==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-JUL-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 24-JUN-12 4FPZ . COMPND 2 MOLECULE: RRNA N-GLYCOSIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MOMORDICA BALSAMINA; . AUTHOR A.SINGH,S.PANDEY,N.SINGH,G.S.KUSHWAHA,M.SINHA,A.BHUSHAN,P.KA . 246 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11200.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 171 69.5 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 . 36 14.6 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 . 12 4.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 30 12.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 72 29.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 2.4 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 1 1 0 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 0 1 1 2 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 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 0 127 0, 0.0 2,-0.3 0, 0.0 49,-0.2 0.000 360.0 360.0 360.0 163.9 -3.6 -27.4 15.0 2 2 A V E -a 50 0A 11 47,-2.2 49,-3.2 2,-0.0 2,-0.3 -0.948 360.0-160.2-130.0 154.3 -0.2 -26.5 13.7 3 3 A S E -a 51 0A 42 -2,-0.3 2,-0.3 47,-0.2 49,-0.2 -0.947 11.7-171.6-134.3 155.7 1.8 -23.4 14.5 4 4 A F E -a 52 0A 8 47,-2.3 49,-2.2 -2,-0.3 2,-0.5 -0.934 8.1-158.5-146.5 130.2 4.7 -21.3 13.1 5 5 A R E -a 53 0A 144 -2,-0.3 49,-0.2 47,-0.2 50,-0.1 -0.921 8.0-163.9-111.3 121.6 6.6 -18.4 14.7 6 6 A L S > S+ 0 0 0 47,-2.4 3,-1.9 -2,-0.5 2,-0.6 0.808 70.1 93.2 -66.6 -32.0 8.5 -15.9 12.6 7 7 A S T 3 S+ 0 0 78 47,-0.5 -2,-0.1 1,-0.3 48,-0.0 -0.515 107.6 0.8 -70.4 117.1 10.4 -14.7 15.6 8 8 A G T 3 S+ 0 0 75 -2,-0.6 -1,-0.3 1,-0.2 5,-0.1 0.449 96.9 157.2 85.1 2.7 13.6 -16.7 15.7 9 9 A A < + 0 0 13 -3,-1.9 -1,-0.2 4,-0.1 -3,-0.1 -0.239 11.2 166.1 -65.2 146.5 12.7 -18.7 12.6 10 10 A D > - 0 0 61 119,-0.0 4,-2.4 166,-0.0 5,-0.3 -0.872 55.2 -82.8-147.2 174.5 15.3 -20.3 10.5 11 11 A P H > S+ 0 0 46 0, 0.0 4,-2.4 0, 0.0 5,-0.1 0.890 127.8 52.1 -53.7 -36.6 15.3 -22.9 7.8 12 12 A S H > S+ 0 0 77 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.951 110.6 43.9 -65.4 -47.3 15.1 -25.7 10.3 13 13 A S H > S+ 0 0 27 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.862 113.8 51.9 -70.6 -31.4 12.1 -24.3 12.2 14 14 A Y H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.914 108.6 50.9 -66.8 -46.6 10.3 -23.5 8.9 15 15 A G H X S+ 0 0 11 -4,-2.4 4,-2.2 -5,-0.3 -2,-0.2 0.890 107.6 53.7 -60.2 -34.8 10.9 -27.1 7.7 16 16 A M H X S+ 0 0 102 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.896 109.2 48.7 -63.0 -38.3 9.4 -28.4 11.1 17 17 A F H X S+ 0 0 2 -4,-1.7 4,-2.9 2,-0.2 -2,-0.2 0.911 110.9 49.9 -67.5 -42.3 6.3 -26.3 10.5 18 18 A I H X S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.904 111.4 49.3 -64.5 -38.6 5.9 -27.6 6.9 19 19 A K H X S+ 0 0 122 -4,-2.2 4,-2.7 -5,-0.2 -2,-0.2 0.934 111.2 48.8 -64.1 -45.2 6.3 -31.1 8.2 20 20 A D H X S+ 0 0 75 -4,-2.5 4,-1.1 2,-0.2 -2,-0.2 0.912 110.4 52.2 -59.3 -42.5 