==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 04-JUN-07 2Z3I . COMPND 2 MOLECULE: BLASTICIDIN-S DEAMINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ASPERGILLUS TERREUS; . AUTHOR T.KUMASAKA,M.YAMAMOTO,M.FURUICHI,M.NAKASAKO,M.KIMURA,I.YAMAG . 516 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20363.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 331 64.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 2.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 100 19.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 8 1.6 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-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 2.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 57 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 133 25.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.6 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 4 0 0 0 0 0 4 4 0 1 0 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 4 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 0 0 PARALLEL BRIDGES PER LADDER . 0 0 4 0 8 0 4 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 . 0 0 0 0 4 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 2 A P 0 0 165 0, 0.0 2,-0.9 0, 0.0 110,-0.0 0.000 360.0 360.0 360.0-157.9 51.2 32.0 114.9 2 3 A L - 0 0 80 111,-0.1 111,-0.1 4,-0.0 109,-0.0 -0.685 360.0-165.2 -94.9 98.9 49.2 35.3 115.1 3 4 A S > - 0 0 47 -2,-0.9 4,-1.7 1,-0.1 5,-0.1 -0.140 29.8-111.0 -73.2 170.7 50.9 38.3 113.4 4 5 A Q H > S+ 0 0 125 2,-0.2 4,-2.6 1,-0.2 5,-0.1 0.925 115.1 47.9 -71.9 -47.6 50.0 42.0 113.9 5 6 A E H > S+ 0 0 119 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.908 113.8 49.6 -59.6 -44.1 48.6 42.7 110.4 6 7 A E H > S+ 0 0 29 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.862 111.6 48.2 -55.2 -48.3 46.5 39.5 110.6 7 8 A S H X S+ 0 0 40 -4,-1.7 4,-2.7 2,-0.2 -2,-0.2 0.895 108.7 54.3 -65.4 -41.8 45.2 40.4 114.1 8 9 A T H X S+ 0 0 42 -4,-2.6 4,-2.8 2,-0.2 -2,-0.2 0.893 106.7 51.0 -61.4 -42.8 44.3 43.9 112.8 9 10 A L H X S+ 0 0 1 -4,-2.0 4,-2.7 2,-0.2 5,-0.3 0.944 111.2 47.9 -58.4 -49.4 42.2 42.6 110.0 10 11 A I H X S+ 0 0 32 -4,-1.9 4,-2.5 1,-0.2 5,-0.2 0.931 113.4 48.6 -57.1 -47.5 40.3 40.3 112.4 11 12 A E H X S+ 0 0 109 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.896 111.9 49.2 -57.5 -46.0 39.8 43.3 114.7 12 13 A R H X S+ 0 0 108 -4,-2.8 4,-1.9 2,-0.2 -2,-0.2 0.923 113.9 43.3 -64.7 -44.9 38.6 45.6 111.9 13 14 A A H X S+ 0 0 0 -4,-2.7 4,-2.4 2,-0.2 5,-0.2 0.900 113.4 52.4 -69.7 -38.7 36.1 43.1 110.4 14 15 A T H X S+ 0 0 43 -4,-2.5 4,-2.6 -5,-0.3 -2,-0.2 0.945 109.9 48.7 -60.5 -47.0 34.8 42.2 113.9 15 16 A A H X S+ 0 0 59 -4,-2.3 4,-1.4 -5,-0.2 -1,-0.2 0.891 110.1 53.0 -62.0 -38.2 34.2 45.9 114.8 16 17 A T H X S+ 0 0 18 -4,-1.9 4,-0.5 2,-0.2 3,-0.5 0.958 112.6 41.5 -61.7 -52.1 32.4 46.4 111.5 17 18 A I H >< S+ 0 0 7 -4,-2.4 3,-1.0 1,-0.2 -2,-0.2 0.924 114.5 52.7 -67.1 -39.4 29.9 43.6 112.0 18 19 A N H 3< S+ 0 0 91 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.761 103.0 60.0 -62.9 -24.8 29.4 44.5 115.7 19 20 A S H 3< S+ 0 0 83 -4,-1.4 -1,-0.2 -3,-0.5 -2,-0.2 0.621 94.2 75.0 -80.7 -15.4 28.6 48.1 114.9 20 21 A I S << S- 0 0 14 -3,-1.0 3,-0.1 -4,-0.5 434,-0.1 -0.654 93.4 -87.5-105.6 155.0 25.6 47.5 112.7 21 22 A P - 0 0 91 0, 0.0 5,-0.1 0, 0.0 -1,-0.1 -0.308 55.6 -95.8 -56.1 139.2 22.0 46.5 113.6 22 23 A I + 0 0 136 -4,-0.1 2,-0.3 2,-0.0 5,-0.1 -0.362 60.8 166.5 -58.2 130.5 21.5 42.7 113.8 23 24 A S - 0 0 27 3,-0.4 55,-0.1 -3,-0.1 -3,-0.0 -0.995 47.8-146.5-152.6 143.1 20.2 41.6 110.4 24 25 A E S S+ 0 0 180 -2,-0.3 3,-0.2 1,-0.1 -1,-0.1 0.597 107.9 50.4 -85.0 -14.7 19.7 38.4 108.3 25 26 A D S S+ 0 0 59 1,-0.3 21,-2.4 20,-0.1 2,-0.5 0.808 120.4 32.2 -84.5 -37.3 20.5 40.4 105.2 26 27 A Y S S+ 0 0 36 19,-0.2 -3,-0.4 -5,-0.1 -1,-0.3 -0.854 76.4 134.8-125.9 89.0 23.7 41.9 106.5 27 28 A S + 0 0 23 -2,-0.5 51,-2.7 -3,-0.2 2,-0.3 0.353 55.3 51.6-125.8 -0.8 25.2 39.3 108.8 28 29 A V E -A 77 0A 15 49,-0.2 16,-2.1 16,-0.1 2,-0.3 -0.998 57.8-159.7-143.3 136.2 29.0 39.1 108.0 29 30 A A E -AB 76 43A 0 47,-2.5 47,-3.2 -2,-0.3 2,-0.3 -0.830 7.5-163.1-110.0 157.9 31.7 41.6 107.7 30 31 A S E -AB 75 42A 0 12,-2.4 12,-1.5 -2,-0.3 2,-0.3 -0.955 5.1-166.3-133.6 153.7 35.1 41.3 105.9 31 32 A A E -AB 74 41A 0 43,-1.8 43,-2.0 -2,-0.3 2,-0.4 -0.993 7.7-170.6-137.2 140.4 38.4 43.2 105.9 32 33 A A E -AB 73 40A 0 8,-2.3 