==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=17-MAY-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 07-MAY-13 4KL4 . COMPND 2 MOLECULE: RRNA N-GLYCOSIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MOMORDICA BALSAMINA; . AUTHOR S.PANDEY,T.K.TYAGI,A.SINGH,A.BHUSHAN,G.S.KUSHWAHA,M.SINHA,P. . 246 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11400.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 170 69.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 4.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 35 14.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.8 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 . 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 . 14 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 28 11.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 73 29.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 2.0 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 1 0 1 1 1 0 1 0 1 1 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 0 2 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 0 PARALLEL BRIDGES PER LADDER . 2 1 0 1 1 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 ANTIPARALLEL BRIDGES PER LADDER . 2 0 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 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 1 A D 0 0 125 0, 0.0 2,-0.3 0, 0.0 49,-0.2 0.000 360.0 360.0 360.0 170.6 -21.8 -17.0 -14.9 2 2 A V E -a 50 0A 10 47,-2.0 49,-3.0 2,-0.0 2,-0.3 -0.906 360.0-164.4-132.7 159.8 -22.6 -13.6 -13.6 3 3 A S E -a 51 0A 58 -2,-0.3 2,-0.3 47,-0.2 49,-0.2 -0.991 11.2-172.9-146.5 155.1 -21.0 -10.3 -14.4 4 4 A F E -a 52 0A 8 47,-2.0 49,-2.9 -2,-0.3 2,-0.6 -0.966 9.8-155.3-153.2 134.4 -20.7 -6.7 -13.1 5 5 A R E -a 53 0A 141 -2,-0.3 49,-0.2 47,-0.2 50,-0.1 -0.938 9.0-161.3-115.2 119.4 -19.1 -3.7 -14.6 6 6 A L S > S+ 0 0 14 47,-2.8 3,-1.9 -2,-0.6 2,-0.4 0.786 71.0 94.7 -63.9 -31.3 -17.9 -0.8 -12.6 7 7 A S T 3 S- 0 0 69 47,-0.5 -2,-0.1 1,-0.3 3,-0.1 -0.512 108.2 -0.9 -65.0 120.0 -17.9 1.5 -15.7 8 8 A G T 3 S+ 0 0 71 -2,-0.4 -1,-0.3 1,-0.2 5,-0.2 0.566 98.0 159.9 73.8 9.8 -21.3 3.3 -15.7 9 9 A A < + 0 0 14 -3,-1.9 -1,-0.2 4,-0.1 -3,-0.1 -0.305 9.7 167.5 -66.9 144.8 -22.3 1.4 -12.5 10 10 A D > - 0 0 61 -3,-0.1 4,-2.7 119,-0.0 5,-0.3 -0.902 53.0 -86.0-143.2 173.9 -25.1 2.9 -10.4 11 11 A P H > S+ 0 0 42 0, 0.0 4,-2.1 0, 0.0 5,-0.1 0.871 126.8 50.6 -52.2 -37.2 -27.3 1.6 -7.5 12 12 A S H > S+ 0 0 74 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.955 110.9 44.7 -67.2 -48.5 -29.7 0.1 -10.0 13 13 A S H > S+ 0 0 30 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.888 114.2 51.6 -65.6 -37.4 -27.1 -1.9 -12.1 14 14 A Y H X S+ 0 0 0 -4,-2.7 4,-2.8 2,-0.2 -1,-0.2 0.944 109.1 50.2 -59.8 -46.7 -25.5 -3.1 -8.8 15 15 A G H X S+ 0 0 10 -4,-2.1 4,-2.4 -5,-0.3 -2,-0.2 0.900 110.8 50.4 -58.4 -38.4 -28.9 -4.2 -7.5 16 16 A M H X S+ 0 0 108 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.915 110.1 48.6 -67.9 -43.4 -29.4 -6.1 -10.8 17 17 A F H X S+ 0 0 4 -4,-2.4 4,-2.9 1,-0.2 -2,-0.2 0.924 111.0 50.1 -62.0 -44.9 -26.0 -7.8 -10.5 18 18 A I H X S+ 0 0 0 -4,-2.8 4,-2.2 2,-0.2 -2,-0.2 0.903 109.5 53.0 -65.0 -32.3 -26.8 -8.8 -6.8 19 19 A K H X S+ 0 0 130 -4,-2.4 4,-2.2 -5,-0.2 -2,-0.2 0.956 109.6 47.3 -65.2 -46.9 -30.1 -10.2 -8.0 20 20 A D H X S+ 0 0 76 -4,-2.4 4,-1.3 2,-0.2 -2,-0.2 0.916 109.0 54.9 -54.3 -47.1 -28.4 -12.3 -10.6 21 21 A L H >< S+ 0 0 2 -4,-2.9 3,-1.1 1,-0.2 4,-0.4 0.964 110.5 45.1 -53.9 -53.5 -25.8 -13.5 -8.1 22 22 A R H >< S+ 0 0 32 -4,-2.2 3,-1.4 1,-0.2 -1,-0.2 0.915 112.6 52.9 -55.1 -42.4 -28.6 -14.7 -5.8 23 23 A N H 3< S+ 0 0 114 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.623 99.9 61.8 -74.7 -12.3 -30.4 -16.3 -8.7 24 24 A A T << S+ 0 0 38 -4,-1.3 -1,-0.3 -3,-1.1 -2,-0.2 0.489 84.5 91.1 -87.5 -6.3 -27.3 -18.3 -9.9 25 25 A L S < S- 0 0 5 -3,-1.4 2,-0.2 -4,-0.4 42,-0.1 -0.771 79.1-129.5 -89.6 133.3 -27.2 -20.2 -6.7 26 26 A P + 0 0 52 0, 0.0 12,-0.9 0, 0.0 2,-0.3 -0.528 32.6 163.6 -87.7 152.2 -29.2 -23.4 -6.8 27 27 A H - 0 0 76 -2,-0.2 10,-0.1 10,-0.2 3,-0.1 -0.979 31.1-159.9-153.5 154.0 -31.8 -24.6 -4.4 28 28 A T S S+ 0 0 124 8,-0.5 2,-0.3 -2,-0.3 9,-0.1 0.630 80.3 28.9-110.7 -19.0 -34.6 -27.1 -4.3 29 29 A E - 0 0 108 7,-0.5 7,-2.5 5,-0.0 2,-0.4 -0.956 61.5-140.4-136.4 157.8 -36.5 -25.6 -1.4 30 30 A K E -F 35 0B 119 -2,-0.3 2,-0.6 5,-0.2 3,-0.1 -0.871 14.2-150.8-101.7 147.3 -37.4 -22.3 0.3 31 31 A V E > S-F 34 0B 17 3,-2.7 3,-1.4 -2,-0.4 169,-0.1 -0.981 86.3 -15.2-118.2 117.9 -37.6 -22.1 4.0 32 32 A Y T 3 S- 0 0 79 -2,-0.6 -1,-0.2 1,-0.3 168,-0.0 0.916 131.8 -54.1 50.8 43.7 -40.1 -19.4 5.0 33 33 A N T 3 S+ 0 0 129 1,-0.2 -1,-0.3 -3,-0.1 -3,-0.0 0.604 114.9 118.5 73.3 11.2 -39.8 -18.2 1.5 34 34 A I E < S-F 31 0B 9 -3,-1.4 -3,-2.7 205,-0.0 -1,-0.2 -0.959 73.4-108.7-112.6 123.2 -35.9 -17.9 1.6 35 35 A P E -F 30 0B 27 0, 0.0 205,-1.8 0, 0.0 2,-0.6 -0.236 30.7-141.1 -49.8 133.4 -33.9 -20.0 -0.8 36 36 A L B -g 240 0C 15 -7,-2.5 -7,-0.5 203,-0.2 -8,-0.5 -0.904 16.1-127.8-102.0 121.4 -32.2 -22.8 1.1 37 37 A L - 0 0 1 203,-2.5 -10,-0.2 -2,-0.6 30,-0.1 -0.384 32.2 -99.1 -69.0 145.4 -28.7 -23.5 -0.2 38 38 A L - 0 0 35 -12,-0.9 204,-0.3 28,-0.3 -1,-0.1 -0.290 20.3-125.9 -65.7 148.6 -27.9 -27.1 -1.1 39 39 A P S S- 0 0 49 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.822 87.7 -18.5 -61.6 -29.8 -26.0 -29.3 1.4 40 40 A S - 0 0 76 26,-0.1 2,-0.3 2,-0.0 205,-0.0 -0.964 54.6-151.3-170.7 160.2 -23.5 -30.1 -1.4 41 41 A V - 0 0 32 -2,-0.3 2,-0.3 -3,-0.1 5,-0.1 -0.985 25.9-124.0-142.0 134.6 -23.0 -30.1 -5.2 42 42 A S > - 0 0 117 -2,-0.3 3,-0.7 3,-0.1 2,-0.1 -0.641 60.3 -20.6 -95.5 139.4 -20.6 -32.4 -7.1 43 43 A G G > S- 0 0 28 -2,-0.3 3,-1.2 1,-0.2 -2,-0.1 -0.399 116.9 -20.1 75.7-144.5 -17.8 -31.5 -9.5 44 44 A A G > S+ 0 0 55 1,-0.3 3,-2.0 2,-0.1 -1,-0.2 0.654 119.8 77.1 -78.7 -23.3 -17.4 -28.2 -11.2 45 45 A G G < S+ 0 0 52 -3,-0.7 -1,-0.3 1,-0.3 -2,-0.1 0.587 77.7 77.6 -68.6 -6.7 -21.0 -27.2 -10.8 46 46 A R G < S+ 0 0 49 -3,-1.2 20,-2.5 -5,-0.1 2,-0.5 0.651 88.3 71.9 -68.9 -15.3 -20.2 -26.4 -7.2 47 47 A Y E < - B 0 65A 18 -3,-2.0 2,-0.4 18,-0.2 18,-0.2 -0.903 63.5-160.3-118.9 116.7 -18.5 -23.2 -8.4 48 48 A L E - B 0 64A 14 16,-3.2 16,-3.3 -2,-0.5 2,-0.5 -0.770 16.8-140.5 -86.9 137.1 -20.1 -20.1 -9.8 49 49 A L E - B 0 63A 43 -2,-0.4 -47,-2.0 14,-0.2 2,-0.5 -0.886 14.5-167.5 -96.8 123.5 -17.8 -17.8 -11.9 50 50 A M E -aB 2 62A 1 12,-2.8 12,-3.4 -2,-0.5 2,-0.7 -0.965 6.9-156.2-110.7 120.9 -18.3 -14.0 -11.3 51 51 A H E -aB 3 61A 41 -49,-3.0 -47,-2.0 -2,-0.5 2,-0.4 -0.864 13.8-171.8 -99.5 119.4 -16.7 -11.8 -13.9 52 52 A L E -aB 4 60A 0 8,-2.5 8,-1.8 -2,-0.7 2,-0.5 -0.934 7.3-158.9-114.7 136.6 -16.0 -8.3 -12.5 53 53 A F E -aB 5 59A 34 -49,-2.9 -47,-2.8 -2,-0.4 -46,-0.3 -0.941 10.3-141.0-115.5 127.8 -14.8 -5.4 -14.5 54 54 A N > - 0 0 3 4,-2.7 3,-1.6 -2,-0.5 -47,-0.5 -0.095 43.8 -85.9 -70.3 179.3 -13.0 -2.4 -13.1 