3.7 -30.5 10.9 21 21 A L H >< S+ 0 0 1 -4,-2.9 3,-0.8 1,-0.2 4,-0.4 0.959 111.7 45.1 -62.4 -48.0 1.3 -29.1 8.2 22 22 A R H >< S+ 0 0 38 -4,-2.3 3,-1.7 1,-0.2 -2,-0.2 0.933 112.6 52.4 -59.9 -43.8 1.7 -32.2 6.0 23 23 A N H 3< S+ 0 0 121 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.660 101.2 60.8 -66.1 -20.8 1.3 -34.5 8.9 24 24 A A T << S+ 0 0 41 -4,-1.1 -1,-0.3 -3,-0.8 -2,-0.2 0.494 85.2 90.1 -83.4 -8.9 -1.9 -32.8 10.0 25 25 A L S < S- 0 0 5 -3,-1.7 2,-0.1 -4,-0.4 42,-0.1 -0.811 79.1-130.1 -92.5 125.6 -3.6 -33.7 6.7 26 26 A P + 0 0 48 0, 0.0 12,-0.8 0, 0.0 2,-0.3 -0.462 30.5 170.7 -80.2 151.2 -5.4 -37.0 6.9 27 27 A H E -F 37 0B 83 10,-0.2 10,-0.1 -2,-0.1 3,-0.1 -0.979 28.5-163.2-148.7 153.3 -5.1 -39.9 4.4 28 28 A T E S+ 0 0 113 8,-0.5 2,-0.3 -2,-0.3 9,-0.1 0.553 79.4 19.3-109.4 -18.8 -6.1 -43.5 4.2 29 29 A E E - 0 0 109 7,-0.4 7,-2.4 5,-0.0 2,-0.3 -0.960 62.2-135.9-139.4 169.0 -3.8 -44.6 1.4 30 30 A K E -F 35 0B 112 -2,-0.3 2,-0.5 5,-0.2 3,-0.0 -0.913 13.7-152.5-119.8 148.2 -0.6 -43.6 -0.4 31 31 A V E > S-F 34 0B 18 3,-2.4 3,-1.5 -2,-0.3 169,-0.1 -0.996 86.1 -10.8-123.2 121.2 -0.3 -43.8 -4.2 32 32 A Y T 3 S- 0 0 79 -2,-0.5 -1,-0.2 1,-0.3 168,-0.0 0.875 131.9 -57.8 47.9 44.3 3.2 -44.4 -5.4 33 33 A N T 3 S+ 0 0 132 1,-0.2 -1,-0.3 -3,-0.0 -3,-0.0 0.605 114.3 118.0 67.1 17.6 4.3 -43.7 -1.7 34 34 A I E < S-F 31 0B 8 -3,-1.5 -3,-2.4 205,-0.0 -1,-0.2 -0.960 73.7-105.9-113.8 129.0 2.7 -40.2 -1.7 35 35 A P E -F 30 0B 26 0, 0.0 205,-1.9 0, 0.0 2,-0.7 -0.194 29.4-142.2 -51.1 133.0 -0.2 -39.5 0.7 36 36 A L E -g 240 0C 9 -7,-2.4 -8,-0.5 203,-0.2 -7,-0.4 -0.904 16.3-131.5-100.9 115.1 -3.6 -39.3 -1.0 37 37 A L E -F 27 0B 1 203,-2.6 -10,-0.2 -2,-0.7 30,-0.1 -0.289 34.7 -90.4 -66.5 156.3 -5.8 -36.6 0.4 38 38 A L - 0 0 31 -12,-0.8 204,-0.3 28,-0.3 -1,-0.1 -0.269 18.2-132.9 -69.7 148.3 -9.3 -37.6 1.2 39 39 A P S S- 0 0 37 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.898 86.9 -9.7 -63.4 -40.4 -12.2 -37.4 -1.2 40 40 A S - 0 0 79 26,-0.1 2,-0.3 2,-0.0 205,-0.0 -0.994 51.8-162.0-156.7 156.0 -14.3 -35.7 1.5 41 41 A V - 0 0 29 -2,-0.3 2,-0.3 -3,-0.1 5,-0.2 -0.961 22.6-138.0-143.6 128.3 -14.5 -34.8 5.2 42 42 A S > - 0 0 114 -2,-0.3 3,-0.7 3,-0.1 2,-0.1 -0.610 56.8 -11.4 -93.3 142.9 -17.8 -33.9 7.0 43 43 A G G > S- 0 0 27 -2,-0.3 3,-1.5 1,-0.2 4,-0.1 -0.302 116.5 -25.1 79.5-155.4 -18.2 -31.2 9.5 44 44 A A G > S+ 0 0 56 1,-0.3 3,-1.9 2,-0.1 -1,-0.2 0.695 120.6 79.7 -72.1 -17.8 -15.7 -29.1 11.3 45 45 A G G < S+ 0 0 56 -3,-0.7 -1,-0.3 1,-0.3 -2,-0.2 0.652 77.3 75.9 -63.2 -15.1 -13.1 -31.9 10.9 46 46 A R G < S+ 0 0 44 -3,-1.5 20,-3.2 -5,-0.2 2,-0.4 0.663 87.6 69.8 -65.7 -23.4 -12.6 -30.7 7.3 47 47 A Y E < - B 0 65A 19 -3,-1.9 2,-0.4 18,-0.2 18,-0.2 -0.888 62.1-158.7-114.6 131.6 -10.6 -27.7 8.5 48 48 A L E - B 0 64A 13 16,-2.9 16,-2.8 -2,-0.4 2,-0.5 -0.854 18.3-138.5 -99.1 138.5 -7.1 -27.5 9.9 49 49 A L E - B 0 63A 42 -2,-0.4 -47,-2.2 14,-0.2 2,-0.6 -0.875 14.5-165.0-101.2 127.4 -6.2 -24.4 11.9 50 50 A M E -aB 2 62A 0 12,-2.8 12,-2.7 -2,-0.5 