8,-2.2 -2,-0.3 2,-0.4 -0.962 15.4-137.7-130.6 149.8 41.2 43.0 103.5 33 34 A L E -AB 72 39A 30 39,-2.4 38,-2.9 -2,-0.4 39,-1.1 -0.899 18.6-145.6-105.1 132.7 44.7 44.3 103.4 34 35 A S E > -A 70 0A 2 4,-2.8 3,-2.1 -2,-0.4 36,-0.2 -0.548 28.7-105.9 -92.7 162.9 46.2 45.9 100.3 35 36 A S T 3 S+ 0 0 81 34,-2.6 35,-0.1 32,-0.3 33,-0.1 0.844 121.5 51.7 -49.4 -41.0 49.8 45.7 99.1 36 37 A D T 3 S- 0 0 94 31,-0.4 -1,-0.3 33,-0.2 34,-0.1 0.354 124.3-100.7 -85.8 2.9 50.3 49.4 100.1 37 38 A G S < S+ 0 0 50 -3,-2.1 2,-0.1 1,-0.3 -2,-0.1 0.411 75.0 135.8 99.6 -0.6 49.0 48.8 103.6 38 39 A R - 0 0 96 29,-0.1 -4,-2.8 -5,-0.0 2,-0.4 -0.485 42.9-142.8 -80.3 151.4 45.4 50.1 103.3 39 40 A I E -B 33 0A 42 -6,-0.2 2,-0.4 -2,-0.1 -6,-0.2 -0.952 12.8-166.7-116.6 137.3 42.5 48.2 104.9 40 41 A F E -B 32 0A 22 -8,-2.2 -8,-2.3 -2,-0.4 2,-0.2 -0.958 5.0-167.0-125.7 140.2 39.1 48.0 103.3 41 42 A T E +B 31 0A 35 -2,-0.4 2,-0.3 -10,-0.2 -10,-0.2 -0.743 13.1 156.7-122.9 166.4 35.9 46.7 105.0 42 43 A G E -B 30 0A 0 -12,-1.5 -12,-2.4 -2,-0.2 2,-0.3 -0.949 27.7-129.9-171.0 167.8 32.4 45.7 103.8 43 44 A V E -B 29 0A 0 407,-0.7 -14,-0.2 -2,-0.3 411,-0.2 -0.901 34.1 -99.3-125.1 164.0 29.4 43.6 104.8 44 45 A N - 0 0 15 -16,-2.1 2,-0.4 -2,-0.3 9,-0.2 -0.225 19.4-144.4 -75.6 169.0 27.5 41.0 102.8 45 46 A V - 0 0 0 7,-2.6 2,-0.2 -19,-0.1 -19,-0.2 -0.899 20.5-142.3-134.1 102.2 24.2 41.5 101.0 46 47 A Y + 0 0 41 -21,-2.4 2,-0.3 -2,-0.4 263,-0.1 -0.446 35.6 146.9 -71.5 131.1 22.1 38.4 101.1 47 48 A H >> - 0 0 4 261,-0.4 3,-2.1 4,-0.3 4,-1.7 -0.897 51.2-130.6-163.4 140.2 20.1 37.5 98.1 48 49 A F T 34 S+ 0 0 16 1,-0.3 259,-0.4 -2,-0.3 262,-0.2 0.720 108.6 61.8 -62.5 -22.5 18.9 34.3 96.4 49 50 A T T 34 S- 0 0 0 261,-0.1 -1,-0.3 430,-0.1 259,-0.1 0.404 136.8 -77.9 -83.4 3.2 20.2 35.5 93.0 50 51 A G T <4 - 0 0 1 -3,-2.1 -2,-0.2 258,-0.2 259,-0.1 0.834 54.5-163.8 105.0 40.4 23.7 35.6 94.5 51 52 A G < - 0 0 4 -4,-1.7 -4,-0.3 257,-0.2 -1,-0.1 -0.298 41.1 -89.8 -46.9 138.7 23.9 38.7 96.7 52 53 A P - 0 0 1 0, 0.0 -7,-2.6 0, 0.0 -1,-0.1 -0.253 34.4-125.1 -62.5 136.9 27.7 39.3 97.3 53 54 A C >> - 0 0 18 -9,-0.2 4,-1.6 -3,-0.1 3,-0.6 -0.320 38.8 -97.4 -62.4 164.5 29.4 37.8 100.3 54 55 A A H 3> S+ 0 0 1 