==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL PROTEIN 09-JAN-03 1NMD . COMPND 2 MOLECULE: ACTIN; . SOURCE 2 ORGANISM_SCIENTIFIC: DICTYOSTELIUM DISCOIDEUM; . AUTHOR S.M.VOROBIEV,S.WELTI,J.CONDEELIS,S.C.ALMO . 485 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20366.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 356 73.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 30 6.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 66 13.6 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 . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 1.0 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 . 2 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 . 37 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 61 12.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 129 26.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 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 3 1 1 2 2 1 1 1 1 3 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 2 1 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 PARALLEL BRIDGES PER LADDER . 0 4 1 4 1 2 0 0 1 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 . 3 1 0 1 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 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 4 A D 0 0 155 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 144.3 43.8 -4.3 2.4 2 5 A V - 0 0 103 1,-0.1 2,-0.5 87,-0.0 87,-0.1 0.117 360.0-140.7 -41.8 142.8 40.2 -5.4 2.4 3 6 A Q - 0 0 76 85,-0.4 2,-0.2 17,-0.0 -1,-0.1 -0.946 15.6-149.3-111.5 121.3 37.3 -3.0 3.2 4 7 A A - 0 0 10 -2,-0.5 15,-2.3 85,-0.2 2,-0.3 -0.583 6.2-141.8 -89.7 153.9 34.4 -4.4 5.3 5 8 A L E -Ab 18 91A 0 85,-2.4 87,-2.8 13,-0.2 2,-0.4 -0.807 6.2-151.0-112.5 156.1 30.9 -3.2 5.0 6 9 A V E -Ab 17 92A 0 11,-2.4 11,-1.7 -2,-0.3 2,-0.5 -0.983 12.3-178.0-132.7 121.0 28.4 -2.8 7.8 7 10 A I E -Ab 16 93A 0 85,-2.9 87,-1.5 -2,-0.4 2,-0.7 -0.971 9.7-166.8-123.8 121.7 24.7 -3.1 7.4 8 11 A D E -A 15 0A 10 7,-3.3 7,-2.1 -2,-0.5 2,-1.6 -0.903 15.2-150.9-109.4 104.5 22.1 -2.6 10.3 9 12 A N E -A 14 0A 10 -2,-0.7 5,-0.2 85,-0.3 2,-0.1 -0.548 18.9-174.7 -77.6 81.3 18.8 -3.9 9.1 10 13 A G - 0 0 13 -2,-1.6 49,-0.1 3,-0.9 20,-0.0 -0.423 33.2-123.6 -76.5 155.2 16.2 -1.8 11.0 11 14 A S S S+ 0 0 12 1,-0.1 48,-0.4 -2,-0.1 -1,-0.1 0.830 111.4 16.3 -65.0 -35.7 12.5 -2.7 10.7 12 15 A G S S+ 0 0 13 1,-0.3 18,-2.6 17,-0.1 2,-0.4 0.772 134.7 30.2-104.7 -41.9 11.8 0.9 9.5 13 16 A M E - C 0 29A 73 16,-0.3 -3,-0.9 17,-0.1 2,-0.4 -0.973 63.3-150.3-128.1 133.2 15.2 2.2 8.4 14 17 A C E -AC 9 28A 0 14,-3.1 14,-2.0 -2,-0.4 2,-0.5 -0.778 10.9-159.9 -96.4 141.6 18.3 0.4 7.1 15 18 A K E +AC 8 27A 31 -7,-2.1 -7,-3.3 -2,-0.4 2,-0.3 -0.992 16.3 174.6-122.7 123.3 21.7 1.9 7.8 16 19 A A E +AC 7 26A 0 10,-2.9 10,-2.4 -2,-0.5 9,-0.6 -0.946 11.8 120.6-130.6 151.4 24.6 0.9 5.6 17 20 A G E -A 6 0A 0 -11,-1.7 -11,-2.4 -2,-0.3 2,-0.4 -0.958 53.2 -63.3-177.2-166.4 28.2 1.9 5.3 18 21 A F E > -A 5 0A 30 5,-0.3 3,-2.1 -2,-0.3 -13,-0.2 -0.905 48.0-110.2-110.6 134.9 31.9 1.1 5.4 19 22 A A T 3 S+ 0 0 9 -15,-2.3 -15,-0.2 -2,-0.4 314,-0.1 -0.383 107.1 39.2 -58.3 131.5 33.8 -0.2 8.5 20 23 A G T 3 S+ 0 0 11 1,-0.6 -1,-0.3 309,-0.2 2,-0.2 0.114 89.8 109.9 111.5 -22.2 36.1 2.6 9.7 21 24 A D < - 0 0 47 -3,-2.1 -1,-0.6 466,-0.2 311,-0.1 -0.611 67.8-138.2 -83.9 150.5 33.6 5.4 9.0 22 25 A D S S+ 0 0 97 -2,-0.2 -1,-0.1 -3,-0.1 307,-0.1 0.443 85.6 26.6 -88.4 -0.0 32.1 7.1 12.0 23 26 A A S S- 0 0 40 -5,-0.2 -5,-0.3 305,-0.1 2,-0.2 -0.987 92.8 -92.2-154.9 155.3 28.6 7.2 10.5 24 27 A P - 0 0 16 0, 0.0 -7,-0.3 0, 0.0 3,-0.1 -0.515 25.1-146.0 -73.1 139.5 26.6 5.2 8.0 25 28 A R S S+ 0 0 187 -9,-0.6 2,-0.4 -2,-0.2 -8,-0.2 0.813 84.3 38.3 -73.1 -28.6 26.9 6.5 4.4 26 29 A A E +C 16 0A 8 -10,-2.4 -10,-2.9 2,-0.0 2,-0.5 -0.975 56.4 173.7-132.5 125.9 23.3 5.5 3.6 27 30 A V E +C 15 0A 45 -2,-0.4 -12,-0.2 -12,-0.2 -14,-0.0 -0.975 23.9 149.8-127.6 116.1 20.2 5.6 5.7 28 31 A F E -C 14 0A 0 -14,-2.0 -14,-3.1 -2,-0.5 15,-0.1 -0.986 49.9 -79.0-147.6 157.8 16.9 4.7 3.9 29 32 A P E -C 13 0A 19 0, 0.0 2,-2.0 0, 0.0 14,-0.5 -0.215 37.8-126.0 -57.4 137.2 13.5 3.1 4.5 30 33 A S + 0 0 0 -18,-2.6 2,-0.4 12,-0.1 29,-0.4 -0.512 67.1 129.9 -85.0 69.9 13.5 -0.7 4.6 31 34 A I - 0 0 0 -2,-2.0 12,-1.8 26,-0.2 2,-0.5 -0.965 46.5-158.6-130.9 143.0 10.8 -0.9 1.9 32 35 A V E -FG 42 56B 1 24,-2.5 24,-2.1 -2,-0.4 2,-0.4 -0.985 17.2-159.6-119.7 125.0 10.4 -2.8 -1.3 33 36 A G E +FG 41 55B 0 8,-3.5 8,-2.7 -2,-0.5 22,-0.2 -0.912 11.0 179.2-112.5 136.0 7.9 -1.3 -3.8 34 37 A R E - G 0 54B 91 20,-2.1 20,-3.6 -2,-0.4 6,-0.1 -0.961 