==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CONTRACTILE PROTEIN 15-MAY-01 1J6Z . COMPND 2 MOLECULE: ACTIN ALPHA 1; . SOURCE 2 ORGANISM_SCIENTIFIC: ORYCTOLAGUS CUNICULUS; . AUTHOR L.R.OTTERBEIN,P.GRACEFFA,R.DOMINGUEZ . 369 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17086.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 260 70.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 20 5.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 40 10.8 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 . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 21 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 52 14.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 105 28.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 2.2 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 2 1 2 2 1 1 0 1 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 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 0 0 PARALLEL BRIDGES PER LADDER . 0 3 2 2 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 ANTIPARALLEL BRIDGES PER LADDER . 1 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 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 E 0 0 127 0, 0.0 97,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 112.5 -14.6 11.2 6.9 2 5 A T + 0 0 137 95,-0.5 2,-0.6 1,-0.2 96,-0.1 0.431 360.0 24.0-136.0 -74.5 -11.8 13.7 6.6 3 6 A T - 0 0 59 94,-0.3 -1,-0.2 15,-0.0 2,-0.1 -0.903 69.1-144.7-110.2 119.2 -8.7 13.4 8.9 4 7 A A - 0 0 9 -2,-0.6 15,-3.1 340,-0.2 2,-0.3 -0.417 8.1-138.6 -79.2 151.3 -7.7 10.1 10.3 5 8 A L E -Ab 18 100A 3 94,-2.8 96,-2.8 13,-0.2 2,-0.4 -0.817 7.7-154.9-105.6 145.7 -6.2 9.6 13.8 6 9 A V E -Ab 17 101A 1 11,-2.7 11,-1.9 -2,-0.3 2,-0.5 -0.993 10.4-176.2-122.3 123.4 -3.4 7.2 14.6 7 10 A C E -Ab 16 102A 4 94,-2.9 96,-1.4 -2,-0.4 2,-0.9 -0.949 7.3-166.5-123.5 108.5 -3.0 5.8 18.1 8 11 A D E -A 15 0A 8 7,-3.3 7,-2.1 -2,-0.5 2,-1.5 -0.856 13.2-151.5 -97.5 105.4 -0.0 3.6 18.8 9 12 A N E -A 14 0A 3 -2,-0.9 5,-0.2 94,-0.3 96,-0.1 -0.564 22.4-169.8 -78.9 81.9 -0.8 2.0 22.2 10 13 A G - 0 0 7 -2,-1.5 58,-0.1 3,-0.9 61,-0.1 -0.337 33.8-119.3 -81.4 156.3 2.8 1.4 23.6 11 14 A S S S+ 0 0 10 1,-0.2 57,-0.3 145,-0.1 60,-0.1 0.776 113.2 6.6 -59.5 -29.6 3.8 -0.6 26.6 12 15 A G S S+ 0 0 6 1,-0.3 18,-1.9 58,-0.1 2,-0.4 0.542 133.7 39.5-124.3 -29.4 5.3 2.5 28.2 13 16 A L E - C 0 29A 69 16,-0.3 -3,-0.9 17,-0.1 2,-0.4 -0.993 62.4-144.1-131.1 134.5 4.4 5.3 25.8 14 17 A V E -AC 9 28A 0 14,-3.1 