1,-0.2 4,-2.3 2,-0.2 -24,-0.3 0.874 125.0 58.7 -55.6 -38.9 31.2 40.4 102.5 55 56 A Q H 3> S+ 0 0 9 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.856 104.4 50.3 -62.4 -36.4 34.5 39.5 100.8 56 57 A L H <> S+ 0 0 0 -3,-0.6 4,-1.8 2,-0.2 -1,-0.2 0.879 108.8 51.1 -69.5 -36.2 33.1 40.5 97.3 57 58 A V H X S+ 0 0 0 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.923 109.5 52.0 -63.9 -42.6 31.8 43.8 98.7 58 59 A V H X S+ 0 0 0 -4,-2.3 4,-3.0 1,-0.2 5,-0.2 0.915 106.0 54.7 -61.1 -41.5 35.4 44.4 100.1 59 60 A L H X S+ 0 0 0 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.893 111.1 43.5 -60.1 -40.0 36.8 43.6 96.6 60 61 A G H X S+ 0 0 0 -4,-1.8 4,-2.0 2,-0.2 373,-0.6 0.838 113.4 52.3 -73.6 -33.8 34.6 46.3 95.0 61 62 A T H X S+ 0 0 27 -4,-2.3 4,-0.8 2,-0.2 -2,-0.2 0.908 112.2 45.8 -63.7 -43.8 35.4 48.7 97.9 62 63 A A H ><>S+ 0 0 2 -4,-3.0 5,-2.3 1,-0.2 3,-1.0 0.937 112.9 49.4 -66.8 -45.0 39.1 48.1 97.4 63 64 A A H ><5S+ 0 0 11 -4,-2.3 3,-1.7 1,-0.3 -1,-0.2 0.853 104.5 59.0 -63.6 -35.0 38.8 48.5 93.6 64 65 A A H 3<5S+ 0 0 18 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.742 108.3 46.6 -63.6 -25.2 36.9 51.8 94.1 65 66 A A T <<5S- 0 0 35 -3,-1.0 -1,-0.3 -4,-0.8 -2,-0.2 0.133 115.3-117.5 -98.8 14.7 39.9 53.1 96.0 66 67 A A T < 5 + 0 0 42 -3,-1.7 -3,-0.2 1,-0.1 -2,-0.1 0.891 56.3 162.5 46.5 46.4 42.3 51.8 93.3 67 68 A A < - 0 0 5 -5,-2.3 -31,-0.4 1,-0.2 -32,-0.3 0.695 23.6-162.4 -68.5 -22.5 43.8 49.6 95.9 68 69 A G + 0 0 48 -6,-0.2 -1,-0.2 -34,-0.1 2,-0.1 -0.476 55.0 17.8 70.4-139.1 45.6 47.2 93.5 69 70 A N - 0 0 112 -2,-0.2 -34,-2.6 -35,-0.1 2,-0.4 -0.393 68.6-146.9 -70.2 134.7 46.6 43.8 94.8 70 71 A L E -A 34 0A 4 -36,-0.2 -36,-0.3 -2,-0.1 30,-0.1 -0.862 10.8-171.2-101.7 137.6 45.1 42.5 98.0 71 72 A T E + 0 0 54 -38,-2.9 31,-1.3 -2,-0.4 2,-0.3 0.697 64.2 10.1-102.7 -24.7 47.3 40.4 100.2 72 73 A C E -Ac 33 102A 14 -39,-1.1 -39,-2.4 29,-0.2 2,-0.3 -0.990 57.2-175.5-156.3 148.6 45.0 39.0 102.9 73 74 A I E -Ac 32 103A 1 29,-1.5 31,-2.6 -2,-0.3 2,-0.3 -0.996 0.4-176.8-148.5 148.5 41.3 38.8 103.7 74 75 A V E -A 31 0A 2 -43,-2.0 -43,-1.8 -2,-0.3 2,-0.4 -0.974 12.9-149.0-142.5 153.2 39.1 37.6 106.6 75 76 A A E -AD 30 84A 3 9,-0.5 9,-2.2 