==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 04-DEC-07 3BJG . COMPND 2 MOLECULE: RICIN A CHAIN (RRNA N-GLYCOSIDASE); . SOURCE 2 ORGANISM_SCIENTIFIC: RICINUS COMMUNIS; . AUTHOR P.M.LEGLER,C.B.MILLARD . 261 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11938.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 175 67.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 13 5.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 33 12.6 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 . 3 1.1 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 . 15 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 10.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 76 29.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 2.3 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 0 1 0 1 2 1 0 0 1 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 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 0 0 0 PARALLEL BRIDGES PER LADDER . 2 1 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 ANTIPARALLEL BRIDGES PER LADDER . 1 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 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 5 A Q 0 0 234 0, 0.0 3,-0.1 0, 0.0 102,-0.1 0.000 360.0 360.0 360.0 105.0 12.0 46.7 43.6 2 6 A Y - 0 0 31 1,-0.1 52,-0.2 52,-0.1 49,-0.1 -0.242 360.0 -92.2 -62.3 145.2 12.6 43.1 44.6 3 7 A P - 0 0 40 0, 0.0 52,-3.1 0, 0.0 2,-0.4 -0.312 43.1-147.3 -61.7 150.2 16.0 42.1 46.0 4 8 A I E -a 55 0A 91 50,-0.2 2,-0.4 -3,-0.1 52,-0.2 -0.960 14.1-169.4-122.4 132.9 18.4 40.8 43.3 5 9 A I E -a 56 0A 11 50,-2.7 52,-2.7 -2,-0.4 2,-0.4 -0.989 15.7-150.2-118.8 136.4 21.2 38.3 43.6 6 10 A N E +a 57 0A 102 -2,-0.4 2,-0.4 50,-0.2 52,-0.2 -0.862 18.3 171.9-108.8 135.0 23.6 37.9 40.7 7 11 A F E -a 58 0A 12 50,-2.5 52,-2.5 -2,-0.4 2,-0.4 -0.994 13.9-161.6-139.4 137.8 25.4 34.7 39.7 8 12 A T E -a 59 0A 58 -2,-0.4 52,-0.2 50,-0.2 133,-0.1 -0.988 10.7-161.0-113.4 132.7 27.5 34.0 36.7 9 13 A T > + 0 0 0 50,-2.4 3,-1.8 -2,-0.4 2,-0.4 0.653 68.4 102.8 -77.4 -20.2 28.2 30.4 35.7 10 14 A A T 3 S- 0 0 31 49,-0.4 -2,-0.1 1,-0.3 3,-0.1 -0.535 104.9 -7.8 -68.9 123.2 31.1 31.8 33.6 11 15 A G T 3 S+ 0 0 74 -2,-0.4 -1,-0.3 1,-0.2 5,-0.1 0.677 95.9 174.9 58.8 21.8 34.2 31.0 35.6 12 16 A A < - 0 0 17 -3,-1.8 2,-0.3 4,-0.1 -1,-0.2 -0.222 7.6-172.0 -56.6 142.7 32.0 29.9 38.5 13 17 A T > - 0 0 71 -3,-0.1 4,-2.8 1,-0.1 5,-0.3 -0.824 41.8 -99.8-127.1 171.0 33.8 28.4 41.5 14 18 A V H > S+ 0 0 17 -2,-0.3 4,-3.0 1,-0.2 5,-0.2 0.942 125.6 48.5 -51.8 -44.8 32.8 26.7 44.6 15 19 A Q H > S+ 0 0 103 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.932 111.5 44.7 -68.7 -47.1 33.3 30.0 46.3 16 20 A S H > S+ 0 0 41 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.882 117.3 47.1 -68.9 -30.7 31.4 32.1 43.9 17 21 A Y H X S+ 0 0 0 -4,-2.8 4,-3.3 2,-0.2 -1,-0.2 0.906 112.2 49.6 -72.7 -44.3 28.5 29.5 43.9 18 22 A T H X S+ 0 0 0 -4,-3.0 4,-2.4 -5,-0.3 5,-0.2 0.910 110.9 50.3 -56.9 -49.3 28.6 29.3 47.7 19 23 A N H X S+ 0 0 86 -4,-3.0 4,-2.0 2,-0.2 -2,-0.2 