46.6 -73.3-131.6 149.2 6.2 -3.2 -6.6 35 38 A P E - G 0 53B 64 0, 0.0 18,-0.3 0, 0.0 17,-0.0 -0.119 37.7-150.1 -42.1 114.5 3.7 -2.1 -9.3 36 39 A R 0 0 38 16,-2.6 17,-0.2 14,-0.0 16,-0.1 0.963 360.0 360.0 -54.0 -55.8 0.4 -1.6 -7.6 37 40 A H 0 0 226 15,-0.4 15,-0.0 0, 0.0 16,-0.0 0.709 360.0 360.0-113.4 360.0 -1.5 -2.5 -10.7 38 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 39 51 A D 0 0 146 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-142.6 10.4 -5.1 -11.5 40 52 A S - 0 0 48 -6,-0.1 2,-0.3 13,-0.0 -6,-0.2 -0.997 360.0-133.9-169.9 170.4 10.7 -3.2 -8.2 41 53 A Y E -F 33 0B 60 -8,-2.7 -8,-3.5 -2,-0.3 2,-0.3 -0.927 14.2-159.7-133.5 158.0 12.0 -0.3 -6.1 42 54 A V E >> -F 32 0B 9 -2,-0.3 3,-0.7 -10,-0.2 4,-0.5 -0.961 50.7 -11.6-137.2 152.2 13.7 -0.0 -2.7 43 55 A G H 3> S- 0 0 0 -12,-1.8 4,-1.9 -14,-0.5 3,-0.2 -0.285 119.7 -2.2 69.3-140.2 14.1 2.8 -0.2 44 56 A D H 3> S+ 0 0 88 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.872 131.5 54.4 -58.9 -42.6 13.4 6.4 -0.8 45 57 A E H <> S+ 0 0 98 -3,-0.7 4,-2.2 2,-0.2 -1,-0.2 0.888 108.2 48.8 -61.0 -40.6 12.5 5.9 -4.4 46 58 A A H < S+ 0 0 0 -4,-0.5 -1,-0.2 1,-0.2 -2,-0.2 0.919 111.5 50.2 -65.8 -41.4 9.8 3.3 -3.5 47 59 A Q H >< S+ 0 0 30 -4,-1.9 3,-1.0 1,-0.2 -2,-0.2 0.883 111.0 49.5 -63.2 -38.5 8.4 5.6 -0.9 48 60 A S H 3< S+ 0 0 88 -4,-2.3 3,-0.5 1,-0.2 -1,-0.2 0.903 112.1 46.9 -67.4 -41.9 8.3 8.4 -3.4 49 61 A K T >X S+ 0 0 68 -4,-2.2 3,-1.7 1,-0.2 4,-0.9 0.013 72.0 122.0 -89.4 25.9 6.5 6.3 -6.1 50 62 A R T <4 + 0 0 82 -3,-1.0 -1,-0.2 1,-0.3 -2,-0.1 0.734 61.4 74.2 -62.4 -20.6 4.0 5.0 -3.6 51 63 A G T 34 S+ 0 0 75 -3,-0.5 -1,-0.3 1,-0.2 -2,-0.1 0.834 113.0 22.1 -61.3 -31.3 1.3 6.4 -5.9 52 64 A I T <4 S+ 0 0 111 -3,-1.7 -16,-2.6 -16,-0.1 -15,-0.4 0.345 119.1 69.8-116.6 2.2 1.9 3.6 -8.4 53 65 A L E < -G 35 0B 11 -4,-0.9 2,-0.5 -18,-0.3 -20,-0.1 -0.862 69.1-133.9-123.3 156.5 3.5 1.0 -6.1 54 66 A T E -G 34 0B 78 -20,-3.6 -20,-2.1 -2,-0.3 2,-0.3 -0.946 33.7-141.8-103.7 126.3 2.4 -1.3 -3.4 55 67 A L E -G 33 0B 59 -2,-0.5 2,-0.4 -22,-0.2 -22,-0.2 -0.683 17.1-170.2 -96.4 144.9 4.9 -1.1 -0.5 56 68 A K E -G 32 0B 34 -24,-2.1 -24,-2.5 -2,-0.3 -2,-0.0 -0.990 15.9-151.2-135.2 142.4 6.1 -4.0 1.7 57 69 A Y - 0 0 117 -2,-0.4 -26,-0.2 -26,-0.2 8,-0.1 -0.924 9.1-170.7-110.8 101.2 8.2 -4.0 4.9 58 70 A P + 0 0 2 0, 0.0 7,-3.4 0, 0.0 8,-1.2 0.527 68.0 70.9 -72.7 -5.1 10.1 -7.3 5.0 59 71 A I E +H 64 0C 2 -48,-0.4 2,-0.5 -29,-0.4 5,-0.2 -0.955 58.5 179.1-120.9 117.5 11.3 -6.8 8.6 60 72 A E E > S-H 63 0C 65 3,-2.8 3,-2.5 -2,-0.5 -48,-0.0 -0.969 74.3 -12.1-119.5 126.2 9.0 -6.9 11.5 61 73 A H T 3 S- 0 0 42 -2,-0.5 -1,-0.2 1,-0.3 3,-0.1 0.789 128.4 -57.9 55.7 30.9 10.1 -6.4 15.1 62 74 A G T 3 S+ 0 0 14 1,-0.3 34,-0.6 -3,-0.1 2,-0.4 0.378 117.9 113.1 83.0 -5.2 13.7 -6.7 13.8 63 75 A I E < S-H 60 0C 38 -3,-2.5 -3,-2.8 32,-0.1 2,-0.4 -0.847 71.7-119.7-102.8 134.7 12.9 -10.2 12.4 64 76 A V E +H 59 0C 21 -2,-0.4 -5,-0.3 -5,-0.2 3,-0.1 -0.576 32.6 172.5 -74.4 125.4 12.9 -10.9 8.6 65 77 A T + 0 0 95 -7,-3.4 2,-0.4 -2,-0.4 -6,-0.2 0.595 70.0 40.7-106.5 -16.0 9.4 -12.1 7.5 66 78 A N > - 0 0 62 -8,-1.2 4,-1.9 1,-0.1 -1,-0.2 -0.885 58.7-173.6-137.6 105.8 10.0 -12.1 3.7 67 79 A W H > S+ 0 0 56 -2,-0.4 4,-1.7 2,-0.2 -1,-0.1 0.715 83.7 56.1 -72.3 -23.4 13.3 -13.3 2.3 68 80 A D H > S+ 0 0 121 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.917 112.5 43.1 -74.6 -41.3 12.7 -12.4 -1.4 69 81 A D H > S+ 0 0 14 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.888 111.3 55.0 -68.5 -39.6 12.1 -8.8 -0.4 70 82 A M H X S+ 0 0 1 -4,-1.9 4,-2.7 1,-0.2 -1,-0.2 0.903 106.6 51.8 -60.0 -41.1 15.0 -8.8 2.0 71 83 A E H X S+ 0 0 59 -4,-1.7 4,-3.2 2,-0.2 -1,-0.2 0.889 107.8 52.3 -60.0 -42.0 17.3 -10.0 -0.9 72 84 A K H X S+ 0 0 23 -4,-1.5 4,-2.8 2,-0.2 -2,-0.2 0.939 109.8 49.0 -61.3 -46.7 15.9 -7.1 -2.9 73 85 A I H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.929 113.9 45.3 -60.8 -43.5 16.8 -4.7 -0.1 74 86 A W H X S+ 0 0 3 -4,-2.7 4,-2.5 2,-0.2 -2,-0.2 0.902 111.8 51.8 -66.6 -40.7 20.3 -6.1 0.2 75 87 A H H X S+ 0 0 92 -4,-3.2 4,-2.3 1,-0.2 5,-0.4 0.960 112.8 46.1 -58.8 -49.0 20.9 -6.1 -3.6 76 88 A H H X>S+ 0 0 24 -4,-2.8 4,-2.4 1,-0.2 5,-2.1 0.907 109.8 54.6 -59.5 -44.6 19.8 -2.5 -3.6 77 89 A T H <>S+ 0 0 0 -4,-2.6 5,-3.0 -5,-0.2 6,-0.4 0.930 114.7 39.4 -56.0 -48.1 22.1 -1.7 -0.6 78 90 A F H <>S+ 0 0 0 -4,-2.5 6,-2.4 3,-0.2 5,-0.6 0.988 126.5 30.4 -67.0 -60.2 25.2 -3.1 -2.3 79 91 A Y H <5S+ 0 0 89 -4,-2.3 -3,-0.2 4,-0.2 -2,-0.2 0.819 134.1 21.8 -73.0 -34.4 24.7 -1.9 -5.9 80 92 A N T <5S+ 0 0 98 -4,-2.4 -3,-0.2 -5,-0.4 -2,-0.1 