14,-1.6 -2,-0.4 2,-0.5 -0.749 18.2-164.8 -85.7 129.2 1.2 6.2 23.9 15 18 A K E +AC 8 27A 32 -7,-2.1 -7,-3.3 -2,-0.4 2,-0.3 -0.993 20.6 163.5-112.5 117.9 2.2 7.8 20.5 16 19 A A E +AC 7 26A 0 10,-2.7 10,-2.4 -2,-0.5 9,-0.8 -0.965 6.2 113.1-141.5 153.9 -0.8 9.6 18.9 17 20 A G E -A 6 0A 0 -11,-1.9 -11,-2.7 -2,-0.3 2,-0.4 -0.960 58.0 -48.0 179.2-160.0 -1.5 12.1 16.2 18 21 A F E > -A 5 0A 27 -2,-0.3 3,-2.2 5,-0.3 -13,-0.2 -0.819 53.5-106.9-106.6 138.2 -3.0 12.7 12.8 19 22 A A T 3 S+ 0 0 17 -15,-3.1 3,-0.1 -2,-0.4 -15,-0.1 -0.374 108.6 33.7 -59.1 138.6 -2.5 10.6 9.7 20 23 A G T 3 S+ 0 0 50 1,-0.5 -1,-0.3 318,-0.2 2,-0.1 0.081 88.1 116.7 100.5 -31.4 -0.2 12.4 7.3 21 24 A D S < S- 0 0 45 -3,-2.2 -1,-0.5 1,-0.1 320,-0.1 -0.445 70.3-128.9 -64.9 153.8 1.8 14.2 10.1 22 25 A D S S+ 0 0 148 1,-0.1 -1,-0.1 -3,-0.1 316,-0.1 0.703 86.2 8.7 -79.8 -17.6 5.5 13.1 9.9 23 26 A A S S- 0 0 44 -5,-0.1 -5,-0.3 314,-0.1 -1,-0.1 -0.958 95.4 -79.8-155.9 158.8 5.6 12.2 13.6 24 27 A P - 0 0 15 0, 0.0 -7,-0.2 0, 0.0 3,-0.1 -0.444 26.9-152.8 -68.6 138.1 3.1 11.9 16.5 25 28 A R S S+ 0 0 162 -9,-0.8 2,-0.5 1,-0.1 -8,-0.2 0.654 81.9 50.7 -78.9 -25.5 2.1 15.1 18.1 26 29 A A E +C 16 0A 3 -10,-2.4 -10,-2.7 2,-0.0 2,-0.4 -0.982 57.3 166.1-121.2 121.7 1.3 13.5 21.5 27 30 A V E +C 15 0A 53 -2,-0.5 -12,-0.2 -12,-0.2 -14,-0.0 -0.942 18.1 147.1-130.2 112.1 3.7 11.2 23.4 28 31 A F E -C 14 0A 2 -14,-1.6 -14,-3.1 -2,-0.4 24,-0.1 -0.983 50.3 -79.7-145.4 164.0 2.9 10.4 27.0 29 32 A P E -C 13 0A 11 0, 0.0 2,-2.1 0, 0.0 23,-0.4 -0.324 32.8-129.0 -68.5 140.3 3.3 7.5 29.5 30 33 A S + 0 0 0 -18,-1.9 38,-0.4 21,-0.1 2,-0.4 -0.425 68.2 122.3 -86.8 65.1 0.8 4.6 29.4 31 34 A I - 0 0 2 -2,-2.1 21,-2.5 35,-0.2 2,-0.4 -0.990 44.3-164.2-131.2 140.5 0.1 4.8 33.1 32 35 A V E -FG 51 65B 1 33,-2.2 33,-2.5 -2,-0.4 2,-0.4 -0.981 9.7-159.9-125.6 131.7 -3.1 5.4 35.0 33 36 A G E -FG 50 64B 0 17,-3.1 17,-1.8 -2,-0.4 31,-0.2 -0.939 6.9-173.1-117.5 138.7 -3.0 6.4 38.7 34 37 A R E - G 0 63B 73 29,-2.3 29,-3.0 -2,-0.4 15,-0.2 -0.995 27.2-114.6-129.7 136.3 -5.9 6.0 41.2 35 38 A P - 0 0 17 0, 0.0 27,-0.2 0, 0.0 3,-0.1 -0.283 14.6-150.5 -60.1 155.5 -6.2 7.3 44.7 36 39 A R S S+ 0 0 159 25,-0.5 2,-0.3 1,-0.2 26,-0.1 0.423 78.3 45.7-106.4 -1.9 -6.4 4.6 47.4 37 40 A H S > S- 0 0 120 1,-0.1 4,-2.4 0, 0.0 -1,-0.2 -0.997 73.1-134.0-147.2 137.7 -8.5 6.6 49.8 38 41 A Q H > S+ 0 0 119 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.843 107.2 52.8 -61.6 -40.9 -11.6 8.7 49.4 39 42 A G H > S+ 