0.885 111.6 49.6 -54.2 -43.1 28.4 33.1 47.9 20 24 A F H X S+ 0 0 5 -4,-1.8 4,-2.7 -5,-0.2 -2,-0.2 0.965 112.2 45.1 -64.6 -52.6 25.5 33.0 45.5 21 25 A I H X S+ 0 0 0 -4,-3.3 4,-3.3 1,-0.2 5,-0.2 0.905 112.7 50.4 -61.2 -41.5 23.6 30.4 47.4 22 26 A R H X S+ 0 0 144 -4,-2.4 4,-2.9 2,-0.2 -1,-0.2 0.858 110.9 50.7 -62.9 -39.5 24.1 32.0 50.8 23 27 A A H X S+ 0 0 40 -4,-2.0 4,-2.5 -5,-0.2 5,-0.2 0.955 113.7 44.1 -62.5 -44.7 23.0 35.3 49.3 24 28 A V H X S+ 0 0 0 -4,-2.7 4,-1.8 2,-0.2 -2,-0.2 0.969 117.6 44.7 -61.1 -49.9 19.8 33.7 47.9 25 29 A R H < S+ 0 0 31 -4,-3.3 4,-0.4 1,-0.2 -1,-0.2 0.894 111.4 55.3 -61.3 -43.0 19.3 31.8 51.2 26 30 A G H >< S+ 0 0 44 -4,-2.9 3,-0.9 1,-0.2 -1,-0.2 0.884 109.1 46.2 -56.0 -44.7 20.0 35.0 53.1 27 31 A R H 3< S+ 0 0 135 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.802 112.0 52.1 -71.3 -27.2 17.3 36.9 51.2 28 32 A L T 3< S+ 0 0 0 -4,-1.8 2,-0.9 -5,-0.2 -1,-0.2 0.528 93.1 85.4 -80.2 -8.3 15.0 34.0 51.8 29 33 A T < + 0 0 47 -3,-0.9 12,-0.1 -4,-0.4 -1,-0.1 -0.840 51.8 178.7-100.1 100.9 15.7 34.1 55.5 30 34 A T - 0 0 68 -2,-0.9 -1,-0.2 10,-0.4 11,-0.1 0.789 34.6-135.6 -69.2 -26.6 13.4 36.6 57.1 31 35 A G S S+ 0 0 58 2,-0.2 3,-0.2 9,-0.2 -1,-0.1 0.454 82.6 102.8 78.1 1.5 14.8 35.9 60.6 32 36 A A S S+ 0 0 89 1,-0.2 2,-0.4 8,-0.2 9,-0.1 0.717 82.5 31.5 -79.3 -26.4 11.2 35.9 61.8 33 37 A D + 0 0 23 7,-0.4 7,-3.3 2,-0.0 2,-0.4 -0.932 60.1 156.7-148.9 107.4 10.8 32.1 62.1 34 38 A V E -F 39 0B 79 -2,-0.4 2,-0.4 5,-0.3 3,-0.1 -0.996 15.7-170.8-135.9 126.1 13.5 29.6 62.9 35 39 A R E > S-F 38 0B 17 3,-2.5 3,-1.5 -2,-0.4 180,-0.0 -0.991 75.8 -11.7-125.7 120.1 12.5 26.2 64.3 36 40 A H T 3 S- 0 0 74 -2,-0.4 -1,-0.2 1,-0.3 179,-0.0 0.924 131.0 -55.2 54.9 43.7 15.2 23.9 65.7 37 41 A E T 3 S+ 0 0 148 1,-0.2 -1,-0.3 -3,-0.1 -3,-0.0 0.455 115.7 114.4 77.8 -0.6 17.8 26.2 64.1 38 42 A I E < -F 35 0B 2 -3,-1.5 -3,-2.5 212,-0.0 -1,-0.2 -0.929 66.1-127.0-111.0 119.0 16.2 26.0 60.7 39 43 A P E -F 34 0B 26 0, 0.0 212,-2.0 0, 0.0 2,-0.4 -0.244 18.7-143.3 -61.5 149.1 14.7 29.1 59.2 40 44 A V B -g 251 0C 1 -7,-3.3 -10,-0.4 210,-0.2 -7,-0.4 -0.924 18.7-118.0-111.7 141.8 11.2 28.8 58.0 41 45 A L - 0 0 0 210,-4.0 32,-0.2 -2,-0.4 212,-0.1 -0.407 47.2 -81.9 -71.1 156.0 10.2 30.7 54.9 42 46 A P - 0 0 18 0, 0.0 211,-0.3 0, 0.0 2,-0.2 -0.285 48.1-103.9 -62.8 144.2 7.5 33.3 55.4 43 47 A N - 0 0 52 1,-0.1 4,-0.1 2,-0.1 211,-0.1 -0.498 21.1-137.6 -60.6 128.7 3.9 32.1 55.5 44 48 A R S > S+ 0 0 85 -2,-0.2 3,-1.9 209,-0.1 2,-0.3 0.823 80.8 96.8 -52.3 -33.6 2.1 33.0 52.2 45 49 A V T 3 S- 0 0 110 1,-0.3 -2,-0.1 3,-0.0 0, 0.0 -0.419 104.7 -5.5 -73.1 119.3 -0.9 34.0 54.2 46 50 A G T 3 S+ 0 0 74 -2,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.526 91.1 151.7 80.4 2.5 -0.9 37.7 54.7 47 51 A L < - 0 0 27 -3,-1.9 -1,-0.2 -4,-0.1 5,-0.1 -0.574 48.8-121.1 -76.8 117.0 2.5 38.1 53.0 48 52 A P > - 0 0 57 0, 0.0 3,-1.9 0, 0.0 -1,-0.1 -0.270 12.6-125.5 -60.0 139.4 2.7 41.5 51.4 49 53 A I G > S+ 0 0 44 1,-0.3 3,-1.4 2,-0.2 4,-0.4 0.825 111.4 64.2 -51.0 -34.7 3.3 41.5 47.7 50 