0.863 127.9 35.1-102.5 -51.3 22.8 1.3 -5.4 81 93 A E T - 0 0 31 -2,-0.3 3,-2.1 1,-0.1 4,-0.1 -0.944 27.6-147.9-102.4 113.4 30.3 -5.3 -5.7 86 98 A P G > S+ 0 0 1 0, 0.0 3,-1.6 0, 0.0 -1,-0.1 0.733 91.1 69.9 -58.8 -24.0 29.5 -7.5 -2.7 87 99 A E G 3 S+ 0 0 69 1,-0.3 29,-0.1 30,-0.2 28,-0.0 0.578 97.3 56.0 -70.1 -6.3 31.7 -10.4 -3.7 88 100 A E G < S+ 0 0 128 -3,-2.1 -85,-0.4 1,-0.1 -1,-0.3 0.314 101.5 65.4-106.3 7.4 34.6 -8.0 -2.9 89 101 A H S < S- 0 0 31 -3,-1.6 30,-0.4 -87,-0.1 -85,-0.2 -0.981 72.1-128.6-141.9 134.1 33.8 -7.2 0.7 90 102 A P - 0 0 4 0, 0.0 -85,-2.4 0, 0.0 2,-0.5 -0.517 39.0-147.2 -67.8 142.3 33.5 -9.0 4.1 91 103 A V E -bd 5 120A 0 28,-2.3 30,-2.2 -87,-0.2 2,-0.6 -0.948 16.7-162.1-124.7 126.3 30.0 -8.0 5.4 92 104 A L E -bd 6 121A 0 -87,-2.8 -85,-2.9 -2,-0.5 2,-0.3 -0.896 16.9-175.8-103.2 125.5 28.9 -7.5 9.0 93 105 A L E -bd 7 122A 0 28,-3.1 30,-2.1 -2,-0.6 2,-0.2 -0.871 15.9-133.8-116.3 151.3 25.1 -7.6 9.4 94 106 A T E - d 0 123A 4 -87,-1.5 2,-0.3 -2,-0.3 -85,-0.3 -0.654 17.9-166.7-103.5 161.3 23.1 -7.0 12.6 95 107 A E E - d 0 124A 8 28,-1.8 30,-2.9 -2,-0.2 31,-0.2 -0.962 26.6-102.0-142.3 159.7 20.3 -9.0 14.1 96 108 A A > - 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0 0 120 -2,-4.0 -4,-3.3 -5,-0.1 2,-0.5 -0.069 49.2-149.7 -46.8 137.8 -1.0 26.4 8.1 235 247 A V E -N 229 0E 82 -6,-0.3 -6,-0.3 -3,-0.1 2,-0.2 -0.966 16.6-169.8-114.7 117.3 0.4 26.8 11.6 236 248 A I E -N 228 0E 1 -8,-3.2 -8,-2.8 -2,-0.5 2,-0.5 -0.551 16.2-125.1-102.9 171.8 -1.0 24.4 14.2 237 249 A T E -N 227 0E 45 -10,-0.2 2,-0.4 -2,-0.2 -10,-0.2 -0.972 15.1-161.0-125.0 124.5 -0.6 24.3 18.0 238 250 A I E +N 226 0E 0 -12,-2.8 -12,-2.1 -2,-0.5 -57,-0.0 -0.837 17.2 165.5-103.0 136.9 0.6 21.4 20.1 239 251 A G > - 0 0 3 -2,-0.4 3,-1.8 -14,-0.2 4,-0.2 0.251 67.9 -15.0-114.3-120.0 -0.1 21.1 23.8 240 252 A N T 3> S+ 0 0 35 1,-0.3 4,-1.9 2,-0.2 3,-0.5 0.447 115.9 84.6 -70.1 0.3 0.2 18.2 26.2 241 253 A E H 3> S+ 0 0 5 1,-0.2 4,-1.6 2,-0.2 -1,-0.3 0.756 75.4 72.8 -72.7 -22.7 0.4 15.9 23.2 242 254 A R H <4 S+ 0 0 29 -3,-1.8 -36,-1.9 1,-0.2 -1,-0.2 0.876 114.9 19.3 -57.9 -39.6 4.1 16.8 23.2 243 255 A F H > S+ 0 0 0 -3,-0.5 4,-1.1 -4,-0.2 -35,-0.3 0.617 115.8 66.7-107.7 -16.5 4.7 14.6 26.3 244 256 A R H X S+ 0 0 33 -4,-1.9 4,-0.6 2,-0.2 -3,-0.2 0.859 97.1 