0 0 44 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.884 110.8 47.3 -62.2 -39.5 -10.3 11.6 51.5 40 43 A V H > S+ 0 0 53 2,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.932 111.0 53.1 -67.8 -41.1 -7.1 11.7 49.4 41 44 A M H <>S+ 0 0 35 -4,-2.4 5,-2.0 1,-0.2 6,-0.4 0.928 115.4 38.8 -57.2 -50.8 -9.2 11.6 46.3 42 45 A V H ><5S+ 0 0 64 -4,-2.5 3,-1.9 3,-0.2 -2,-0.2 0.926 114.3 54.5 -66.9 -42.9 -11.3 14.6 47.3 43 46 A G H 3<5S+ 0 0 68 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.732 107.2 50.9 -64.7 -25.6 -8.4 16.5 48.9 44 47 A M T 3<5S- 0 0 53 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.355 139.9 -71.9 -94.3 4.8 -6.4 16.3 45.6 45 48 A G T < 5 - 0 0 50 -3,-1.9 -3,-0.2 -4,-0.1 -2,-0.2 0.561 63.7 -87.6 122.0 5.3 -9.3 17.6 43.6 46 49 A Q S -F 32 0B 9 -2,-0.3 3,-1.0 -19,-0.2 4,-0.3 -0.958 50.0 -20.0-126.5 147.7 -3.0 9.6 33.3 52 55 A G T 3> S+ 0 0 0 -21,-2.5 4,-2.4 -23,-0.4 3,-0.4 -0.330 124.4 0.3 69.9-136.6 0.6 9.9 32.2 53 56 A D H 3> S+ 0 0 102 1,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.850 132.0 57.6 -63.0 -31.0 3.0 12.5 33.6 54 57 A E H <> S+ 0 0 99 -3,-1.0 4,-1.0 2,-0.2 -1,-0.3 0.878 108.5 46.7 -63.6 -39.2 0.2 13.7 36.0 55 58 A A H >4 S+ 0 0 0 -3,-0.4 3,-0.5 -4,-0.3 7,-0.2 0.943 111.6 50.4 -66.6 -45.6 -0.1 10.1 37.4 56 59 A Q H >< S+ 0 0 45 -4,-2.4 3,-1.7 1,-0.2 -2,-0.2 0.907 104.1 58.3 -61.8 -36.2 3.7 9.7 37.7 57 60 A S H 3< S+ 0 0 102 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.843 106.2 49.9 -64.9 -30.3 4.0 13.0 39.6 58 61 A K T XX S+ 0 0 63 -4,-1.0 4,-2.3 -3,-0.5 3,-1.7 0.149 80.4 144.4 -94.1 21.5 1.6 11.6 42.3 59 62 A R B <4 +h 62 0C 134 -3,-1.7 4,-0.1 1,-0.2 -3,-0.1 -0.184 62.9 32.7 -61.0 147.2 3.4 8.3 42.8 60 63 A G T 34 S+ 0 0 44 2,-0.7 -1,-0.2 1,-0.1 3,-0.1 0.142 121.9 52.8 91.6 -26.7 3.4 7.0 46.3 61 64 A I T <4 S+ 0 0 82 -3,-1.7 -25,-0.5 1,-0.1 -2,-0.2 0.780 109.4 45.0 -99.4 -61.9 -0.0 8.6 46.9 62 65 A L B < S-h 59 0C 1 -4,-2.3 -2,-0.7 -7,-0.2 2,-0.5 -0.476 89.3-115.7 -76.1 158.2 -1.9 7.1 43.9 63 66 A T E -G 34 0B 72 -29,-3.0 -29,-2.3 -2,-0.2 2,-0.3 -0.853 35.1-141.8 -89.2 124.3 -1.6 3.4 43.0 64 67 A L E -G 33 0B 51 -2,-0.5 2,-0.4 -31,-0.2 -31,-0.2 -0.690 16.7-167.3 -91.6 144.9 -0.0 3.4 39.5 65 68 A K E -G 32 0B 79 -33,-2.5 -33,-2.2 -2,-0.3 3,-0.0 -0.999 18.2-157.0-129.4 141.6 -1.1 0.9 36.9 66 69 A Y > - 0 0 63 -2,-0.4 3,-1.2 -35,-0.2 -35,-0.2 -0.906 14.7-177.4-108.8 95.9 0.5 -0.0 33.6 67 70 A P T 3 S+ 0 0 0 0, 0.0 7,-2.9 0, 0.0 8,-0.8 0.495 85.7 