54 A N G 3 S+ 0 0 130 1,-0.3 -1,-0.3 2,-0.1 3,-0.2 0.747 106.8 38.7 -52.7 -35.9 6.2 43.7 48.6 51 55 A Q G < S+ 0 0 128 -3,-1.9 -1,-0.3 1,-0.1 -2,-0.2 0.018 97.8 93.7-108.7 19.5 8.0 41.1 50.6 52 56 A R S < S+ 0 0 13 -3,-1.4 20,-2.8 1,-0.1 21,-0.4 0.745 76.5 36.6 -93.2 -30.6 7.0 38.3 48.2 53 57 A F E - B 0 71A 2 -4,-0.4 2,-0.3 18,-0.2 18,-0.2 -0.918 47.8-162.9-131.1 156.1 9.7 37.8 45.6 54 58 A I E - B 0 70A 2 16,-2.2 16,-3.3 -2,-0.3 2,-0.4 -0.933 20.6-135.5-127.1 157.8 13.4 37.8 45.1 55 59 A L E -aB 4 69A 20 -52,-3.1 -50,-2.7 -2,-0.3 2,-0.5 -0.935 10.1-165.5-119.0 133.6 15.3 38.0 41.8 56 60 A V E -aB 5 68A 0 12,-2.9 12,-3.4 -2,-0.4 2,-0.6 -0.966 10.9-156.6-119.6 108.4 18.2 35.9 40.8 57 61 A E E -aB 6 67A 70 -52,-2.7 -50,-2.5 -2,-0.5 2,-0.5 -0.772 11.3-161.9 -88.4 122.4 20.0 37.3 37.8 58 62 A L E +aB 7 66A 0 8,-3.7 8,-2.3 -2,-0.6 2,-0.3 -0.930 10.9 178.9-110.9 130.6 21.9 34.5 36.0 59 63 A S E -aB 8 65A 44 -52,-2.5 -50,-2.4 -2,-0.5 -49,-0.4 -0.897 7.4-166.2-120.9 159.1 24.6 35.3 33.5 60 64 A N > - 0 0 1 4,-1.5 3,-1.9 -2,-0.3 81,-0.0 -0.791 40.3 -91.5-139.8-178.0 26.7 32.9 31.7 61 65 A H T 3 S+ 0 0 136 1,-0.3 -1,-0.0 -2,-0.3 80,-0.0 0.758 120.1 64.8 -68.7 -27.3 29.8 32.5 29.6 62 66 A A T 3 S- 0 0 49 79,-0.2 -1,-0.3 2,-0.1 3,-0.1 0.403 117.5-115.6 -71.6 3.8 27.8 33.1 26.4 63 67 A E S < S+ 0 0 169 -3,-1.9 2,-0.3 1,-0.3 -2,-0.2 0.714 72.5 137.5 66.3 22.3 27.2 36.6 27.9 64 68 A L - 0 0 20 18,-0.0 -4,-1.5 2,-0.0 2,-0.4 -0.758 35.8-163.1 -97.8 149.5 23.6 35.9 28.2 65 69 A S E +B 59 0A 37 -2,-0.3 18,-0.4 -6,-0.2 2,-0.3 -0.984 11.8 176.9-134.5 139.0 21.5 36.8 31.2 66 70 A V E -B 58 0A 1 -8,-2.3 -8,-3.7 -2,-0.4 2,-0.6 -0.950 22.8-137.2-129.5 152.6 18.0 35.8 32.5 67 71 A T E -BC 57 81A 14 14,-3.0 14,-2.8 -2,-0.3 2,-0.3 -0.956 14.8-157.8-116.2 114.2 16.4 36.9 35.7 68 72 A L E -BC 56 80A 0 -12,-3.4 -12,-2.9 -2,-0.6 2,-0.5 -0.681 7.1-146.4 -84.6 140.5 14.6 34.2 37.8 69 73 A A E -BC 55 79A 0 10,-2.9 9,-3.0 -2,-0.3 10,-0.8 -0.940 15.5-162.1-105.8 126.4 12.0 35.3 40.2 70 74 A L E -BC 54 77A 0 -16,-3.3 -16,-2.2 -2,-0.5 2,-0.6 -0.896 19.4-121.9-107.6 144.8 11.8 33.1 43.3 71 75 A D E >> -B 53 0A 4 5,-2.5 4,-2.3 -2,-0.4 3,-1.3 -0.730 11.6-144.2 -83.2 122.4 8.9 33.0 45.6 72 76 A M T 34 S+ 0 0 12 -20,-2.8 -1,-0.1 -2,-0.6 -19,-0.1 0.732 96.5 62.2 -49.0 -28.2 9.8 34.0 49.2 73 77 A T T 34 S+ 0 0 8 -21,-0.4 180,-0.5 1,-0.2 -1,-0.2 0.693 127.9 2.1 -83.2 -17.9 7.3 31.4 50.5 74 78 A N T <4 S- 0 0 42 -3,-1.3 -2,-0.2 2,-0.1 -1,-0.2 0.288 90.7-116.2-147.0 5.4 8.9 28.3 49.0 75 79 A A < + 0 0 0 -4,-2.3 -3,-0.2 1,-0.2 100,-0.1 0.632 65.7 154.6 58.6 14.2 12.1 29.5 47.2 76 80 A A - 0 0 24 -5,-0.4 -5,-2.5 -6,-0.1 2,-0.5 -0.406 52.6-116.1 -73.3 145.6 10.4 28.3 44.0 77 81 A V E +C 70 0A 7 -7,-0.2 -7,-0.2 40,-0.2 3,-0.1 -0.699 33.1 178.6 -74.8 122.6 11.2 29.6 40.6 78 82 A V E - 0 0 19 -9,-3.0 11,-2.3 -2,-0.5 2,-0.3 0.510 59.3 -55.1-103.6 -5.4 7.9 31.2 39.5 79 83 A G E -CD 69 88A 0 -10,-0.8 -10,-2.9 9,-0.3 -1,-0.4 -0.956 54.9-122.5 153.3-172.4 9.2 32.5 36.2 80 84 A Y E -CD 68 87A 0 7,-2.5 7,-2.6 -2,-0.3 2,-0.4 -0.993 9.2-122.0-162.7 159.8 11.9 34.6 34.7 81 85 A R E -CD 67 86A 62 -14,-2.8 -14,-3.0 -2,-0.3 2,-0.4 -0.905 17.5-179.0-111.2 137.5 12.8 37.6 32.5 82 86 A A E > - D 0 85A 1 3,-3.1 3,-1.9 -2,-0.4 -16,-0.1 -0.947 66.1 -54.0-131.3 115.1 15.0 37.5 29.4 83 87 A G T 3 S- 0 0 38 -18,-0.4 -16,-0.0 -2,-0.4 -1,-0.0 -0.307 124.9 -10.5 56.0-123.2 15.5 40.9 27.8 84 88 A N T 3 S+ 0 0 82 23,-0.1 25,-2.4 -3,-0.1 24,-1.0 0.121 123.6 80.8 -98.4 23.7 12.1 42.5 27.3 85 89 A S E < -De 82 109A 10 -3,-1.9 -3,-3.1 23,-0.2 2,-0.4 -0.973 54.1-165.1-127.8 145.3 10.1 39.3 28.0 86 90 A A E -De 81 110A 0 23,-2.6 25,-2.4 -2,-0.3 2,-0.4 -0.980 4.6-164.1-127.0 141.4 8.9 37.5 31.2 87 91 A Y E -De 80 111A 8 -7,-2.6 -7,-2.5 -2,-0.4 2,-0.4 -0.988 7.6-167.3-125.4 128.0 7.6 34.0 31.4 88 92 A F E -De 79 112A 2 23,-2.7 25,-3.2 -2,-0.4 -9,-0.3 -0.952 24.0-115.3-119.2 141.8 5.7 32.7 34.4 89 93 A F - 0 0 12 -11,-2.3 27,-0.3 -2,-0.4 25,-0.1 -0.359 54.3 -82.0 -61.8 150.4 4.7 29.2 35.4 90 94 A H - 0 0 92 25,-3.4 27,-0.3 1,-0.1 -1,-0.1 -0.385 56.1-114.0 -53.5 120.8 1.0 28.6 35.5 91 95 A P - 0 0 23 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.357 11.6-143.1 -61.7 138.6 -0.2 30.0 38.9 92 96 A D S S+ 0 0 123 1,-0.1 2,-0.3 -3,-0.1 -2,-0.1 0.604 81.7 4.0 -74.5 -15.5 -1.5 27.4 41.4 93 97 A N S > S- 0 0 51 1,-0.1 4,-1.8 0, 0.0 5,-0.1 -0.972 82.4 -94.9-162.7 173.4 -4.1 29.8 42.6 94 98 A Q H > S+ 0 0 141 -2,-0.3 4,-2.4 1,-0.2 5,-0.2 0.855 118.1 54.5 -71.2 -34.5 -5.6 33.3 42.0 95 99 A E H > S+ 0 0 113 2,-0.2 4,-3.0 1,-0.2 -1,-0.2 0.914 108.5 49.0 -67.9 -38.3 -3.5 35.1 44.5 96 100 A D H > S+ 0 0 15 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.893 109.1 54.7 -63.5 -36.0 -0.3 33.7 43.0 97 101 A A H X S+ 0 0 23 -4,-1.8 4,-0.7 2,-0.2 -2,-0.2 0.908 113.2 41.6 -58.9 -43.3 -1.7 34.9 39.6 98 102 A E H >< S+ 0 0 89 -4,-2.4 3,-1.2 1,-0.2 4,-0.4 0.937 110.6 57.3 -69.9 -44.7 -2.1 38.3 41.1 99 103 A A H >< S+ 0 0 2 -4,-3.0 3,-1.9 1,-0.3 -2,-0.2 0.909 101.6 55.5 -54.0 -44.3 1.3 38.2 42.9 100 104 A I H >< S+ 0 0 13 -4,-2.4 3,-2.0 1,-0.3 -1,-0.3 0.723 90.3 73.1 -68.7 -18.2 3.2 37.6 39.7 101 105 A T T << S+ 0 0 76 -3,-1.2 -1,-0.3 -4,-0.7 -2,-0.2 0.635 91.1 62.4 -64.8 -13.9 1.8 40.7 38.0 102 106 A H T < S+ 0 0 68 -3,-1.9 2,-0.4 -4,-0.4 3,-0.3 0.473 89.4 90.0 -91.9 1.9 4.1 42.5 40.4 103 107 A L S < S- 0 0 0 -3,-2.0 -23,-0.1 1,-0.2 -17,-0.1 -0.818 101.0 -9.3-100.6 136.3 7.2 40.9 38.7 104 108 A F S > S+ 0 0 19 -2,-0.4 3,-1.5 1,-0.2 -1,-0.2 0.925 75.1 171.9 54.7 52.8 9.2 42.3 35.8 105 109 A T T 3 + 0 0 95 -3,-0.3 -1,-0.2 1,-0.3 -2,-0.1 0.483 67.6 59.4 -85.6 -1.0 6.5 45.0 35.4 106 110 A D T 3 S+ 0 0 120 3,-0.0 -1,-0.3 0, 0.0 2,-0.2 0.291 77.5 111.1-104.8 2.9 8.5 46.9 32.8 107 111 A V < - 0 0 13 -3,-1.5 -22,-0.2 1,-0.1 -23,-0.1 -0.535 61.4-146.7 -74.6 148.1 8.8 44.0 30.3 108 112 A Q S S+ 0 0 151 -24,-1.0 2,-0.5 1,-0.2 -23,-0.2 0.819 85.1 52.7 -80.5 -31.6 6.9 44.6 27.1 109 113 A N E +e 85 0A 59 -25,-2.4 -23,-2.6 -3,-0.0 2,-0.4 -0.914 63.6 177.8-117.6 126.9 6.1 40.9 26.8 110 114 A R E +e 86 0A 95 -2,-0.5 