2,-0.7 -0.954 6.7-153.8-109.2 123.9 -2.8 -22.9 11.4 51 51 A H E -aB 3 61A 40 -49,-3.2 -47,-2.3 -2,-0.6 2,-0.4 -0.827 15.5-173.5 -98.8 115.5 -1.6 -20.4 13.9 52 52 A L E -aB 4 60A 0 8,-2.5 8,-1.9 -2,-0.7 2,-0.4 -0.902 5.5-163.9-111.4 136.7 1.0 -18.0 12.5 53 53 A F E -aB 5 59A 35 -49,-2.2 -47,-2.4 -2,-0.4 -46,-0.2 -0.951 11.6-139.7-120.3 131.2 2.9 -15.4 14.5 54 54 A N > - 0 0 3 4,-2.4 3,-2.0 -2,-0.4 -47,-0.5 -0.171 42.3 -87.3 -79.3 175.9 4.8 -12.4 13.1 55 55 A Y T 3 S+ 0 0 93 1,-0.3 -1,-0.1 -49,-0.2 -2,-0.0 0.876 131.4 51.6 -53.2 -34.3 8.2 -11.2 14.3 56 56 A D T 3 S- 0 0 141 1,-0.1 -1,-0.3 2,-0.0 3,-0.1 0.451 120.3-109.6 -84.6 -4.0 6.4 -9.1 17.0 57 57 A G S < S+ 0 0 41 -3,-2.0 2,-0.1 1,-0.3 -2,-0.1 0.497 70.7 139.8 88.9 6.0 4.3 -12.0 18.1 58 58 A N - 0 0 85 1,-0.0 -4,-2.4 -5,-0.0 2,-0.3 -0.464 37.3-151.8 -74.4 154.8 1.0 -10.9 16.8 59 59 A T E -B 53 0A 56 -6,-0.2 18,-0.5 -2,-0.1 2,-0.3 -0.922 26.8-170.3-139.6 152.3 -1.1 -13.7 15.3 60 60 A I E -B 52 0A 1 -8,-1.9 -8,-2.5 -2,-0.3 2,-0.5 -0.938 21.7-138.5-128.6 153.8 -3.7 -14.9 12.8 61 61 A T E -BC 51 75A 18 14,-1.9 14,-2.8 -2,-0.3 2,-0.5 -0.986 18.6-157.6-111.3 125.5 -5.3 -18.3 12.6 62 62 A V E -BC 50 74A 0 -12,-2.7 -12,-2.8 -2,-0.5 2,-0.5 -0.892 7.0-142.8-106.0 130.9 -5.7 -19.6 9.1 63 63 A A E -BC 49 73A 0 10,-2.4 9,-2.9 -2,-0.5 10,-0.9 -0.808 18.8-169.7 -94.8 127.2 -8.4 -22.2 8.2 64 64 A V E -BC 48 71A 2 -16,-2.8 -16,-2.9 -2,-0.5 2,-0.4 -0.975 24.4-126.7-121.1 129.3 -7.2 -24.8 5.7 65 65 A D E >>> -BC 47 70A 3 5,-2.5 4,-2.0 -2,-0.4 3,-0.9 -0.632 19.6-149.2 -72.6 119.0 -9.5 -27.4 3.9 66 66 A V T 345S+ 0 0 6 -20,-3.2 -28,-0.3 -2,-0.4 -1,-0.1 0.610 89.5 61.8 -74.0 -10.1 -7.7 -30.8 4.6 67 67 A T T 345S+ 0 0 0 -21,-0.3 175,-0.5 -30,-0.1 -1,-0.2 0.709 127.0 7.9 -81.1 -28.6 -9.0 -32.3 1.3 68 68 A N T <45S- 0 0 22 -3,-0.9 -2,-0.2 2,-0.1 3,-0.1 0.440 92.4-118.8-135.7 1.4 -7.2 -29.8 -1.0 69 69 A V T <5 + 0 0 1 -4,-2.0 2,-0.3 1,-0.2 -3,-0.2 0.731 60.3 154.8 61.0 25.6 -5.0 -27.6 1.2 70 70 A Y E < -C 65 0A 112 -5,-0.5 -5,-2.5 89,-0.1 2,-0.4 -0.657 46.5-124.5 -81.7 137.0 -7.0 -24.6 0.2 71 71 A I E -C 64 0A 9 -2,-0.3 -7,-0.2 -7,-0.2 3,-0.1 -0.710 27.1-177.5 -80.9 130.2 -7.0 -21.7 2.5 72 72 A M E - 0 0 1 -9,-2.9 11,-2.1 -2,-0.4 2,-0.3 0.806 54.6 -54.4 -96.0 -40.1 -10.6 -20.8 3.3 73 73 A G E -CD 63 82A 1 -10,-0.9 -10,-2.4 9,-0.2 -1,-0.4 -0.948 49.5-126.8 178.3-172.5 -10.2 -17.7 5.5 74 74 A Y E -CD 62 81A 2 7,-2.3 7,-2.6 -2,-0.3 2,-0.5 -0.983 11.8-124.4-157.2 161.5 -8.5 -16.5 8.7 75 75 A L E -CD 61 80A 41 -14,-2.8 -14,-1.9 -2,-0.3 2,-0.5 -0.947 20.0-176.2-112.5 130.6 -9.2 -14.9 12.1 76 76 A A E > - D 0 79A 2 3,-2.6 3,-1.8 -2,-0.5 2,-0.3 -0.935 64.5 -51.4-130.7 110.0 -7.4 -11.7 13.1 77 77 A L T 3 S- 0 0 140 -2,-0.5 64,-0.0 -18,-0.5 63,-0.0 -0.480 122.7 -19.7 59.6-121.8 -8.2 -10.6 16.6 78 78 A T T 3 S+ 0 0 51 -2,-0.3 22,-1.6 21,-0.1 23,-1.2 0.329 121.4 84.3-100.3 13.3 -11.9 -10.5 16.7 79 79 A T E < -De 76 101A 14 -3,-1.8 -3,-2.6 20,-0.2 2,-0.3 -0.951 59.6-153.9-116.8 132.8 -12.7 -10.4 13.1 80 80 