59.7 -71.6 -33.1 1.6 12.4 26.2 245 257 A C H >< S+ 0 0 0 -4,-1.6 3,-1.5 1,-0.2 4,-0.2 0.986 112.0 33.8 -59.7 -63.6 2.8 10.8 23.1 246 258 A P H >4 S+ 0 0 0 0, 0.0 3,-2.0 0, 0.0 4,-0.5 0.702 101.0 80.8 -68.8 -14.2 6.2 9.4 24.4 247 259 A E H >X S+ 0 0 0 -4,-1.1 4,-2.4 1,-0.3 3,-1.0 0.769 76.8 75.5 -59.0 -23.3 4.5 8.8 27.8 248 260 A A T << S+ 0 0 0 -3,-1.5 -1,-0.3 -4,-0.6 7,-0.2 0.749 82.8 64.5 -60.6 -26.6 3.1 5.7 26.2 249 261 A L T <4 S+ 0 0 1 -3,-2.0 13,-2.2 1,-0.2 -1,-0.3 0.866 114.5 31.6 -64.4 -36.0 6.6 4.1 26.5 250 262 A F T <4 S+ 0 0 7 -3,-1.0 11,-0.6 -4,-0.5 -2,-0.2 0.729 130.1 38.3 -92.3 -27.3 6.2 4.2 30.3 251 263 A Q >< + 0 0 71 -4,-2.4 3,-2.8 -5,-0.1 4,-0.2 -0.630 63.1 173.8-125.9 72.9 2.4 3.8 30.3 252 264 A P G > >S+ 0 0 4 0, 0.0 5,-2.3 0, 0.0 3,-1.3 0.581 72.2 79.4 -55.0 -10.5 1.6 1.2 27.6 253 265 A S G > 5S+ 0 0 76 1,-0.3 3,-2.9 3,-0.3 -5,-0.1 0.784 76.0 74.4 -68.2 -24.7 -2.0 1.4 28.8 254 266 A F G < 5S+ 0 0 53 -3,-2.8 -1,-0.3 1,-0.3 -6,-0.1 0.773 103.3 39.6 -56.6 -26.9 -2.2 4.6 26.8 255 267 A L G < 5S- 0 0 50 -3,-1.3 -1,-0.3 -4,-0.2 -2,-0.2 -0.026 126.4-103.8-110.5 26.8 -2.3 2.3 23.8 256 268 A G T < 5S+ 0 0 71 -3,-2.9 2,-0.4 1,-0.2 -3,-0.3 0.830 74.3 145.8 56.0 34.5 -4.5 -0.2 25.5 257 269 A M < - 0 0 44 -5,-2.3 -1,-0.2 2,-0.1 -2,-0.1 -0.834 47.9-150.3-104.0 142.6 -1.6 -2.6 26.1 258 270 A E + 0 0 208 -2,-0.4 -5,-0.1 -3,-0.1 -1,-0.1 0.628 65.5 109.9 -83.3 -13.3 -1.4 -4.7 29.3 259 271 A S S S- 0 0 59 -7,-0.2 2,-0.2 1,-0.1 -2,-0.1 -0.102 73.4-106.7 -62.4 158.5 2.4 -4.6 29.1 260 272 A A - 0 0 34 1,-0.1 -9,-0.1 -8,-0.1 -1,-0.1 -0.586 39.6-100.4 -86.9 147.1 4.7 -2.8 31.5 261 273 A G > - 0 0 2 -11,-0.6 4,-1.8 -2,-0.2 3,-0.4 -0.008 40.8 -94.3 -58.7 171.4 6.5 0.4 30.5 262 274 A I H > S+ 0 0 2 -13,-2.2 4,-2.1 1,-0.2 5,-0.1 0.762 122.2 58.5 -61.4 -31.5 10.1 0.4 29.5 263 275 A H H > S+ 0 0 19 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.899 110.2 43.8 -66.9 -40.7 11.4 1.3 33.0 264 276 A E H > S+ 0 0 80 -3,-0.4 4,-3.2 2,-0.2 -2,-0.2 0.850 111.0 54.0 -71.9 -34.3 9.8 -1.9 34.4 265 277 A T H X S+ 0 0 13 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.910 110.7 47.4 -64.8 -41.9 11.0 -4.0 31.5 266 278 A T H X S+ 0 0 0 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.954 113.4 47.3 -62.8 -49.8 14.5 -2.9 32.2 267 