2,-0.4 -25,-0.2 -23,-0.2 -0.991 4.1 176.7-127.7 127.9 4.5 38.7 29.5 111 115 A Y E -e 87 0A 113 -25,-2.4 -23,-2.7 -2,-0.4 2,-0.5 -0.997 18.2-155.9-132.9 143.2 3.6 35.1 29.2 112 116 A T E -e 88 0A 74 -2,-0.4 -23,-0.2 -25,-0.2 -22,-0.1 -0.968 25.2-129.8-115.0 124.7 2.2 32.6 31.5 113 117 A F - 0 0 11 -25,-3.2 -26,-0.0 -2,-0.5 -2,-0.0 -0.354 11.2-130.6 -65.2 152.9 3.0 29.1 30.7 114 118 A A S S+ 0 0 93 -24,-0.1 2,-0.3 -25,-0.1 -1,-0.1 0.436 90.1 68.3 -84.6 -3.7 0.0 26.7 30.6 115 119 A F S S- 0 0 24 1,-0.0 -25,-3.4 7,-0.0 -2,-0.2 -0.834 82.7-119.1-113.8 159.2 2.1 24.4 32.8 116 120 A G - 0 0 0 -2,-0.3 -2,-0.1 -27,-0.3 -38,-0.0 -0.376 23.5-115.9 -87.3 173.5 3.3 24.6 36.4 117 121 A G S S+ 0 0 26 -27,-0.3 2,-0.2 -2,-0.1 -40,-0.2 -0.049 70.6 123.6-102.4 31.1 6.9 24.7 37.5 118 122 A N S > S- 0 0 61 1,-0.1 4,-2.3 -42,-0.1 5,-0.2 -0.590 72.7-114.3 -89.1 153.9 6.7 21.5 39.5 119 123 A Y H > S+ 0 0 29 -2,-0.2 4,-3.4 2,-0.2 5,-0.2 0.832 111.4 57.4 -55.1 -41.4 9.1 18.6 38.7 120 124 A D H > S+ 0 0 100 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.969 112.8 37.8 -60.8 -55.1 6.5 16.3 37.5 121 125 A R H > S+ 0 0 105 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.898 120.3 49.6 -60.5 -37.3 5.1 18.6 34.8 122 126 A L H X S+ 0 0 0 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.865 109.4 49.3 -71.2 -40.9 8.6 19.7 34.0 123 127 A E H X>S+ 0 0 13 -4,-3.4 5,-1.6 2,-0.2 4,-1.3 0.845 113.5 47.2 -63.7 -40.0 10.0 16.3 33.7 124 128 A Q H <5S+ 0 0 128 -4,-2.0 3,-0.2 -5,-0.2 -2,-0.2 0.937 114.1 46.6 -70.5 -43.5 7.2 15.2 31.4 125 129 A L H <5S+ 0 0 46 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.926 114.8 48.3 -61.4 -41.8 7.6 18.3 29.3 126 130 A A H <5S- 0 0 11 -4,-2.7 -1,-0.2 2,-0.2 -2,-0.2 0.722 104.0-131.8 -68.6 -23.8 11.4 17.7 29.4 127 131 A G T <5S+ 0 0 60 -4,-1.3 2,-0.3 -3,-0.2 -3,-0.2 0.682 79.4 84.4 72.7 16.6 11.0 14.1 28.4 128 132 A N S - 0 0 83 -2,-0.3 3,-2.2 1,-0.1 -9,-0.1 -0.448 36.5-108.2 -73.7 154.1 13.3 12.7 34.9 130 134 A R G > S+ 0 0 16 1,-0.3 3,-2.4 2,-0.2 -1,-0.1 0.865 118.6 67.0 -46.2 -42.6 15.6 14.7 37.2 131 135 A E G 3 S+ 0 0 75 1,-0.3 -1,-0.3 64,-0.2 64,-0.2 0.624 106.3 40.5 -62.0 -14.9 17.5 11.5 37.7 132 136 A N G < S+ 0 0 97 -3,-2.2 2,-0.6 2,-0.1 -1,-0.3 0.046 95.9 91.8-119.3 20.7 18.6 11.6 34.0 133 137 A I S < S- 0 0 0 -3,-2.4 61,-0.1 63,-0.1 2,-0.1 -0.966 75.1-133.9-116.9 113.4 19.2 15.3 33.8 134 138 A E - 0 0 79 -2,-0.6 61,-0.3 61,-0.2 2,-0.3 -0.367 19.6-158.7 -67.5 144.3 22.8 16.2 34.6 135 139 A L B +H 194 0D 0 59,-2.5 59,-2.2 4,-0.1 2,-0.3 -0.870 37.4 93.3-120.3 157.1 23.5 19.1 37.0 136 140 A G S > S- 0 0 0 -2,-0.3 4,-2.2 57,-0.2 5,-0.2 -0.853 88.4 -61.2 147.2-177.0 26.6 21.2 37.4 137 141 A N H > S+ 0 0 26 55,-0.5 4,-2.9 -2,-0.3 5,-0.2 0.890 131.1 55.1 -66.7 -36.1 27.9 24.4 36.1 138 142 A G H > S+ 0 0 21 54,-0.3 4,-2.2 2,-0.2 5,-0.2 0.971 109.2 47.0 -58.1 -58.3 27.8 23.2 32.5 139 143 A P H > S+ 0 0 1 0, 0.0 4,-2.5 0, 0.0 -2,-0.2 0.889 115.4 46.6 -48.2 -43.3 24.1 22.3 32.7 140 144 A L H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.880 