A S E -De 75 102A 4 21,-2.5 23,-3.3 -2,-0.4 2,-0.4 -0.741 8.6-163.7 -98.4 153.1 -13.0 -13.4 10.6 81 81 A Y E -De 74 103A 10 -7,-2.6 -7,-2.3 -2,-0.3 2,-0.4 -0.999 7.6-177.6-134.9 134.2 -12.3 -13.1 6.9 82 82 A F E -De 73 104A 4 21,-1.9 23,-2.8 -2,-0.4 -9,-0.2 -0.974 31.2-104.5-133.2 150.2 -13.3 -15.6 4.2 83 83 A F - 0 0 4 -11,-2.1 2,-1.6 -2,-0.4 25,-0.2 -0.287 39.1-109.3 -64.3 153.5 -12.9 -15.8 0.5 84 84 A N S S+ 0 0 101 23,-2.6 -1,-0.1 20,-0.1 3,-0.0 -0.628 83.1 101.7 -87.1 77.2 -15.9 -15.1 -1.7 85 85 A E S >> S- 0 0 41 -2,-1.6 4,-2.1 -13,-0.1 3,-0.6 -0.985 81.2-109.4-153.3 152.2 -16.5 -18.6 -2.8 86 86 A P H 3> S+ 0 0 117 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.865 114.3 53.8 -57.9 -36.5 -18.9 -21.4 -1.8 87 87 A A H 3> S+ 0 0 46 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.846 111.4 47.5 -65.8 -35.3 -16.4 -23.7 -0.1 88 88 A A H <> S+ 0 0 0 -3,-0.6 4,-1.7 2,-0.2 -1,-0.2 0.866 108.1 53.9 -75.0 -34.8 -15.2 -20.8 2.1 89 89 A D H < S+ 0 0 84 -4,-2.1 4,-0.4 2,-0.2 -2,-0.2 0.931 109.8 48.7 -63.5 -40.8 -18.8 -19.8 3.0 90 90 A L H >< S+ 0 0 68 -4,-2.2 3,-2.0 1,-0.2 4,-0.4 0.930 107.0 54.8 -62.6 -45.1 -19.4 -23.3 4.1 91 91 A A H >X S+ 0 0 0 -4,-2.1 3,-2.4 1,-0.3 4,-2.1 0.873 98.2 65.0 -51.9 -36.6 -16.2 -23.3 6.1 92 92 A S T 3< S+ 0 0 10 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.682 90.5 66.3 -64.4 -16.2 -17.6 -20.2 7.8 93 93 A Q T <4 S+ 0 0 92 -3,-2.0 -1,-0.3 -4,-0.4 -2,-0.2 0.698 115.0 25.2 -72.0 -22.2 -20.2 -22.4 9.2 94 94 A Y T <4 S+ 0 0 101 -3,-2.4 2,-0.4 -4,-0.4 3,-0.2 0.655 111.7 58.4-117.7 -26.7 -17.6 -24.3 11.3 95 95 A V S < S+ 0 0 15 -4,-2.1 -1,-0.1 1,-0.2 -21,-0.1 -0.887 104.6 5.9-116.6 149.5 -14.6 -22.1 12.1 96 96 A F S > S+ 0 0 23 -2,-0.4 3,-1.9 1,-0.1 -1,-0.2 0.706 70.9 151.1 62.8 28.2 -14.1 -18.8 13.9 97 97 A R T 3 + 0 0 179 1,-0.3 -1,-0.1 -3,-0.2 -2,-0.1 0.794 63.9 61.7 -61.9 -28.0 -17.7 -18.6 14.9 98 98 A S T 3 S+ 0 0 122 -19,-0.0 -1,-0.3 2,-0.0 -2,-0.1 0.440 74.5 121.5 -84.6 7.8 -17.0 -16.6 18.0 99 99 A A < - 0 0 20 -3,-1.9 -20,-0.2 1,-0.1 -21,-0.1 -0.395 67.1-133.0 -56.9 141.5 -15.5 -13.7 15.9 100 100 A R S S+ 0 0 195 -22,-1.6 2,-0.3 1,-0.1 -21,-0.2 0.847 88.5 21.0 -65.7 -27.2 -17.4 -10.4 16.6 101 101 A R E -e 79 0A 105 -23,-1.2 -21,-2.5 2,-0.0 2,-0.5 -0.987 65.2-149.8-145.5 143.6 -17.6 -9.8 13.0 102 102 A K E -e 80 0A 101 -2,-0.3 2,-0.5 -23,-0.2 -21,-0.2 -0.961 13.6-169.2-121.4 116.3 -17.3 -11.7 9.7 103 103 A I E -e 81 0A 42 -23,-3.3 -21,-1.9 -2,-0.5 2,-0.6 -0.879 13.1-147.8-105.0 130.0 -16.0 -10.1 6.6 104 104 A T E -e 82 0A 72 -2,-0.5 -21,-0.2 -23,-0.2 -20,-0.1 -0.854 26.4-126.0 -91.7 120.5 -16.3 -11.7 3.2 105 105 A L - 0 0 1 -23,-2.8 2,-0.7 -2,-0.6 -21,-0.1 -0.274 20.0-114.9 -60.0 152.1 -13.3 -10.7 1.1 106 106 A P S S+ 0 0 79 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.113 91.9 40.7 -89.9 44.7 -14.1 -9.2 -2.3 107 107 A Y S S- 0 0 15 -2,-0.7 -23,-2.6 10,-0.0 2,-0.1 -0.943 81.2-107.9-169.9 161.1 -12.5 -12.0 -4.3 108 108 A S - 0 0 22 -2,-0.3 -23,-0.1 -25,-0.2 -26,-0.0 -0.287 38.7-107.0 -81.8 177.2 -12.2 -15.8 -4.4 109 109 A G S S+ 0 0 16 -2,-0.1 -38,-0.1 4,-0.1 2,-0.1 0.372 75.5 113.8 -96.3 6.7 -8.9 -17.5 -3.5 110 110 A N S > S- 0 0 68 1,-0.1 4,-2.7 4,-0.0 5,-0.3 -0.415 75.7-113.0 -78.2 161.7 -7.7 -18.8 -6.8 111 111 A Y H > S+ 0 0 22 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.870 111.6 54.5 -61.1 -38.9 -4.5 -17.3 -8.3 112 112 A E H > S+ 0 0 109 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.962 113.6 41.5 -62.7 -49.3 -6.1 -15.5 -11.2 113 113 A R H > S+ 0 0 128 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.860 114.3 50.7 -64.5 -39.6 -8.5 -13.6 -9.0 114 114 A L H X S+ 0 0 0 -4,-2.7 4,-2.7 2,-0.2 -1,-0.2 0.898 109.3 51.5 -67.2 -41.1 -6.0 -12.8 -6.3 115 115 A Q H X>S+ 0 0 37 -4,-2.5 4,-1.5 -5,-0.3 5,-1.2 0.891 109.0 51.0 -64.6 -37.9 -3.5 -11.5 -8.8 116 116 A I H <5S+ 0 0 107 -4,-1.9 3,-0.3 -5,-0.2 -2,-0.2 0.958 113.5 45.3 -60.5 -46.9 -6.2 -9.2 -10.3 117 117 A A H <5S+ 0 0 29 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.901 114.5 47.9 -64.0 -39.9 -7.1 -7.9 -6.8 118 118 A A H <5S- 0 0 20 -4,-2.7 -1,-0.2 2,-0.2 -2,-0.2 0.738 106.0-128.1 -76.4 -24.0 -3.4 -7.4 -5.9 119 119 A G T <5S+ 0 0 64 -4,-1.5 -3,-0.2 -3,-0.3 -4,-0.1 0.595 79.3 69.1 87.4 8.8 -2.6 -5.6 -9.2 120 120 A K S - 0 0 55 0, 0.0 3,-2.1 0, 0.0 4,-0.3 -0.516 37.5-111.5 -80.5 160.0 1.0 -11.4 -11.0 122 122 A R G > S+ 0 0 6 1,-0.3 3,-1.3 2,-0.2 64,-0.0 0.716 110.1 76.5 -69.2 -11.6 2.8 -13.5 -8.6 123 123 A E G 3 S+ 0 0 81 1,-0.3 -1,-0.3 57,-0.1 57,-0.1 0.724 101.7 43.8 -61.9 -25.1 5.9 -13.7 -10.8 124 124 A K G < S+ 0 0 139 -3,-2.1 -1,-0.3 56,-0.1 -2,-0.2 0.403 93.8 90.5-101.3 -0.7 6.5 -10.2 -9.5 125 125 A I S < S- 0 0 17 -3,-1.3 54,-0.1 -4,-0.3 -1,-0.0 -0.862 73.3-133.6-101.2 113.7 5.7 -10.7 -5.8 126 126 A P - 0 0 59 0, 0.0 54,-0.3 0, 0.0 2,-0.3 -0.337 24.0-167.2 -65.1 146.1 8.7 -11.6 -3.7 127 127 A I B +H 179 0D 2 52,-1.9 52,-2.4 50,-0.1 2,-0.3 -0.832 29.1 105.9-129.0 165.6 8.2 -14.5 -1.2 128 128 A G S > S- 0 0 0 -2,-0.3 4,-1.5 50,-0.2 47,-0.2 -0.875 82.1 -63.5 150.6 179.3 10.2 -15.8 1.7 129 129 A L H > S+ 0 0 1 45,-2.0 4,-2.0 42,-0.4 5,-0.2 0.885 131.8 52.6 -66.7 -39.3 10.0 -15.7 5.5 130 130 A P H > S+ 0 0 26 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.916 108.9 51.4 -62.3 -40.0 10.3 -11.9 5.7 131 131 A A H > S+ 0 0 7 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.867 107.4 53.4 -62.1 -35.2 7.4 -11.7 3.2 132 132 A L H X S+ 0 0 0 -4,-1.5 4,-2.3 2,-0.2 -1,-0.2 0.908 106.3 52.1 -69.8 -37.2 5.4 -14.0 5.3 133 133 A D H X S+ 0 0 28 -4,-2.0 4,-2.2 1,-0.2 -2,-0.2 0.953 111.4 48.0 -60.3 -42.9 6.0 -11.8 8.3 134 134 A T H X S+ 0 0 77 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.866 109.5 52.0 -62.6 -40.5 4.8 -8.9 6.2 135 135 A A H X S+ 0 0 3 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.923 108.9 49.7 -65.8 -41.4 1.7 -10.8 5.1 136 136 A I H X S+ 0 0 1 -4,-2.3 4,-1.0 1,-0.2 -2,-0.2 0.937 111.8 50.1 -59.7 -46.1 0.7 -11.7 8.7 137 137 A S H >< S+ 0 0 49 -4,-2.2 3,-0.6 1,-0.2 4,-0.4 0.884 