36.3 -77.1 -4.4 -2.5 -1.4 31.7 68 71 A I T > S+ 0 0 0 -38,-0.4 3,-2.5 -57,-0.3 5,-0.2 -0.256 78.7 149.7-130.2 32.7 -0.3 -2.3 28.6 69 72 A E T < S+ 0 0 64 -3,-1.2 4,-0.1 1,-0.3 -1,-0.1 0.784 79.3 21.5 -43.8 -50.9 2.7 -3.4 30.7 70 73 A X T 3 S- 0 0 87 2,-0.4 -1,-0.3 -4,-0.1 3,-0.1 0.080 126.1 -85.2-109.1 24.0 4.0 -6.0 28.3 71 74 A G S < S+ 0 0 7 -3,-2.5 34,-0.5 1,-0.3 2,-0.4 0.053 103.9 96.6 100.5 -23.5 2.3 -4.7 25.2 72 75 A I S S- 0 0 42 32,-0.1 2,-0.4 -61,-0.0 -2,-0.4 -0.806 80.2-117.1-100.2 134.9 -1.1 -6.5 25.6 73 76 A I + 0 0 9 -2,-0.4 -5,-0.2 -5,-0.2 3,-0.1 -0.613 38.4 169.9 -72.9 125.5 -3.9 -4.4 27.1 74 77 A T + 0 0 90 -7,-2.9 2,-0.4 -2,-0.4 -1,-0.1 0.493 61.0 48.6-116.3 -7.8 -4.9 -6.1 30.4 75 78 A N > - 0 0 58 -8,-0.8 4,-2.1 1,-0.1 -1,-0.2 -0.917 56.0-171.5-140.7 111.1 -7.3 -3.6 32.1 76 79 A W H > S+ 0 0 60 -2,-0.4 4,-2.4 2,-0.2 5,-0.1 0.801 86.2 55.1 -76.8 -27.9 -10.1 -2.0 30.0 77 80 A D H > S+ 0 0 112 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.939 113.1 43.6 -71.0 -40.6 -11.2 0.5 32.6 78 81 A D H > S+ 0 0 5 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.908 112.8 52.8 -65.0 -41.9 -7.6 1.9 32.7 79 82 A M H X S+ 0 0 0 -4,-2.1 4,-2.8 1,-0.2 5,-0.2 0.908 104.5 55.3 -62.4 -38.8 -7.3 1.7 28.9 80 83 A E H X S+ 0 0 80 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.902 107.4 51.1 -58.8 -41.1 -10.6 3.7 28.5 81 84 A K H X S+ 0 0 41 -4,-1.6 4,-2.4 2,-0.2 -1,-0.2 0.902 109.5 50.0 -61.6 -42.3 -8.9 6.4 30.7 82 85 A I H X S+ 0 0 0 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.930 113.0 45.5 -63.2 -44.0 -5.8 6.4 28.5 83 86 A W H X S+ 0 0 1 -4,-2.8 4,-2.6 2,-0.2 5,-0.2 0.875 111.4 52.6 -66.7 -37.8 -7.8 6.8 25.3 84 87 A H H X S+ 0 0 86 -4,-2.6 4,-3.0 -5,-0.2 5,-0.5 0.932 111.2 47.3 -61.3 -41.6 -10.0 9.5 26.8 85 88 A H H X>S+ 0 0 12 -4,-2.4 5,-2.3 1,-0.2 4,-2.0 0.917 111.2 52.6 -62.4 -44.1 -6.8 11.4 27.8 86 89 A T H <>S+ 0 0 2 -4,-2.4 5,-2.8 3,-0.2 6,-0.4 0.960 118.0 34.6 -56.1 -51.7 -5.5 10.9 24.3 87 90 A F H <5S+ 0 0 3 -4,-2.6 6,-2.6 3,-0.2 5,-0.5 0.942 129.9 28.0 -72.6 -51.3 -8.5 12.3 22.5 88 91 A Y H <5S+ 0 0 94 -4,-3.0 -3,-0.2 4,-0.2 -2,-0.2 0.698 130.3 27.4 -89.1 -28.2 -9.7 15.0 24.8 89 92 A N T <5S+ 0 0 80 -4,-2.0 -3,-0.2 -5,-0.5 -4,-0.1 0.769 128.7 29.9-104.6 -37.8 -6.6 16.2 26.7 90 93 A E T - 0 0 24 -2,-0.3 3,-2.3 1,-0.1 4,-0.2 -0.921 26.7-153.7-102.4 105.7 -13.9 15.0 19.0 95 98 A P G > S+ 0 0 0 0, 0.0 3,-1.8 0, 0.0 -1,-0.1 0.804 87.0 70.7 -60.0 -22.6 -13.4 11.3 18.2 96 99 A E