108.9 53.9 -71.8 -39.8 23.4 25.7 34.3 141 145 A E H X S+ 0 0 32 -4,-2.9 4,-1.6 2,-0.2 -1,-0.2 0.927 115.3 41.6 -51.2 -50.5 25.4 27.6 31.7 142 146 A E H X S+ 0 0 98 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.849 109.9 56.6 -69.9 -39.6 23.4 25.8 29.1 143 147 A A H X S+ 0 0 0 -4,-2.5 4,-2.9 1,-0.2 -1,-0.2 0.881 107.4 51.2 -60.2 -38.6 20.1 26.3 31.0 144 148 A I H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.909 111.0 45.3 -68.5 -44.3 20.7 30.0 31.0 145 149 A S H X S+ 0 0 22 -4,-1.6 4,-2.5 2,-0.2 -2,-0.2 0.934 114.2 50.7 -62.0 -42.9 21.4 30.2 27.3 146 150 A A H X S+ 0 0 12 -4,-2.7 4,-0.9 1,-0.2 -2,-0.2 0.907 111.0 47.3 -63.3 -46.4 18.3 28.0 26.7 147 151 A L H X S+ 0 0 0 -4,-2.9 4,-0.7 1,-0.2 3,-0.4 0.897 113.8 50.3 -57.2 -41.0 16.1 30.2 29.0 148 152 A Y H >< S+ 0 0 62 -4,-2.2 3,-0.9 1,-0.2 4,-0.3 0.919 109.4 47.4 -66.5 -45.3 17.4 33.2 27.2 149 153 A Y H 3<>S+ 0 0 101 -4,-2.5 5,-3.4 1,-0.3 6,-0.7 0.550 95.3 75.0 -80.9 -6.7 16.8 32.0 23.6 150 154 A Y H ><5S+ 0 0 59 -4,-0.9 3,-1.1 -3,-0.4 -1,-0.3 0.895 93.8 53.7 -67.5 -37.6 13.3 30.9 24.5 151 155 A S T <<5S+ 0 0 29 -3,-0.9 -1,-0.2 -4,-0.7 -2,-0.2 0.639 112.7 42.8 -68.7 -21.0 12.5 34.7 24.4 152 156 A T T 3 5S- 0 0 87 -3,-0.3 -1,-0.3 -4,-0.3 -2,-0.2 0.234 121.4-107.9-104.2 6.6 14.0 34.8 20.8 153 157 A G T < 5S+ 0 0 65 -3,-1.1 -3,-0.2 -4,-0.1 -2,-0.1 0.659 88.2 114.1 79.6 16.6 12.3 31.5 19.8 154 158 A G < + 0 0 54 -5,-3.4 2,-0.5 -8,-0.1 -4,-0.2 0.332 58.0 77.7-101.0 5.6 15.4 29.3 19.7 155 159 A T S S- 0 0 14 -6,-0.7 2,-0.2 -5,-0.1 -2,-0.1 -0.974 70.1-140.7-124.6 126.4 14.5 27.0 22.5 156 160 A Q >> - 0 0 134 -2,-0.5 4,-2.5 1,-0.1 3,-0.7 -0.493 28.6-111.5 -74.3 146.6 12.1 24.2 22.3 157 161 A L H 3> S+ 0 0 61 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.842 115.1 54.9 -45.0 -52.5 9.8 23.5 25.2 158 162 A P H 3> S+ 0 0 63 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.886 112.1 44.7 -54.0 -37.2 11.4 20.2 26.3 159 163 A T H <> S+ 0 0 68 -3,-0.7 4,-2.6 2,-0.2 -2,-0.2 0.892 111.2 53.9 -73.6 -37.4 14.8 22.0 26.5 160 164 A L H X S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.927 110.8 46.9 -57.4 -50.5 13.2 24.9 28.3 161 165 A A H X S+ 0 0 0 -4,-2.9 4,-2.8 2,-0.2 -2,-0.2 0.881 111.0 49.8 -59.3 -48.4 11.7 22.4 30.9 162 166 A R H X S+ 0 0 73 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.906 111.5 51.2 -54.9 -43.8 15.1 20.6 31.3 163 167 A S H X S+ 0 0 5 -4,-2.6 4,-2.7 2,-0.2 -2,-0.2 0.875 109.0 49.2 -63.7 -42.7 16.7 24.0 31.8 164 168 A F H X S+ 0 0 0 -4,-2.2 4,-3.4 2,-0.2 5,-0.3 0.942 109.0 53.9 -59.0 -46.9 14.0 24.9 34.5 165 169 A I H X S+ 0 0 0 -4,-2.8 4,-1.9 1,-0.2 -2,-0.2 0.883 111.0 45.0 -57.2 -41.6 14.7 21.6 36.2 166 170 A I H X S+ 0 0 8 -4,-2.0 4,-2.6 2,-0.2 5,-0.2 0.948 115.7 47.2 -65.1 -51.0 18.5 22.5 36.3 167 171 A C H X>S+ 0 0 0 -4,-2.7 4,-1.4 2,-0.2 5,-0.5 0.934 111.4 50.2 -55.9 -48.8 17.8 26.0 37.5 168 172 A I H <>S+ 0 0 10 -4,-3.4 5,-2.5 1,-0.2 3,-0.4 0.943 115.2 43.2 -60.4 -45.4 15.4 24.9 40.1 169 173 A Q H <>S+ 0 0 0 -4,-1.9 5,-0.7 -5,-0.3 -1,-0.2 0.901 