29,-0.4 2,-0.4 -0.981 10.0-164.2-123.8 140.6 35.3 37.4 107.2 76 77 A I E -AD 29 83A 4 -47,-3.2 -47,-2.5 -2,-0.4 7,-0.2 -0.992 13.1-138.5-126.5 128.4 33.7 37.6 110.6 77 78 A G E > -AD 28 82A 1 5,-2.6 5,-0.8 -2,-0.4 4,-0.5 -0.496 23.2-108.6 -83.6 153.5 30.2 36.5 111.4 78 79 A N T > 5S+ 0 0 15 -51,-2.7 3,-1.3 1,-0.2 -1,-0.1 -0.059 93.8 43.8 -65.6 174.3 27.7 38.4 113.5 79 80 A E T 3 5S- 0 0 133 1,-0.3 -1,-0.2 -62,-0.1 -2,-0.1 0.861 133.0 -62.4 52.3 42.2 26.6 37.3 117.0 80 81 A N T 3 5S+ 0 0 147 -3,-0.2 -1,-0.3 1,-0.1 -2,-0.2 0.744 94.1 139.4 64.0 25.8 30.1 36.4 118.1 81 82 A R T < 5 - 0 0 99 -3,-1.3 -3,-0.1 -4,-0.5 -1,-0.1 0.750 43.7-160.0 -73.8 -24.0 30.5 33.7 115.5 82 83 A G E < +D 77 0A 24 -5,-0.8 -5,-2.6 2,-0.0 -1,-0.2 -0.371 47.4 8.8 80.1-158.0 34.1 34.7 114.8 83 84 A I E -D 76 0A 18 -7,-0.2 2,-0.4 -2,-0.1 -7,-0.2 -0.319 61.7-165.9 -64.2 132.8 36.1 33.8 111.7 84 85 A L E -D 75 0A 28 -9,-2.2 -9,-0.5 20,-0.1 171,-0.1 -0.983 23.6-120.1-115.6 133.3 34.1 32.3 108.8 85 86 A S - 0 0 20 -2,-0.4 20,-0.1 169,-0.2 -11,-0.1 -0.412 40.4 -93.8 -65.9 148.3 36.0 30.6 105.9 86 87 A P - 0 0 3 0, 0.0 169,-0.4 0, 0.0 -1,-0.1 -0.336 45.0-115.1 -59.8 143.6 35.4 32.1 102.5 87 88 A C > - 0 0 4 167,-0.1 4,-2.3 1,-0.1 5,-0.2 -0.262 31.8 -97.8 -74.4 168.8 32.6 30.3 100.6 88 89 A G H > S+ 0 0 0 1,-0.2 4,-1.9 2,-0.2 131,-0.4 0.879 125.1 51.4 -56.4 -41.4 33.4 28.4 97.4 89 90 A R H > S+ 0 0 0 129,-0.4 4,-2.6 130,-0.3 130,-0.3 0.945 108.9 50.5 -63.4 -45.0 32.3 31.3 95.2 90 91 A C H > S+ 0 0 0 1,-0.2 4,-2.8 2,-0.2 -2,-0.2 0.902 109.0 53.5 -54.4 -41.8 34.5 33.8 97.2 91 92 A R H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.880 109.3 47.0 -64.3 -40.3 37.4 31.4 96.7 92 93 A Q H X S+ 0 0 0 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.928 113.3 47.9 -66.9 -46.7 36.9 31.3 92.9 93 94 A V H X S+ 0 0 0 -4,-2.6 4,-2.5 1,-0.2 5,-0.4 0.942 114.1 47.9 -60.3 -44.6 36.5 35.1 92.6 94 95 A L H X S+ 0 0 0 -4,-2.8 4,-2.9 1,-0.2 7,-0.3 0.900 110.3 50.7 -62.1 -43.6 39.7 35.6 94.8 95 96 A L H < S+ 0 0 12 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.874 116.4 42.4 -60.6 -40.5 41.7 33.0 92.8 96 97 A D H < S+ 0 0 34 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.802 