110.5 49.3 -58.1 -46.1 1.1 -8.0 9.6 138 138 A T H >< S+ 0 0 44 -4,-2.2 3,-1.2 1,-0.2 -1,-0.2 0.893 108.2 53.1 -60.7 -44.5 -1.1 -6.9 6.6 139 139 A L H 3< S+ 0 0 2 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.703 90.0 79.0 -70.7 -12.3 -3.9 -9.4 7.4 140 140 A L T << S+ 0 0 25 -4,-1.0 2,-0.4 -3,-0.6 -1,-0.2 0.804 103.2 31.0 -63.0 -33.7 -4.1 -8.1 11.0 141 141 A H S < S- 0 0 144 -3,-1.2 -1,-0.2 -4,-0.4 6,-0.1 -0.989 101.0 -99.5-130.0 128.7 -6.1 -5.1 9.8 142 142 A Y + 0 0 104 -2,-0.4 2,-0.2 -3,-0.1 -3,-0.1 -0.122 54.8 142.1 -56.1 131.2 -8.4 -5.1 6.9 143 143 A D > - 0 0 84 -5,-0.1 4,-2.8 1,-0.1 5,-0.2 -0.772 32.1-158.8-157.2 103.6 -7.2 -3.7 3.6 144 144 A S H > S+ 0 0 32 -2,-0.2 4,-1.6 1,-0.2 -1,-0.1 0.869 89.4 46.4 -66.1 -37.0 -8.6 -5.8 0.7 145 145 A T H > S+ 0 0 85 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.947 117.8 43.3 -65.6 -45.2 -6.0 -4.8 -1.9 146 146 A A H > S+ 0 0 35 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.881 111.1 56.9 -64.3 -40.9 -3.1 -5.3 0.5 147 147 A A H X S+ 0 0 2 -4,-2.8 4,-2.7 1,-0.2 -1,-0.2 0.818 98.8 59.9 -59.7 -38.4 -4.6 -8.6 1.7 148 148 A A H X S+ 0 0 0 -4,-1.6 4,-1.9 2,-0.2 -1,-0.2 0.929 109.6 41.9 -56.5 -49.2 -4.7 -10.1 -1.8 149 149 A G H X S+ 0 0 17 -4,-1.1 4,-2.1 2,-0.2 -2,-0.2 0.903 114.3 51.6 -62.3 -40.7 -0.9 -9.7 -2.1 150 150 A A H X S+ 0 0 5 -4,-2.0 4,-2.7 1,-0.2 -2,-0.2 0.882 109.6 51.0 -63.1 -40.0 -0.5 -11.0 1.5 151 151 A L H X S+ 0 0 0 -4,-2.7 4,-2.9 2,-0.2 5,-0.2 0.851 105.2 54.6 -70.7 -31.1 -2.6 -14.0 0.7 152 152 A L H X S+ 0 0 0 -4,-1.9 4,-1.6 1,-0.2 -2,-0.2 0.918 112.7 45.2 -67.4 -37.0 -0.6 -14.8 -2.5 153 153 A V H X S+ 0 0 9 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.949 114.3 48.4 -67.8 -45.6 2.5 -14.8 -0.2 154 154 A L H X S+ 0 0 1 -4,-2.7 4,-0.8 1,-0.2 5,-0.4 0.912 109.9 49.7 -62.9 -44.3 0.7 -16.9 2.5 155 155 A I H ><>S+ 0 0 18 -4,-2.9 5,-2.2 1,-0.2 3,-0.6 0.922 114.7 45.8 -62.8 -42.7 -0.7 -19.5 0.2 156 156 A Q H 3<>S+ 0 0 0 -4,-1.6 5,-0.6 -5,-0.2 -1,-0.2 0.853 113.5 46.5 -67.2 -38.5 2.7 -20.1 -1.4 157 157 A T H 3<5S+ 0 0 0 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.470 128.6 22.3 -85.4 -5.1 4.8 -20.2 1.8 158 158 A T T 5S+ 0 0 3 -5,-0.4 4,-2.1 1,-0.2 -3,-0.2 0.887 123.9 45.6 -49.0 -52.7 0.1 -24.7 1.2 160 160 A E H > S+ 0 0 73 71,-2.8 4,-2.5 -2,-0.4 5,-0.2 0.877 100.7 59.6 -59.1 -37.1 9.5 -30.3 -1.3 166 166 A Y H > S+ 0 0 32 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.917 106.2 47.2 -58.6 -41.1 11.1 -28.1 -4.0 167 167 A I H > S+ 0 0 0 -3,-0.4 4,-2.2 -7,-0.3 -6,-0.2 0.928 109.1 53.0 -71.6 -35.2 8.9 -25.2 -2.9 168 168 A E H X S+ 0 0 21 -4,-2.0 4,-2.4 -7,-0.5 -1,-0.2 0.946 110.8 48.5 -61.0 -45.2 9.6 -25.7 0.8 169 169 A Q H X S+ 0 0 73 -4,-2.5 4,-1.7 1,-0.2 -1,-0.2 0.886 107.4 54.9 -62.3 -38.5 13.4 -25.6 -0.1 170 170 A Q H X S+ 0 0 22 -4,-2.2 4,-0.7 1,-0.2 -1,-0.2 0.891 109.0 47.0 -62.8 -38.8 12.9 -22.4 -2.1 171 171 A I H >< S+ 0 0 0 -4,-2.2 3,-0.9 1,-0.2 -42,-0.4 0.896 108.2 57.0 -69.8 -36.4 11.3 -20.7 0.9 172 172 A Q H >< S+ 0 0 50 -4,-2.4 3,-1.0 1,-0.3 -1,-0.2 0.845 103.8 52.7 -59.6 -36.6 14.1 -22.0 3.1 173 173 A E H 3< S+ 0 0 137 -4,-1.7 3,-0.3 1,-0.3 -1,-0.3 0.752 108.2 52.8 -66.5 -25.3 16.6 -20.3 0.8 174 174 A R T << S+ 0 0 8 -3,-0.9 -45,-2.0 -4,-0.7 -1,-0.3 -0.129 70.8 121.7-101.2 31.2 14.5 -17.2 1.4 175 175 A A S < S+ 0 0 4 -3,-1.0 -1,-0.2 -47,-0.2 -2,-0.1 0.823 92.1 13.1 -65.2 -33.8 14.6 -17.3 5.2 176 176 A Y S S+ 0 0 154 -3,-0.3 2,-0.3 1,-0.3 -1,-0.2 0.339 130.6 42.5-125.6 -0.2 16.3 -13.9 5.5 177 177 A R S S- 0 0 184 -4,-0.1 -1,-0.3 -50,-0.1 -50,-0.1 -0.874 75.0-134.0-147.7 119.6 15.9 -12.3 2.0 178 178 A D + 0 0 53 -2,-0.3 2,-0.3 -50,-0.1 -50,-0.2 -0.307 24.6 176.0 -71.0 156.0 12.8 -12.4 -0.2 179 179 A E B -H 127 0D 96 -52,-2.4 -52,-1.9 -54,-0.1 3,-0.1 -0.975 37.7 -96.3-154.3 144.7 12.9 -13.2 -3.8 180 180 A V - 0 0 56 -2,-0.3 -57,-0.1 -54,-0.3 -56,-0.1 -0.209 59.4 -87.4 -57.9 150.0 10.2 -13.6 -6.5 181 181 A P - 0 0 10 0, 0.0 -1,-0.1 0, 0.0 -56,-0.0 -0.363 44.7-108.4 -61.1 143.0 9.3 -17.3 -7.1 182 182 A S > - 0 0 29 1,-0.1 4,-1.8 -3,-0.1 3,-0.3 -0.240 29.4-110.7 -62.4 156.5 11.5 -19.3 -9.6 183 183 A S H > S+ 0 0 82 1,-0.2 4,-2.4 2,-0.2 33,-0.2 0.872 121.8 56.4 -57.8 -34.9 9.7 -20.1 -12.9 184 184 A A H > S+ 0 0 5 33,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.878 103.4 54.0 -66.1 -37.5 9.8 -23.8 -11.7 185 185 A T H > S+ 0 0 1 -3,-0.3 4,-2.4 2,-0.2 5,-0.2 0.951 110.1 45.4 -62.4 -47.8 7.9 -22.8 -8.5 186 186 A I H X S+ 0 0 10 -4,-1.8 4,-2.0 1,-0.2 -1,-0.2 0.914 111.4 54.2 -61.4 -42.3 5.2 -21.2 -10.5 187 187 A S H X S+ 0 0 15 -4,-2.4 4,-1.6 1,-0.2 -1,-0.2 0.920 109.8 46.2 -57.4 -49.1 5.1 -24.2 -12.8 188 188 A L H X S+ 0 0 6 -4,-2.5 4,-0.9 2,-0.2 3,-0.3 0.921 110.2 52.7 -64.0 -42.4 4.6 -26.7 -10.0 189 189 A E H >< S+ 0 0 11 -4,-2.4 3,-0.7 1,-0.3 4,-0.3 0.921 112.2 46.0 -58.5 -45.1 1.9 -24.6 -8.3 190 190 A N H 3< S+ 0 0 94 -4,-2.0 4,-0.3 1,-0.2 -1,-0.3 0.758 115.1 48.5 -65.7 -28.7 0.0 -24.5 -11.5 191 191 A S H 3X S+ 0 0 20 -4,-1.6 4,-3.5 -3,-0.3 5,-0.3 0.436 77.8 100.5 -96.1 -0.6 0.5 -28.3 -12.1 192 192 A W H S+ 0 0 46 -4,-0.3 4,-2.3 -3,-0.2 -1,-0.2 0.962 116.6 49.0 -65.0 -46.9 -4.0 -30.8 -9.8 194 194 A G H > S+ 0 0 34 -4,-0.3 4,-2.4 1,-0.2 -2,-0.2 0.912 115.1 44.8 -54.8 -50.5 -2.7 -32.2 -13.2 195 195 A L H X S+ 0 0 0 -4,-3.5 4,-2.1 2,-0.2 -1,-0.2 0.876 110.6 52.8 -63.4 -41.3 0.1 -34.1 -11.5 196 196 A S H X S+ 0 0 0 -4,-2.4 4,-1.8 -5,-0.3 -1,-0.2 0.921 112.2 47.3 -59.3 -44.4 -2.1 -35.4 -8.7 197 197 A K H X S+ 0 0 88 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.920 111.9 48.1 -65.5 -48.9 -4.5 -36.7 -11.4 198 198 A Q H X S+ 0 0 13 -4,-2.4 4,-1.6 2,-0.2 12,-0.2 0.830 109.4 53.1 -63.4 -36.5 -1.8 -38.3 -13.6 199 199 A I H X S+ 0 0 0 -4,-2.1 4,-0.6 2,-0.2 -1,-0.2 0.910 110.8 47.6 -65.8 -40.2 -0.2 -40.1 -10.6 200 200 A Q H >< S+ 0 0 24 -4,-1.8 3,-0.9 -5,-0.2 -2,-0.2 0.895 111.9 48.6 -65.7 -38.8 -3.5 -41.5 -9.7 201 201 A L H 3< S+ 0 0 61 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.771 96.9 72.0 -74.7 -23.8 -4.2 -42.7 -13.3 202 202 