116.3 44.9 -66.9 -38.2 17.7 22.3 41.5 170 174 A M H <5S+ 0 0 0 -4,-2.6 -1,-0.2 3,-0.2 -2,-0.2 0.594 132.4 18.7 -86.9 -7.3 20.9 24.4 41.5 171 175 A I T X5S+ 0 0 0 -4,-1.4 4,-2.8 -3,-0.4 5,-0.2 0.669 130.1 34.5-123.6 -70.0 19.2 27.4 42.9 172 176 A S H > S+ 0 0 61 -2,-0.4 4,-2.7 1,-0.2 70,-0.2 0.810 100.8 59.9 -57.6 -35.6 23.0 22.8 52.3 179 183 A Y H > S+ 0 0 40 68,-1.7 4,-2.2 2,-0.2 -1,-0.2 0.938 108.3 41.1 -60.6 -44.4 23.3 19.2 51.4 180 184 A I H > S+ 0 0 0 67,-0.4 4,-2.0 -7,-0.3 -6,-0.2 0.909 113.6 52.6 -73.3 -40.1 22.1 19.9 47.8 181 185 A E H X S+ 0 0 9 -4,-2.6 4,-3.1 -7,-0.5 -1,-0.2 0.913 108.2 52.6 -52.3 -47.9 24.2 23.1 47.6 182 186 A G H X S+ 0 0 20 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.927 107.2 52.2 -55.2 -46.2 27.1 20.9 48.8 183 187 A E H X S+ 0 0 8 -4,-2.2 4,-1.7 1,-0.2 -1,-0.2 0.843 112.1 45.8 -56.3 -39.1 26.3 18.5 45.9 184 188 A M H X S+ 0 0 0 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.905 110.8 52.6 -69.3 -41.5 26.4 21.5 43.5 185 189 A R H X S+ 0 0 53 -4,-3.1 4,-3.0 1,-0.2 -2,-0.2 0.871 108.7 49.6 -62.8 -41.1 29.6 22.8 45.0 186 190 A T H X S+ 0 0 61 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.918 109.0 52.7 -64.1 -45.5 31.3 19.5 44.6 187 191 A R H <>S+ 0 0 12 -4,-1.7 5,-3.3 -5,-0.2 -2,-0.2 0.911 113.8 43.3 -54.3 -44.8 30.2 19.3 41.0 188 192 A I H ><5S+ 0 0 16 -4,-2.3 3,-1.4 3,-0.2 -2,-0.2 0.929 109.3 57.0 -68.3 -43.4 31.7 22.8 40.4 189 193 A R H 3<5S+ 0 0 117 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.837 121.2 28.6 -54.2 -40.8 34.9 22.0 42.3 190 194 A Y T 3<5S- 0 0 151 -4,-2.0 -1,-0.3 -5,-0.1 -2,-0.2 0.173 108.5-118.5-110.6 18.2 35.6 19.0 40.0 191 195 A N T < 5 + 0 0 137 -3,-1.4 2,-0.3 1,-0.2 -3,-0.2 0.885 60.4 158.9 42.0 49.7 33.8 20.4 36.9 192 196 A R < - 0 0 170 -5,-3.3 -55,-0.5 -6,-0.2 2,-0.4 -0.722 32.3-165.1 -96.2 148.9 31.4 17.5 37.0 193 197 A R + 0 0 92 -2,-0.3 2,-0.3 -57,-0.2 -57,-0.2 -0.976 28.9 147.0-126.9 127.0 28.1 17.3 35.4 194 198 A S B -H 135 0D 40 -59,-2.2 -59,-2.5 -2,-0.4 3,-0.1 -0.984 49.5 -98.3-160.0 142.8 26.1 14.5 36.7 195 199 A A - 0 0 31 -61,-0.3 -61,-0.2 -2,-0.3 2,-0.2 -0.244 56.4 -85.9 -58.6 150.7 22.4 13.7 37.3 196 200 A P - 0 0 5 0, 0.0 -1,-0.1 0, 0.0 -63,-0.1 -0.469 44.5-130.6 -65.1 132.0 21.2 14.1 40.9 197 201 A D > - 0 0 34 -2,-0.2 4,-2.4 -3,-0.1 3,-0.4 -0.153 35.1 -89.5 -68.4 170.8 21.7 10.9 43.0 198 202 A P H > S+ 0 0 39 0, 0.0 4,-2.4 0, 0.0 31,-0.4 0.765 126.6 60.2 -59.6 -26.8 18.9 9.4 45.1 199 203 A S H > S+ 0 0 6 2,-0.2 4,-1.8 1,-0.2 5,-0.2 0.935 109.1 42.5 -65.1 -41.0 19.9 11.6 48.1 200 204 A V H > S+ 0 0 0 -3,-0.4 4,-2.6 2,-0.2 5,-0.2 0.953 116.3 48.4 -65.9 -48.1 19.3 14.7 46.1 201 205 A I H X S+ 0 0 6 -4,-2.4 4,-2.7 1,-0.2 5,-0.2 0.935 113.3 45.5 -58.8 -48.8 16.0 13.4 44.6 202 206 A T H X S+ 0 0 14 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.865 111.4 52.1 -71.1 -35.6 14.5 12.2 47.8 203 207 A L H < S+ 0 0 6 -4,-1.8 4,-0.4 -5,-0.2 -1,-0.2 0.958 113.0 46.1 -58.2 -53.4 15.4 15.4 49.7 204 208 A E H >< S+ 0 0 10 -4,-2.6 3,-1.0 1,-0.2 4,-0.3 0.912 115.0 