279 A Y H X S+ 0 0 57 -4,-2.2 4,-2.8 1,-0.2 -2,-0.2 0.941 112.6 50.2 -57.1 -48.6 14.1 -3.6 35.9 268 280 A N H X S+ 0 0 60 -4,-3.2 4,-0.6 1,-0.2 -1,-0.2 0.855 109.0 50.4 -59.8 -38.3 12.6 -7.0 35.2 269 281 A S H >< S+ 0 0 0 -4,-2.3 3,-1.1 2,-0.2 4,-0.4 0.936 111.0 50.1 -65.7 -43.5 15.4 -7.9 32.8 270 282 A I H >< S+ 0 0 0 -4,-2.4 3,-1.9 1,-0.3 -2,-0.2 0.932 106.3 55.6 -59.3 -45.4 17.9 -6.9 35.5 271 283 A M H 3< S+ 0 0 67 -4,-2.8 -1,-0.3 1,-0.3 -2,-0.2 0.659 99.5 61.6 -65.5 -11.9 16.1 -9.0 38.1 272 284 A K T << S+ 0 0 108 -3,-1.1 -1,-0.3 -4,-0.6 -2,-0.2 0.567 92.8 83.1 -89.4 -8.3 16.5 -12.1 35.9 273 285 A C S < S- 0 0 3 -3,-1.9 5,-0.1 -4,-0.4 -3,-0.0 -0.532 100.2 -73.6 -93.5 161.4 20.3 -11.9 36.1 274 286 A D >> - 0 0 87 -2,-0.2 3,-2.2 1,-0.2 4,-1.0 -0.278 42.1-127.5 -53.3 129.3 22.6 -13.2 38.8 275 287 A V H 3> S+ 0 0 90 1,-0.3 4,-0.5 2,-0.2 3,-0.3 0.803 105.8 68.4 -50.4 -30.6 22.3 -10.9 41.8 276 288 A D H 34 S+ 0 0 129 1,-0.2 -1,-0.3 2,-0.1 4,-0.2 0.745 106.4 37.0 -63.6 -25.2 26.1 -10.6 41.7 277 289 A I H X> S+ 0 0 14 -3,-2.2 4,-1.2 1,-0.1 3,-0.9 0.582 88.7 92.5-105.7 -9.0 26.1 -8.6 38.5 278 290 A R H 3X S+ 0 0 55 -4,-1.0 4,-2.6 -3,-0.3 5,-0.3 0.826 80.8 60.8 -54.1 -34.3 22.9 -6.5 39.0 279 291 A K H 3X S+ 0 0 150 -4,-0.5 4,-1.6 1,-0.2 -1,-0.3 0.899 104.4 49.2 -59.7 -41.4 25.0 -3.6 40.4 280 292 A D H <4 S+ 0 0 67 -3,-0.9 -1,-0.2 2,-0.2 -2,-0.2 0.769 110.8 50.3 -68.9 -29.0 26.9 -3.3 37.2 281 293 A L H >< S+ 0 0 0 -4,-1.2 3,-2.0 -3,-0.2 -142,-0.5 0.953 109.9 48.7 -74.9 -50.1 23.7 -3.4 35.1 282 294 A Y H 3< S+ 0 0 5 -4,-2.6 34,-2.2 1,-0.3 3,-0.4 0.841 112.1 50.9 -55.7 -36.5 22.0 -0.6 37.2 283 295 A G T 3< S+ 0 0 17 -4,-1.6 -1,-0.3 -5,-0.3 -2,-0.2 0.450 115.1 43.3 -84.1 1.9 25.2 1.4 36.8 284 296 A N < + 0 0 26 -3,-2.0 -145,-2.3 -5,-0.1 2,-1.0 -0.440 63.7 158.4-145.7 64.8 25.3 1.0 33.0 285 297 A V E -jm 139 317D 0 31,-2.5 33,-3.4 -3,-0.4 2,-0.5 -0.811 23.4-166.6 -93.9 103.4 21.8 1.5 31.5 286 298 A V E -jm 140 318D 0 -147,-2.0 -145,-2.9 -2,-1.0 2,-0.4 -0.791 6.1-154.5 -96.6 126.2 22.6 2.3 27.9 287 299 A L E +j 141 0D 0 31,-3.0 2,-0.3 -2,-0.5 -145,-0.2 -0.835 21.4 165.5-100.6 137.0 19.8 3.7 25.7 288 300 A S E +j 142 0D 0 -147,-2.5 -145,-2.2 -2,-0.4 36,-0.2 -0.981 26.1 60.0-145.4 157.9 20.0 3.3 21.9 289 301 A G S > S- 0 0 9 34,-2.7 