127.6 27.5 -78.7 -32.6 40.7 34.8 89.5 97 98 A L H < S+ 0 0 24 -4,-2.5 -3,-0.2 -5,-0.2 -2,-0.2 0.741 135.9 21.8-102.9 -28.7 41.1 38.4 90.7 98 99 A H >< + 0 0 12 -4,-2.9 3,-2.6 -5,-0.4 19,-0.2 -0.500 63.5 167.2-138.0 64.2 43.8 38.2 93.4 99 100 A P T 3 S+ 0 0 56 0, 0.0 19,-0.4 0, 0.0 18,-0.2 0.746 77.9 57.5 -56.8 -21.0 45.7 35.0 92.9 100 101 A G T 3 S+ 0 0 68 -30,-0.1 -5,-0.1 -6,-0.1 -6,-0.0 0.499 86.1 112.7 -86.1 -3.7 48.4 36.2 95.4 101 102 A I < - 0 0 1 -3,-2.6 16,-2.2 -7,-0.3 2,-0.3 -0.246 51.7-151.7 -74.7 154.0 46.0 36.7 98.3 102 103 A K E -cE 72 116A 93 -31,-1.3 -29,-1.5 14,-0.2 2,-0.4 -0.897 8.3-149.0-113.4 152.2 45.7 34.7 101.5 103 104 A A E -cE 73 115A 2 12,-2.7 12,-2.7 -2,-0.3 2,-0.5 -0.972 16.7-124.1-120.4 142.6 42.5 34.2 103.5 104 105 A I E + E 0 114A 2 -31,-2.6 -29,-0.4 -2,-0.4 2,-0.3 -0.717 42.0 159.3 -84.1 126.0 42.4 33.8 107.3 105 106 A V E - E 0 113A 0 8,-2.6 8,-2.9 -2,-0.5 2,-0.5 -0.826 46.0 -93.8-134.8 172.2 40.6 30.6 108.3 106 107 A K E - E 0 112A 99 -2,-0.3 5,-0.1 6,-0.2 -21,-0.0 -0.822 42.1-140.1 -91.1 129.2 40.6 28.5 111.5 107 108 A D > - 0 0 61 4,-3.1 3,-2.2 -2,-0.5 -1,-0.1 -0.067 38.9 -78.5 -75.7-174.0 43.1 25.7 111.4 108 109 A S T 3 S+ 0 0 114 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.604 133.6 49.1 -65.1 -12.2 42.6 22.1 112.7 109 110 A D T 3 S- 0 0 129 2,-0.2 -1,-0.3 0, 0.0 -2,-0.0 0.299 122.7-102.9-110.2 8.5 43.2 23.4 116.3 110 111 A G S < S+ 0 0 37 -3,-2.2 -2,-0.1 1,-0.3 -4,-0.0 0.513 78.5 136.2 86.0 8.0 40.8 26.3 116.0 111 112 A Q - 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0 0 99 -3,-1.3 -3,-0.1 -4,-0.6 -1,-0.1 0.680 42.2-158.2 -80.1 -16.7 29.8 55.9 78.9 472 83 D G E < +S 467 0D 29 -5,-0.7 -5,-2.5 -72,-0.0 -1,-0.2 -0.383 49.3 13.1 73.7-152.3 27.6 57.9 81.4 473 84 D I E -S 466 0D 17 -7,-0.2 2,-0.4 -2,-0.1 -7,-0.2 -0.309 61.3-164.9 -65.4 131.6 24.5 56.4 83.0 474 85 D L E -S 465 0D 27 -9,-2.4 -9,-0.5 20,-0.1 -89,-0.1 -0.988 23.2-121.2-115.1 131.6 23.9 52.6 82.8 475 86 D S - 0 0 19 -2,-0.4 20,-0.1 -91,-0.1 -11,-0.1 -0.438 39.5 -98.1 -63.6 141.8 20.5 51.2 83.7 476 87 D P - 0 0 3 0, 0.0 -91,-0.5 0, 0.0 -1,-0.1 -0.348 43.2-116.0 -61.1 141.1 20.6 48.6 86.6 477 88 D C > - 0 0 4 -93,-0.1 4,-2.3 