726 68.5 139.3-162.3 111.7 3.9 1.4 -23.7 76 83 A I E -i 134 0C 0 57,-1.7 59,-2.2 247,-0.2 2,-1.0 -0.992 41.4-135.2-154.5 130.5 2.7 -1.1 -26.3 77 84 A H E > -i 135 0C 4 247,-2.3 3,-2.2 -2,-0.3 4,-0.3 -0.794 16.7-172.9 -94.0 97.1 -0.5 -1.5 -28.3 78 85 A A G > S+ 0 0 0 57,-1.0 3,-1.4 -2,-1.0 4,-0.2 0.855 84.4 59.0 -49.3 -44.8 -1.2 -5.3 -28.3 79 86 A S G 3 S+ 0 0 0 56,-0.9 -1,-0.3 1,-0.2 3,-0.1 0.438 100.9 55.4 -68.6 -6.0 -4.1 -4.8 -30.7 80 87 A Q G X S+ 0 0 1 -3,-2.2 3,-1.6 244,-0.2 4,-0.4 0.388 75.1 98.7-106.2 0.5 -1.8 -3.2 -33.4 81 88 A Y G X + 0 0 38 -3,-1.4 3,-0.9 -4,-0.3 -2,-0.1 0.789 68.2 74.2 -59.2 -29.6 0.7 -6.2 -33.5 82 89 A S G 3 S+ 0 0 75 1,-0.2 -1,-0.3 -4,-0.2 -2,-0.1 0.810 109.4 27.5 -51.1 -36.7 -1.1 -7.5 -36.6 83 90 A F G X S+ 0 0 30 -3,-1.6 3,-1.1 3,-0.1 -1,-0.2 0.287 85.5 136.4-116.9 11.0 0.5 -4.7 -38.8 84 91 A A T < S+ 0 0 28 -3,-0.9 244,-0.1 -4,-0.4 3,-0.1 -0.353 71.0 35.3 -58.0 136.2 3.8 -4.1 -36.8 85 92 A G T 3 S+ 0 0 62 1,-0.4 2,-0.3 240,-0.3 -1,-0.3 0.487 114.4 80.7 90.3 10.4 6.7 -3.8 -39.2 86 93 A S S < S+ 0 0 58 -3,-1.1 -1,-0.4 239,-0.2 239,-0.1 -0.935 76.3 20.6-140.8 153.5 4.3 -2.1 -41.6 87 94 A S + 0 0 27 -2,-0.3 2,-1.1 1,-0.2 3,-0.2 0.677 56.2 142.8 69.4 26.3 2.7 1.3 -42.4 88 95 A I + 0 0 52 1,-0.2 -1,-0.2 -3,-0.0 240,-0.1 -0.545 43.3 102.8 -97.3 66.8 4.9 3.9 -40.6 89 96 A D + 0 0 98 -2,-1.1 -1,-0.2 2,-0.1 212,-0.1 0.061 64.3 59.5-141.5 23.8 4.4 6.3 -43.5 90 97 A L S S- 0 0 46 -3,-0.2 -1,-0.1 2,-0.0 2,-0.0 -0.969 87.1-101.0-147.7 147.5 1.9 9.0 -42.3 91 98 A P >> - 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