G 3 S+ 0 0 87 1,-0.3 29,-0.1 30,-0.2 28,-0.0 0.635 96.1 54.9 -70.7 -6.0 -16.7 11.0 16.5 97 100 A E G < S+ 0 0 125 -3,-2.3 -95,-0.5 1,-0.1 -94,-0.3 0.408 101.8 66.9-100.6 -5.9 -15.3 13.1 13.6 98 101 A H S < S- 0 0 20 -3,-1.8 30,-0.3 -4,-0.2 -94,-0.1 -0.943 72.2-132.6-130.8 122.0 -12.3 10.9 12.9 99 102 A P - 0 0 10 0, 0.0 -94,-2.8 0, 0.0 2,-0.5 -0.406 38.6-148.5 -52.7 135.7 -11.6 7.4 11.6 100 103 A T E -bd 5 129A 0 28,-2.1 30,-1.5 -96,-0.2 2,-0.5 -0.966 14.6-157.1-127.9 125.3 -9.1 6.0 14.1 101 104 A L E -bd 6 130A 2 -96,-2.8 -94,-2.9 -2,-0.5 2,-0.3 -0.885 15.8-167.6 -95.9 123.7 -6.4 3.5 13.5 102 105 A L E -bd 7 131A 0 28,-2.8 30,-2.4 -2,-0.5 2,-0.3 -0.827 10.9-137.8-111.0 147.1 -5.2 1.6 16.6 103 106 A T E - d 0 132A 1 -96,-1.4 2,-0.3 -2,-0.3 -94,-0.3 -0.753 16.0-163.5-102.3 154.5 -2.1 -0.6 16.9 104 107 A E E - 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0 0 125 -5,-0.1 -4,-2.7 1,-0.0 2,-0.5 -0.434 50.7-140.3 -72.9 157.9 27.5 18.4 39.8 244 247 A V E -N 238 0E 84 -6,-0.2 -6,-0.2 -3,-0.1 2,-0.2 -0.993 14.9-163.7-123.1 123.6 29.1 16.6 36.9 245 248 A I E -N 237 0E 4 -8,-2.8 -8,-2.3 -2,-0.5 2,-0.4 -0.667 14.3-131.8-100.9 161.9 29.4 12.8 36.8 246 249 A T E -N 236 0E 38 -2,-0.2 2,-0.4 -10,-0.2 -10,-0.2 -0.921 17.9-165.3-114.4 132.9 31.7 10.8 34.5 247 250 A I E +N 235 0E 1 -12,-2.8 -12,-2.6 -2,-0.4 -57,-0.0 -0.998 22.2 147.1-118.7 129.2 30.3 7.8 32.6 248 251 A G S > S+ 0 0 2 -2,-0.4 3,-1.8 -14,-0.2 4,-0.3 0.383 70.8 6.5-125.0-102.8 32.6 5.3 31.0 249 252 A N T >> S+ 0 0 53 1,-0.3 4,-2.5 2,-0.2 3,-1.0 0.672 115.1 76.2 -66.0 -15.8 32.0 1.5 30.5 250 253 A E H 3> S+ 0 0 8 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.806 81.1 72.7 -62.3 -24.0 28.4 2.0 31.8 251 254 A R H <4 S+ 0 0 36 -3,-1.8 -36,-2.2 1,-0.2 -1,-0.2 0.882 114.7 19.6 -57.3 -40.9 27.7 3.5 28.3 252 255 A F H <> S+ 0 0 0 -3,-1.0 4,-1.4 -4,-0.3 -35,-0.3 0.681 114.9 67.7-107.6 -17.6 27.9 0.1 26.7 253 256 A R H X S+ 0 0 49 -4,-2.5 4,-0.7 2,-0.2 -3,-0.2 0.906 97.1 58.3 -63.6 -39.7 27.4 -2.2 29.7 254 257 A C H >< S+ 0 0 0 -4,-1.8 3,-1.3 1,-0.2 4,-0.2 0.972 112.1 35.2 -57.8 -56.8 23.8 -1.0 30.0 255 258 A P H >4 S+ 0 0 0 0, 0.0 3,-2.0 0, 0.0 4,-0.5 0.716 98.1 81.7 -75.2 -11.4 22.5 -2.0 26.5 256 259 A E H >X S+ 0 0 0 -4,-1.4 4,-2.2 1,-0.3 3,-1.5 0.848 76.7 77.1 -58.0 -25.8 24.7 -5.1 26.4 257 260 A T T << S+ 0 0 0 -3,-1.3 -1,-0.3 -4,-0.7 7,-0.2 0.798 81.8 63.8 -54.1 -34.5 21.8 -6.5 28.5 258 261 A L T <4 S+ 0 0 1 -3,-2.0 13,-2.4 1,-0.2 -1,-0.3 0.850 113.8 