A A H ><>S+ 0 0 0 -4,-1.6 5,-2.7 5,-0.2 3,-2.0 0.766 79.5 83.8 -62.0 -24.4 -0.8 -44.2 -13.6 203 203 A Q T <<5S+ 0 0 134 -3,-0.9 -172,-0.0 -4,-0.6 -4,-0.0 -0.696 101.5 24.6 -78.7 118.2 -2.1 -46.9 -11.2 204 204 A G T 3 5S+ 0 0 59 -2,-0.7 -1,-0.3 0, 0.0 -2,-0.1 0.329 116.9 70.2 103.8 -7.6 -3.7 -49.1 -13.7 205 205 A N T X 5S- 0 0 35 -3,-2.0 3,-1.8 0, 0.0 -2,-0.2 0.004 115.1 -99.8-133.0 30.7 -1.5 -47.9 -16.5 206 206 A N T 3 5S- 0 0 160 1,-0.3 -3,-0.2 21,-0.0 3,-0.1 0.764 79.5 -57.0 60.0 29.9 1.9 -49.4 -15.5 207 207 A G T 3 - 0 0 48 4,-3.4 3,-3.1 -2,-0.5 -33,-0.2 -0.262 25.4 -93.1 -87.8 171.1 12.8 -27.3 -14.3 218 218 A S T 3 S+ 0 0 94 1,-0.3 -1,-0.1 2,-0.1 -35,-0.1 0.537 128.9 49.7 -53.0 -19.3 15.2 -26.1 -11.5 219 219 A K T 3 S- 0 0 179 2,-0.2 -1,-0.3 -35,-0.0 -2,-0.0 0.318 125.0-103.6-100.4 -0.2 17.5 -24.8 -14.2 220 220 A G S < S+ 0 0 46 -3,-3.1 2,-0.3 1,-0.3 -2,-0.1 0.575 76.8 134.6 89.1 12.7 14.6 -22.9 -16.0 221 221 A N - 0 0 101 1,-0.0 -4,-3.4 -5,-0.0 2,-1.1 -0.771 60.7-112.9-102.2 140.9 14.2 -25.4 -18.9 222 222 A R E +J 216 0F 161 -2,-0.3 -6,-0.3 -6,-0.3 2,-0.1 -0.596 43.5 179.8 -81.3 85.3 10.7 -26.8 -20.2 223 223 A V E -J 215 0F 52 -2,-1.1 -8,-2.5 -8,-1.1 2,-0.4 -0.235 24.3-132.0 -81.6 162.1 10.5 -30.6 -19.4 224 224 A Q E -J 214 0F 98 -10,-0.2 2,-0.6 -2,-0.1 -10,-0.2 -0.968 11.7-154.4-118.9 126.5 7.9 -33.3 -20.0 225 225 A I E +J 213 0F 10 -12,-3.1 -12,-2.4 -2,-0.4 3,-0.1 -0.891 25.4 159.2-105.9 116.9 6.8 -35.6 -17.1 226 226 A T E + 0 0 58 -2,-0.6 -17,-2.5 -14,-0.2 2,-0.3 0.587 55.5 16.0-114.7 -15.7 5.5 -38.9 -18.5 227 227 A N E > S-J 208 0F 46 -19,-0.3 3,-1.4 -17,-0.0 -19,-0.2 -0.953 79.3 -93.5-156.3 170.6 5.7 -41.5 -15.8 228 228 A V T 3 S+ 0 0 20 -21,-2.5 -20,-0.1 -2,-0.3 -21,-0.1 0.510 107.9 74.4 -70.4 -7.7 6.1 -42.1 -12.1 229 229 A T T 3 S+ 0 0 107 -22,-0.2 -1,-0.3 4,-0.1 -21,-0.0 0.548 71.4 112.9 -82.4 -3.6 9.9 -42.6 -12.2 230 230 A S S X> S- 0 0 26 -3,-1.4 4,-2.2 1,-0.1 3,-1.1 -0.346 79.4-121.4 -71.9 146.3 10.3 -38.8 -12.7 231 231 A N H 3>>S+ 0 0 127 1,-0.3 4,-2.4 2,-0.2 5,-1.6 0.830 111.9 65.9 -54.1 -33.9 12.0 -36.9 -9.9 232 232 A V H 34>S+ 0 0 17 1,-0.2 5,-2.7 3,-0.2 -1,-0.3 0.880 112.3 33.8 -57.0 -34.9 8.9 -34.8 -9.6 233 233 A V H <45S+ 0 0 5 -3,-1.1 -2,-0.2 -6,-0.2 -1,-0.2 0.863 121.6 44.3 -90.3 -37.3 7.0 -37.9 -8.4 234 234 A T H <5S+ 0 0 87 -4,-2.2 -3,-0.2 1,-0.1 -2,-0.2 0.778 134.6 6.7 -82.6 -21.8 9.7 -39.8 -6.5 235 235 A S T <5S+ 0 0 45 -4,-2.4 -3,-0.2 -5,-0.3 -70,-0.1 0.751 124.0 45.6-128.9 -37.5 11.1 -36.9 -4.6 236 236 A N T - 0 0 13 -175,-0.5 3,-2.0 -2,-0.4 -45,-0.1 -0.348 14.6-130.2 -61.0 135.1 -7.9 -36.9 -4.8 243 243 A T G > S+ 0 0 57 1,-0.3 3,-1.8 2,-0.2 -1,-0.1 0.781 106.3 72.9 -57.4 -25.9 -9.3 -37.4 -8.4 244 244 A K G 3 S+ 0 0 157 1,-0.3 -1,-0.3 2,-0.2 -2,-0.1 0.780 100.4 46.2 -56.9 -18.8 -12.7 -37.3 -6.8 245 245 A N G < 0 0 72 -3,-2.0 -1,-0.3 1,-0.1 -2,-0.2 0.205 360.0 360.0-107.4 13.5 -12.1 -33.6 -6.4 246 246 A I < 0 0 81 -3,-1.8 -2,-0.2 -5,-0.1 -3,-0.1 0.723 360.0 360.0-111.1 360.0 -10.7 -32.9 -10.0