3,-1.6 -2,-0.3 -145,-0.2 -0.111 84.3 -79.1 107.3 154.5 17.7 3.6 18.9 290 302 A G G > S+ 0 0 33 34,-0.3 3,-1.5 1,-0.3 -146,-0.2 0.828 122.4 59.8 -59.9 -34.4 15.7 6.3 17.3 291 303 A T G 3 S+ 0 0 7 -148,-1.9 3,-0.4 1,-0.3 -1,-0.3 0.502 95.3 63.0 -76.3 -2.1 12.8 6.1 19.8 292 304 A T G < S+ 0 0 0 -3,-1.6 -1,-0.3 -149,-0.4 -2,-0.2 0.309 78.9 91.8 -99.4 7.1 15.1 6.9 22.8 293 305 A M < + 0 0 71 -3,-1.5 -1,-0.2 -4,-0.1 -2,-0.1 0.478 52.1 120.0 -81.3 -2.7 15.8 10.3 21.2 294 306 A F S > S- 0 0 15 -3,-0.4 3,-1.7 1,-0.1 4,-0.3 -0.379 73.6-111.0 -63.3 132.8 13.0 12.1 23.1 295 307 A P T 3 S+ 0 0 85 0, 0.0 -88,-2.9 0, 0.0 -1,-0.1 -0.392 103.1 25.2 -61.4 147.1 14.4 15.0 25.2 296 308 A G T 3> S+ 0 0 31 -90,-0.2 4,-2.0 -3,-0.1 5,-0.2 0.316 85.3 114.2 83.4 -9.3 14.0 14.1 28.9 297 309 A I H <> S+ 0 0 2 -3,-1.7 4,-2.5 1,-0.2 5,-0.2 0.889 75.4 50.4 -65.1 -36.9 13.9 10.3 28.4 298 310 A A H > S+ 0 0 26 -4,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.944 111.2 48.2 -66.9 -44.8 17.2 9.7 30.3 299 311 A D H > S+ 0 0 105 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.875 114.2 48.1 -60.3 -39.0 16.1 11.8 33.3 300 312 A R H X S+ 0 0 12 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.885 110.8 49.2 -70.5 -38.5 12.8 9.9 33.3 301 313 A M H X S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 5,-0.3 0.889 111.0 51.9 -67.0 -37.4 14.5 6.5 33.1 302 314 A N H X S+ 0 0 64 -4,-2.5 4,-2.8 -5,-0.2 5,-0.2 0.964 111.4 46.4 -62.5 -50.8 16.8 7.5 35.9 303 315 A K H X S+ 0 0 79 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.911 115.0 45.0 -58.4 -46.6 13.9 8.5 38.1 304 316 A E H X S+ 0 0 37 -4,-2.4 4,-1.3 2,-0.2 -1,-0.2 0.922 116.2 45.0 -66.9 -44.5 11.8 5.4 37.4 305 317 A L H X S+ 0 0 0 -4,-2.4 4,-2.0 -5,-0.2 3,-0.4 0.902 110.6 54.6 -66.1 -40.2 14.7 3.0 37.8 306 318 A T H < S+ 0 0 67 -4,-2.8 -1,-0.2 -5,-0.3 -2,-0.2 0.904 107.9 52.1 -59.2 -38.8 15.8 4.8 41.0 307 319 A A H < S+ 0 0 80 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.790 112.3 43.9 -67.9 -29.8 12.3 4.3 42.3 308 320 A L H < S+ 0 0 59 -4,-1.3 -1,-0.2 -3,-0.4 -2,-0.2 0.749 106.5 66.0 -87.2 -26.8 12.3 0.5 41.6 309 321 A A S < S- 0 0 10 -4,-2.0 6,-0.1 1,-0.1 -42,-0.0 -0.585 99.1 -83.6 -96.1 157.7 15.8 -0.3 43.0 310 322 A P > - 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