33.3 -60.5 -35.9 19.7 -6.9 25.3 259 262 A F T <4 S+ 0 0 7 -3,-1.5 11,-0.4 -4,-0.5 -2,-0.2 0.697 131.6 34.5 -87.3 -25.5 22.3 -9.4 24.0 260 263 A Q >< + 0 0 54 -4,-2.2 3,-2.3 -5,-0.2 -1,-0.2 -0.688 63.3 176.1-130.8 78.7 23.1 -10.8 27.5 261 264 A P G > >S+ 0 0 5 0, 0.0 3,-2.0 0, 0.0 5,-1.8 0.709 72.3 80.5 -61.0 -14.7 19.9 -10.8 29.6 262 265 A S G > 5S+ 0 0 79 1,-0.3 3,-1.5 3,-0.2 -5,-0.1 0.741 73.9 77.1 -65.4 -15.4 21.9 -12.6 32.4 263 266 A F G < 5S+ 0 0 50 -3,-2.3 -1,-0.3 1,-0.3 -6,-0.1 0.769 104.7 33.9 -62.7 -28.1 23.2 -9.1 33.3 264 267 A I G < 5S- 0 0 54 -3,-2.0 -1,-0.3 -4,-0.2 -2,-0.2 0.127 128.6 -95.4-111.2 18.6 19.9 -8.4 34.9 265 268 A G T < 5S+ 0 0 51 -3,-1.5 2,-0.4 1,-0.3 -3,-0.2 0.821 78.6 138.6 75.8 32.6 19.4 -11.9 36.1 266 269 A M < - 0 0 44 -5,-1.8 -1,-0.3 2,-0.1 -2,-0.1 -0.899 45.9-152.3-108.4 141.4 17.2 -13.2 33.3 267 270 A E + 0 0 182 -2,-0.4 -5,-0.1 -6,-0.1 -1,-0.1 0.496 57.5 120.6 -88.2 -1.7 17.7 -16.7 31.7 268 271 A S S S- 0 0 51 1,-0.1 -6,-0.2 -7,-0.1 2,-0.1 -0.150 70.9-101.2 -64.5 155.7 16.4 -15.6 28.4 269 272 A A - 0 0 31 1,-0.1 -1,-0.1 -8,-0.1 -9,-0.1 -0.418 44.3-108.6 -68.3 149.9 18.2 -15.7 25.0 270 273 A G > - 0 0 2 -11,-0.4 4,-2.2 -2,-0.1 3,-0.3 -0.245 35.7 -94.7 -78.5 168.2 19.5 -12.4 23.8 271 274 A I H > S+ 0 0 1 -13,-2.4 4,-1.3 1,-0.2 -12,-0.1 0.754 123.9 53.6 -62.5 -25.7 17.9 -10.5 20.9 272 275 A H H > S+ 0 0 20 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.898 110.3 47.8 -75.4 -35.5 20.4 -11.9 18.3 273 276 A E H > S+ 0 0 91 -3,-0.3 4,-3.0 1,-0.2 -2,-0.2 0.906 111.2 49.7 -70.1 -38.3 19.6 -15.5 19.4 274 277 A T H X S+ 0 0 15 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.815 108.1 54.7 -69.0 -32.2 15.8 -14.8 19.3 275 278 A T H X S+ 0 0 4 -4,-1.3 4,-2.4 -5,-0.2 -2,-0.2 0.963 112.7 42.2 -62.1 -51.6 16.1 -13.4 15.8 276 279 A Y H X S+ 0 0 58 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.934 113.8 51.7 -60.1 -46.9 17.9 -16.5 14.6 277 280 A N H < S+ 0 0 66 -4,-3.0 4,-0.4 1,-0.2 -1,-0.2 0.851 110.2 50.1 -61.0 -35.9 15.4 -18.8 16.5 278 281 A S H >< S+ 0 0 0 -4,-2.2 3,-1.5 2,-0.2 -1,-0.2 0.944 109.3 49.8 -67.2 -45.3 12.5 -16.9 14.9 279 282 A I H >< S+ 0 0 0 -4,-2.4 3,-1.7 1,-0.3 -2,-0.2 0.901 107.6 56.0 -61.9 -34.7 13.9 -17.3 11.3 280 283 A M T 3< S+ 0 0 74 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.502 99.1 59.6 -77.4 -6.7 14.4 -21.0 12.0 281 284 A K T < S+ 0 0 117 -3,-1.5 -1,-0.3 -4,-0.4 2,-0.2 0.360 96.5 84.2 -95.9 2.0 10.7 -21.5 12.8 282 285 A C S < S- 0 