55 55 A Y T 3 S+ 0 0 139 1,-0.3 -1,-0.1 -49,-0.2 -2,-0.0 0.819 130.7 50.2 -61.1 -30.4 -13.7 1.1 -14.4 56 56 A D T 3 S- 0 0 128 2,-0.1 -1,-0.3 -49,-0.0 3,-0.1 0.524 121.5-105.6 -84.2 -3.6 -11.1 0.7 -17.1 57 57 A G S < S+ 0 0 39 -3,-1.6 2,-0.2 1,-0.3 -2,-0.1 0.569 71.7 143.8 92.3 6.3 -12.5 -2.6 -18.2 58 58 A N - 0 0 84 1,-0.0 -4,-2.7 -5,-0.0 2,-0.3 -0.557 36.7-147.9 -74.9 150.6 -9.8 -4.8 -16.7 59 59 A T E -B 53 0A 54 -6,-0.2 18,-0.5 -2,-0.2 2,-0.3 -0.899 27.5-174.7-131.7 147.9 -11.2 -8.1 -15.4 60 60 A I E -BC 52 76A 0 -8,-1.8 -8,-2.5 -2,-0.3 2,-0.5 -0.963 21.3-139.5-124.5 153.3 -10.9 -10.7 -12.8 61 61 A T E -BC 51 75A 18 14,-2.0 14,-3.0 -2,-0.3 2,-0.5 -0.961 17.8-158.4-110.9 125.1 -13.0 -13.9 -12.5 62 62 A V E -BC 50 74A 0 -12,-3.4 -12,-2.8 -2,-0.5 2,-0.5 -0.843 6.4-143.9-107.2 134.3 -14.0 -14.9 -9.1 63 63 A A E -BC 49 73A 0 10,-2.5 9,-3.4 -2,-0.5 10,-0.9 -0.828 18.4-171.8-102.6 126.5 -15.0 -18.4 -8.1 64 64 A V E -BC 48 71A 2 -16,-3.3 -16,-3.2 -2,-0.5 2,-0.6 -0.963 25.4-128.0-120.9 132.8 -17.7 -18.9 -5.6 65 65 A D E >>> -BC 47 70A 3 5,-2.4 4,-2.3 -2,-0.4 3,-1.4 -0.666 18.7-151.2 -80.2 118.8 -18.9 -22.1 -3.9 66 66 A V T 345S+ 0 0 5 -20,-2.5 -28,-0.3 -2,-0.6 -1,-0.2 0.546 88.7 64.9 -74.1 -12.8 -22.7 -22.1 -4.5 67 67 A T T 345S+ 0 0 1 -21,-0.4 175,-0.5 -30,-0.1 -1,-0.3 0.708 126.2 4.3 -73.2 -30.1 -23.4 -24.0 -1.3 68 68 A N T <45S- 0 0 18 -3,-1.4 -2,-0.2 2,-0.1 3,-0.1 0.424 92.3-117.6-138.9 -0.7 -22.1 -21.3 1.1 69 69 A V T <5 + 0 0 1 -4,-2.3 2,-0.4 1,-0.2 -3,-0.2 0.729 59.4 156.2 60.6 32.0 -21.3 -18.3 -1.1 70 70 A Y E < -C 65 0A 106 -5,-0.7 -5,-2.4 89,-0.0 2,-0.3 -0.713 45.9-125.0 -86.6 131.8 -17.6 -18.5 0.0 71 71 A I E -C 64 0A 9 -2,-0.4 -7,-0.2 -7,-0.2 3,-0.1 -0.593 27.5-176.5 -71.7 129.5 -15.1 -17.0 -2.4 72 72 A M E - 0 0 1 -9,-3.4 11,-1.7 1,-0.4 2,-0.3 0.778 54.1 -55.0 -96.2 -33.3 -12.6 -19.7 -3.2 73 73 A G E -CD 63 82A 1 -10,-0.9 -10,-2.5 9,-0.2 -1,-0.4 -0.950 50.6-128.2 170.2 179.9 -10.1 -17.8 -5.4 74 74 A Y E -CD 62 81A 3 7,-1.8 7,-2.4 -2,-0.3 2,-0.5 -0.974 12.1-122.0-152.4 164.8 -10.0 -15.7 -8.6 75 75 A L E -CD 61 80A 35 -14,-3.0 -14,-2.0 -2,-0.3 2,-0.4 -0.959 19.4-176.9-116.5 130.1 -8.3 -15.4 -11.9 76 76 A A E > -CD 60 79A 3 3,-3.0 3,-1.9 -2,-0.5 2,-0.2 -0.960 67.0 -49.3-126.9 107.8 -6.3 -12.3 -13.0 77 77 A L T 3 S- 0 0 145 -18,-0.5 63,-0.0 -2,-0.4 0, 0.0 -0.450 122.7 -22.5 58.1-126.8 -5.0 -12.6 -16.5 78 78 A T T 3 S+ 0 0 44 -2,-0.2 23,-1.4 21,-0.1 22,-1.3 0.185 121.3 89.6-100.7 17.2 -3.2 -15.9 -16.7 79 79 A T E < -De 76 101A 10 -3,-1.9 -3,-3.0 21,-0.2 2,-0.3 -0.969 58.3-156.5-117.1 135.5 -2.6 -16.3 -12.9 80 80 A S E -De 75 102A 3 21,-2.4 23,-2.7 -2,-0.4 2,-0.3 -0.728 5.7-162.9-103.6 153.3 -5.0 -17.9 -10.5 81 81 A Y E +De 74 103A 5 -7,-2.4 -7,-1.8 -2,-0.3 2,-0.3 -0.999 8.9 179.4-134.0 136.7 -5.1 -17.2 -6.8 82 82 A F E -De 73 104A 4 21,-1.6 23,-2.6 -2,-0.3 -9,-0.2 -0.984 31.7-103.6-138.3 152.6 -6.7 -19.4 -4.0 83 83 A F - 0 0 4 -11,-1.7 2,-1.5 -2,-0.3 25,-0.3 -0.200 39.2-107.0 -67.4 156.2 -7.0 -19.2 -0.3 84 84 A N S S+ 0 0 100 23,-3.1 -1,-0.1 20,-0.1 3,-0.1 -0.667 83.5 97.5 -91.2 78.0 -4.8 -21.4 1.8 85 85 A E S >> S- 0 0 48 -2,-1.5 4,-2.3 23,-0.1 3,-0.5 -0.968 82.9-106.7-156.6 154.9 -7.5 -23.8 3.0 86 86 A P H 3> S+ 0 0 115 0, 0.0 4,-3.5 0, 0.0 5,-0.2 0.906 115.6 55.5 -55.6 -42.9 -8.7 -27.4 1.9 87 87 A A H 3> S+ 0 0 48 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.894 112.0 43.7 -57.5 -40.5 -11.9 -26.1 0.3 88 88 A A H <> S+ 0 0 0 -3,-0.5 4,-1.5 2,-0.2 -1,-0.2 0.865 110.5 54.3 -76.2 -34.8 -10.0 -23.8 -1.9 89 89 A D H X S+ 0 0 101 -4,-2.3 4,-0.5 1,-0.2 3,-0.5 0.941 109.8 49.1 -60.8 -44.0 -7.4 -26.4 -2.7 90 90 A L H >< S+ 0 0 79 -4,-3.5 3,-1.7 1,-0.2 4,-0.4 0.931 107.4 54.3 -56.9 -46.2 -10.3 -28.6 -3.8 91 91 A A H >X S+ 0 0 0 -4,-1.9 4,-2.1 1,-0.3 3,-1.9 0.816 96.0 66.8 -60.8 -29.3 -11.8 -25.8 -5.9 92 92 A S H 3< S+ 0 0 16 -4,-1.5 -1,-0.3 -3,-0.5 -2,-0.2 0.681 90.3 65.6 -72.4 -12.7 -8.5 -25.4 -7.8 93 93 A Q T << S+ 0 0 110 -3,-1.7 -1,-0.3 -4,-0.5 -2,-0.2 0.743 113.8 29.1 -68.1 -27.3 -9.1 -28.8 -9.2 94 94 A Y T <4 S+ 0 0 98 -3,-1.9 2,-0.3 -4,-0.4 3,-0.3 0.762 112.3 52.8-109.8 -36.4 -12.1 -27.5 -11.1 95 95 A V S < S+ 0 0 15 -4,-2.1 -1,-0.1 1,-0.2 -21,-0.1 -0.858 105.1 9.2-115.2 147.9 -11.7 -23.8 -12.0 96 96 A F > + 0 0 22 -2,-0.3 3,-1.7 1,-0.1 -1,-0.2 0.747 69.5 147.7 67.1 29.7 -9.1 -21.7 -13.8 97 97 A R T 3 + 0 0 181 1,-0.3 -2,-0.1 -3,-0.3 -1,-0.1 0.823 65.0 63.6 -63.2 -33.8 -7.1 -24.8 -14.9 98 98 A S T 3 S+ 0 0 117 2,-0.0 -1,-0.3 3,-0.0 -2,-0.1 0.530 77.9 119.0 -68.8 -5.9 -6.0 -23.0 -18.1 99 99 A A < - 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