45.8 -51.3 -50.5 13.8 17.4 46.9 205 209 A N H 3< S+ 0 0 94 -4,-2.7 4,-0.2 1,-0.2 -1,-0.2 0.763 118.7 43.9 -66.6 -29.8 10.7 15.1 46.9 206 210 A S T 3X S+ 0 0 17 -4,-1.9 4,-3.2 -5,-0.2 5,-0.3 0.247 79.3 105.8-100.9 6.7 10.5 15.2 50.7 207 211 A W H <> S+ 0 0 17 -3,-1.0 4,-2.3 -4,-0.4 45,-0.2 0.912 85.1 41.3 -57.1 -54.4 11.1 18.9 51.3 208 212 A G H > S+ 0 0 17 -4,-0.3 4,-2.4 -3,-0.2 -1,-0.2 0.916 117.6 48.3 -54.3 -47.4 7.5 19.7 52.2 209 213 A R H > S+ 0 0 171 -4,-0.2 4,-3.0 2,-0.2 -2,-0.2 0.909 112.4 48.6 -65.0 -42.1 7.1 16.6 54.3 210 214 A L H X S+ 0 0 0 -4,-3.2 4,-2.1 2,-0.2 5,-0.2 0.868 111.5 50.0 -60.7 -43.5 10.4 17.3 56.1 211 215 A S H X S+ 0 0 0 -4,-2.3 4,-2.3 -5,-0.3 -2,-0.2 0.904 115.4 43.8 -60.7 -41.8 9.3 20.9 56.7 212 216 A T H X S+ 0 0 24 -4,-2.4 4,-1.8 2,-0.2 -2,-0.2 0.903 111.6 52.3 -70.7 -43.3 6.1 19.6 58.1 213 217 A A H < S+ 0 0 20 -4,-3.0 10,-0.2 1,-0.2 -2,-0.2 0.874 113.6 43.9 -62.8 -40.1 7.6 16.9 60.1 214 218 A I H >< S+ 0 0 1 -4,-2.1 3,-1.3 2,-0.2 6,-0.3 0.924 114.8 48.4 -67.5 -47.3 10.1 19.3 61.8 215 219 A Q H 3< S+ 0 0 8 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.762 119.4 39.1 -70.8 -21.3 7.5 21.9 62.4 216 220 A E T 3< S+ 0 0 117 -4,-1.8 -1,-0.3 -5,-0.1 -2,-0.2 0.250 92.4 121.8-108.3 6.4 5.1 19.4 63.8 217 221 A S S < S- 0 0 19 -3,-1.3 2,-1.0 -5,-0.1 5,-0.2 -0.206 71.4-115.0 -69.5 160.8 7.7 17.4 65.7 218 222 A N B > S-I 221 0E 117 3,-2.6 3,-2.1 1,-0.2 -1,-0.1 -0.861 93.2 -34.2 -97.0 99.1 7.6 16.9 69.4 219 223 A Q T 3 S- 0 0 172 -2,-1.0 -1,-0.2 1,-0.3 3,-0.1 0.794 128.3 -41.8 57.2 31.6 10.7 18.8 70.5 220 224 A G T 3 S+ 0 0 1 1,-0.3 21,-2.4 -6,-0.3 2,-0.5 0.124 112.7 122.6 104.8 -21.1 12.4 17.7 67.2 221 225 A A E < -IJ 218 240E 42 -3,-2.1 -3,-2.6 19,-0.2 -1,-0.3 -0.643 60.9-129.5 -77.5 122.2 11.1 14.1 67.3 222 226 A F E - 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0 0 0 -74,-2.0 2,-0.4 -212,-0.1 -1,-0.3 -0.995 63.6-157.6-147.1 135.5 15.0 26.4 54.7 251 255 A M B -g 40 0C 0 -212,-2.0 -210,-4.0 -2,-0.4 2,-0.3 -0.947 22.7-119.6-115.0 145.2 11.6 25.1 55.4 252 256 A V - 0 0 14 -2,-0.4 2,-0.2 -45,-0.2 -178,-0.1 -0.585 45.0 -98.7 -69.7 133.6 8.3 26.0 53.8 253 257 A Y + 0 0 53 -180,-0.5 -209,-0.1 -211,-0.3 3,-0.1 -0.376 55.7 157.5 -53.6 123.0 5.9 27.3 56.4 254 258 A R - 0 0 117 1,-0.6 2,-0.3 -43,-0.2 -1,-0.2 0.644 61.6 -3.8-124.3 -36.2 3.6 24.4 57.4 255 259 A C S S- 0 0 26 3,-0.0 -1,-0.6 0, 0.0 -212,-0.0 -0.972 79.7 -88.9-152.9 164.5 2.2 25.3 60.8 256 260 A A - 0 0 59 -2,-0.3 0, 0.0 -3,-0.1 0, 0.0 -0.435 52.8-101.1 -71.0 147.5 2.6 28.1 63.4 257 261 A P - 0 0 69 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.565 46.4-115.9 -72.1 133.1 5.3 27.4 65.9 258 262 A P - 0 0 95 0, 0.0 3,-0.1 0, 0.0 -3,-0.0 -0.290 40.0 -82.0 -64.2 158.3 3.5 26.1 69.0 259 263 A P - 0 0 126 0, 0.0 -3,-0.0 0, 0.0 0, 0.0 -0.364 63.6 -97.9 -56.1 141.2 3.7 28.2 72.1 260 264 A S 0 0 111 1,-0.2 0, 0.0 -3,-0.1 0, 0.0 -0.073 360.0 360.0 -61.5 159.1 6.9 27.3 73.7 261 265 A S 0 0 172 -3,-0.1 -1,-0.2 0, 0.0 0, 0.0 0.027 360.0 360.0 -26.0 360.0 7.3 24.7 76.6