1,-0.1 5,-0.1 -0.189 31.3 -97.3 -69.8 171.9 20.7 45.1 85.2 478 89 D G H > S+ 0 0 0 1,-0.2 4,-1.7 2,-0.2 -129,-0.4 0.864 124.9 52.6 -60.5 -39.0 17.8 42.7 85.9 479 90 D R H > S+ 0 0 0 -131,-0.4 4,-2.4 -130,-0.3 -130,-0.3 0.931 109.2 50.0 -61.3 -47.2 19.7 41.1 88.9 480 91 D C H > S+ 0 0 0 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.909 107.7 54.2 -56.7 -44.2 20.3 44.5 90.4 481 92 D R H X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.884 109.1 48.2 -58.7 -40.2 16.6 45.4 90.0 482 93 D Q H X S+ 0 0 0 -4,-1.7 4,-2.3 2,-0.2 -1,-0.2 0.918 112.8 46.3 -69.3 -45.3 15.6 42.3 91.9 483 94 D V H X S+ 0 0 0 -4,-2.4 4,-3.0 2,-0.2 5,-0.4 0.952 114.7 48.9 -62.1 -48.1 18.1 42.8 94.8 484 95 D L H X S+ 0 0 0 -4,-3.0 4,-2.7 2,-0.2 7,-0.3 0.902 110.8 49.8 -55.2 -45.2 17.0 46.5 95.0 485 96 D L H < S+ 0 0 9 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.934 117.6 40.6 -60.1 -44.9 13.3 45.6 95.0 486 97 D D H < S+ 0 0 40 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.845 126.8 30.8 -75.4 -36.3 13.8 43.1 97.8 487 98 D L H < S+ 0 0 23 -4,-3.0 -3,-0.2 1,-0.2 -2,-0.2 0.780 136.4 19.3 -96.8 -29.9 16.3 45.0 99.9 488 99 D H >< + 0 0 9 -4,-2.7 3,-2.3 -5,-0.4 -1,-0.2 -0.535 65.3 169.0-138.1 67.1 15.2 48.7 99.3 489 100 D P T 3 S+ 0 0 54 0, 0.0 19,-0.3 0, 0.0 18,-0.2 0.722 78.4 57.5 -58.8 -23.1 11.6 48.6 97.9 490 101 D G T 3 S+ 0 0 67 -30,-0.1 2,-0.1 -6,-0.1 -5,-0.1 0.346 86.5 116.7 -86.1 8.0 11.3 52.4 98.4 491 102 D I < - 0 0 2 -3,-2.3 16,-2.4 -7,-0.3 2,-0.4 -0.393 50.9-151.5 -80.6 151.7 14.4 53.1 96.1 492 103 D K E -rT 462 506D 106 -31,-1.4 -29,-1.4 14,-0.2 2,-0.4 -0.930 8.4-148.2-113.2 145.4 14.5 54.9 92.8 493 104 D A E -rT 463 505D 1 12,-2.9 12,-2.8 -2,-0.4 2,-0.6 -0.941 15.6-127.2-114.5 137.0 17.1 54.3 90.1 494 105 D I E + T 0 504D 3 -31,-2.4 -29,-0.4 -2,-0.4 2,-0.2 -0.745 41.8 161.1 -82.9 120.2 18.4 57.0 87.8 495 106 D V E - T 0 503D 6 8,-2.8 8,-2.8 -2,-0.6 2,-0.5 -0.743 42.4 -93.5-128.5 174.2 18.1 55.8 84.2 496 107 D K E - T 0 502D 105 -2,-0.2 2,-0.0 6,-0.2 -21,-0.0 -0.847 35.8-145.6 -95.9 130.6 18.1 57.6 80.8 497 108 D D > - 0 0 66 4,-2.4 3,-3.1 -2,-0.5 4,-0.0 -0.188 44.4 -75.9 -77.6 179.6 14.7 58.7 79.3 498 109 D S T 3 S+ 0 0 122 1,-0.3 -1,-0.0 2,-0.1 -2,-0.0 0.798 136.1 50.5 -45.1 -38.2 13.8 58.8 75.6 499 110 D D T 3 S- 0 0 125 2,-0.1 -1,-0.3 1,-0.0 -2,-0.0 0.306 119.8-110.6 -83.6 5.2 15.9 62.0 75.2 500 111 D G S < S+ 0 0 35 -3,-3.1 -2,-0.1 1,-0.3 -4,-0.1 0.804 73.6 141.7 65.4 29.2 18.9 60.3 77.0 501 112 D Q - 0 0 112 -4,-0.0 -4,-2.4 1,-0.0 -1,-0.3 -0.846 60.7 -96.5-104.1 141.2 18.4 62.7 80.0 502 113 D P E +T 496 0D 36 0, 0.0 2,-0.3 0, 0.0 -110,-0.2 -0.297 49.1 171.7 -56.9 126.7 18.8 61.5 83.6 503 114 D T E -T 495 0D 48 -8,-2.8 -8,-2.8 -112,-0.1 2,-0.6 -0.999 29.5-131.5-141.4 138.1 15.5 60.6 85.2 504 115 D A E -T 494 0D 35 -2,-0.3 2,-0.4 -10,-0.2 -10,-0.2 -0.795 28.8-173.1 -95.0 122.7 14.7 58.9 88.6 505 116 D V E -T 493 0D 36 -12,-2.8 -12,-2.9 -2,-0.6 5,-0.1 -0.946 29.6-107.9-121.9 132.5 12.3 56.0 88.4 506 117 D G E >> -T 492 0D 28 -2,-0.4 3,-1.3 -14,-0.3 4,-0.6 -0.259 32.2-123.1 -48.9 135.8 10.7 53.9 91.2 507 118 D I H >> S+ 0 0 1 -16,-2.4 3,-1.1 1,-0.3 4,-0.6 0.826 109.1 61.0 -57.5 -35.4 12.3 50.4 91.3 508 119 D R H 34 S+ 0 0 139 -19,-0.3 3,-0.3 1,-0.3 -1,-0.3 0.760 97.9 58.0 -62.4 -27.3 8.9 48.7 90.7 509 120 D E H <4 S+ 0 0 129 -3,-1.3 -1,-0.3 1,-0.2 -2,-0.2 0.662 103.8 53.1 -76.4 -18.5 8.5 50.5 87.4 510 121 D L H << S+ 0 0 5 -3,-1.1 -1,-0.2 -4,-0.6 -2,-0.2 0.565 115.9 40.3 -89.8 -13.5 11.8 48.8 86.3 511 122 D L S >< S- 0 0 3 -4,-0.6 3,-1.0 -3,-0.3 -1,-0.2 -0.563 81.8-168.9-131.4 70.9 10.4 45.4 87.3 512 123 D P T 3 S+ 0 0 41 0, 0.0 3,-0.1 0, 0.0 -3,-0.1 -0.315 79.4 12.2 -61.0 140.8 6.8 45.4 86.1 513 124 D S T 3 S- 0 0 59 1,-0.1 -147,-0.1 -5,-0.1 -168,-0.1 0.894 100.0-162.4 50.3 47.1 4.9 42.3 87.5 514 125 D G < - 0 0 25 -3,-1.0 2,-0.4 -6,-0.2 -1,-0.1 -0.248 21.5-119.8 -62.8 138.2 7.9 41.8 89.9 515 126 D Y - 0 0 47 -169,-0.4 2,-0.6 -3,-0.1 -167,-0.2 -0.665 30.3-150.4 -69.6 126.6 8.6 38.5 91.6 516 127 D V - 0 0 83 -2,-0.4 2,-0.2 -169,-0.1 -34,-0.0 -0.925 10.8-131.7-108.5 114.3 8.5 39.5 95.3 517 128 D W - 0 0 75 -2,-0.6 2,-0.1 -35,-0.2 -2,-0.0 -0.453 28.8-178.7 -68.8 125.8 10.7 37.3 97.5 518 129 D E 0 0 131 -2,-0.2 -1,-0.1 1,-0.1 0, 0.0 -0.112 360.0 360.0 -97.7-160.0 9.0 35.9 100.6 519 130 D G 0 0 127 -2,-0.1 -1,-0.1 0, 0.0 -2,-0.0 0.314 360.0 360.0 54.1 360.0 10.4 33.7 103.4