0 5 -3,-1.7 5,-0.1 -4,-0.2 -3,-0.0 -0.663 99.5 -75.6-102.7 163.8 9.9 -20.2 9.3 283 286 A D >> - 0 0 99 -2,-0.2 3,-2.4 1,-0.1 4,-0.8 -0.234 40.9-126.5 -55.3 132.9 9.7 -22.1 6.1 284 287 A I G >4 S+ 0 0 111 1,-0.3 3,-0.8 2,-0.2 4,-0.5 0.845 106.9 63.3 -51.6 -35.2 13.2 -22.7 4.8 285 288 A D G 34 S+ 0 0 133 1,-0.2 -1,-0.3 2,-0.1 4,-0.2 0.548 104.9 43.3 -72.0 -11.9 12.3 -21.1 1.5 286 289 A I G <> S+ 0 0 19 -3,-2.4 4,-1.7 -7,-0.1 3,-0.4 0.505 87.6 91.2-108.7 -0.3 11.6 -17.7 3.0 287 290 A R H S+ 0 0 144 -4,-0.5 4,-1.7 1,-0.2 -1,-0.2 0.927 107.4 49.9 -57.9 -38.6 16.9 -15.8 2.7 289 292 A D H 4 S+ 0 0 66 -3,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.845 112.1 48.1 -68.0 -36.7 14.3 -13.0 2.4 290 293 A L H >< S+ 0 0 0 -4,-1.7 3,-1.7 1,-0.2 -142,-0.5 0.929 109.1 52.3 -68.1 -45.6 14.2 -12.6 6.2 291 294 A Y H 3< S+ 0 0 2 -4,-2.9 34,-2.2 1,-0.3 3,-0.4 0.848 111.4 47.1 -59.7 -30.0 18.0 -12.6 6.6 292 295 A A T 3< S+ 0 0 17 -4,-1.7 -1,-0.3 32,-0.3 -2,-0.2 0.350 115.1 47.2 -91.8 1.5 18.3 -9.8 4.1 293 296 A N < + 0 0 35 -3,-1.7 -145,-2.5 -4,-0.1 2,-0.8 -0.380 63.4 153.8-138.3 57.4 15.5 -7.7 5.6 294 297 A N E -jm 148 326D 11 31,-2.2 33,-3.5 -3,-0.4 2,-0.5 -0.823 26.6-166.4 -88.3 109.5 16.0 -7.5 9.4 295 298 A V E -jm 149 327D 2 -147,-2.2 -145,-2.9 -2,-0.8 2,-0.4 -0.878 9.0-147.1-105.9 127.2 14.3 -4.2 10.4 296 299 A M E +j 150 0D 3 31,-2.9 2,-0.3 -2,-0.5 -145,-0.2 -0.785 24.0 169.2 -90.3 137.9 14.9 -2.6 13.7 297 300 A S E +j 151 0D 0 -147,-2.9 -145,-2.3 -2,-0.4 36,-0.2 -0.984 27.1 50.6-145.0 154.3 12.1 -0.7 15.4 298 301 A G S > S- 0 0 9 34,-2.5 3,-1.7 -2,-0.3 -145,-0.2 -0.047 84.3 -77.6 104.8 157.8 11.3 0.9 18.7 299 302 A G G > S+ 0 0 37 34,-0.3 3,-1.5 1,-0.3 -146,-0.2 0.825 123.6 59.4 -61.2 -35.5 13.0 3.3 21.1 300 303 A T G 3 S+ 0 0 7 -148,-2.0 3,-0.4 1,-0.3 -1,-0.3 0.536 96.8 62.8 -78.6 -1.7 15.3 0.7 22.6 301 304 A T G < S+ 0 0 0 -3,-1.7 -1,-0.3 -149,-0.6 -2,-0.2 0.391 78.1 92.8 -97.4 11.3 16.8 0.0 19.1 302 305 A M < + 0 0 72 -3,-1.5 -1,-0.2 -4,-0.2 -2,-0.1 0.664 53.1 120.0 -79.4 -11.7 18.1 3.6 19.0 303 306 A Y S > S- 0 0 14 -3,-0.4 3,-1.8 -4,-0.1 4,-0.3 -0.227 70.9-114.2 -59.5 131.3 21.5 2.9 20.4 304 307 A P T 3 S+ 0 0 87 0, 0.0 -88,-3.0 0, 0.0 -1,-0.1 -0.328 102.9 28.2 -54.8 138.5 24.5 3.7 18.2 305 308 A G T 3> S+ 0 0 33 -90,-0.2 4,-2.3 -3,-0.1 5,-0.2 0.255 85.2 111.5 93.5 -16.6 26.2 0.5 17.2 306 309 A I H <> S+ 0 0 2 -3,-1.8 4,-2.5 2,-0.2 5,-0.2 0.888 76.3 50.0 -62.2 -41.7 23.2 -1.8 17.4 307 310 A A H > S+ 0 0 27 -4,-0.3 4,-2.7 2,-0.2 -1,-0.2 0.926 112.3 47.3 -64.8 -40.9 22.9 -2.5 13.7 308 311 A D H > S+ 0 0 112 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.874 112.9 48.8 -67.2 -37.9 26.6 -3.4 13.4 309 312 A R H X S+ 0 0 9 -4,-2.3 4,-2.7 2,-0.2 -1,-0.2 0.936 111.7 48.8 -66.3 -44.4 26.4 -5.6 16.4 310 313 A M H X S+ 0 0 6 -4,-2.5 4,-2.8 1,-0.2 5,-0.3 0.919 109.6 53.2 -60.9 -40.2 23.3 -7.4 15.1 311 314 A Q H X S+ 0 0 61 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.947 111.9 46.0 -58.7 -44.9 25.0 -7.8 11.7 312 315 A K H X S+ 0 0 70 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.927 115.3 44.6 -64.4 -46.9 28.0 -9.5 13.4 313 316 A E H X S+ 0 0 35 -4,-2.7 4,-1.2 2,-0.2 -2,-0.2 0.924 114.6 47.3 -68.5 -41.4 25.9 -11.8 15.7 314 317 A I H >X S+ 0 0 0 -4,-2.8 4,-2.5 -5,-0.2 3,-0.6 0.920 109.5 54.5 -66.6 -39.6 23.5 -12.9 12.9 315 318 A T H 3< S+ 0 0 75 -4,-2.4 -1,-0.2 -5,-0.3 -2,-0.2 0.887 106.1 53.5 -58.7 -40.9 26.4 -13.5 10.6 316 319 A A H 3< S+ 0 0 82 -4,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.807 115.2 39.1 -65.4 -29.5 27.9 -15.8 13.2 317 320 A L H << S+ 0 0 62 -4,-1.2 -2,-0.2 -3,-0.6 -1,-0.2 0.771 104.4 77.2 -90.0 -29.0 24.7 -17.9 13.5 318 321 A A S < S- 0 0 13 -4,-2.5 6,-0.0 1,-0.2 -42,-0.0 -0.344 94.6 -79.7 -83.6 160.6 23.7 -18.1 9.9 319 322 A P > - 0 0 71 0, 0.0 3,-1.9 0, 0.0 -1,-0.2 -0.219 46.3-112.5 -51.9 145.9 25.0 -20.2 7.1 320 323 A S T 3 S+ 0 0 130 1,-0.3 -2,-0.1 -3,-0.1 -3,-0.0 0.722 113.4 49.1 -56.7 -30.1 28.2 -18.9 5.5 321 324 A T T 3 S+ 0 0 129 2,-0.1 2,-0.3 0, 0.0 -1,-0.3 0.399 83.7 120.4 -94.8 7.4 26.7 -18.0 2.1 322 325 A M < - 0 0 47 -3,-1.9 2,-0.5 -7,-0.1 -4,-0.1 -0.549 61.4-135.3 -77.1 128.8 23.7 -16.1 3.6 323 326 A K - 0 0 128 -2,-0.3 2,-0.4 2,-0.0 -2,-0.1 -0.717 27.3-168.1 -78.4 120.3 23.3 -12.4 2.7 324 327 A I + 0 0 18 -2,-0.5 2,-0.4 -32,-0.1 -32,-0.3 -0.949 10.9 175.0-116.4 133.8 22.5 -10.6 5.9 325 328 A K - 0 0 94 -34,-2.2 -31,-2.2 -2,-0.4 2,-0.5 -0.987 14.9-159.4-141.9 131.1 21.2 -7.0 6.1 326 329 A I E -m 294 0D 24 -2,-0.4 2,-0.5 -33,-0.2 -31,-0.2 -0.936 8.8-159.8-109.4 127.9 20.1 -5.0 9.1 327 330 A I E +m 295 0D 21 -33,-3.5 -31,-2.9 -2,-0.5 -2,-0.0 -0.955 13.5 174.7-109.2 120.7 17.9 -1.9 8.3 328 331 A A - 0 0 31 -2,-0.5 -31,-0.1 -33,-0.2 -21,-0.1 -0.725 19.1-153.1-130.2 87.2 17.8 0.7 11.1 329 332 A P > - 0 0 26 0, 0.0 3,-2.0 0, 0.0 4,-0.1 -0.190 19.7-125.2 -61.5 146.0 15.8 3.7 10.0 330 333 A P T 3 S+ 0 0 112 0, 0.0 3,-0.4 0, 0.0 0, 0.0 0.848 111.2 49.3 -59.0 -32.7 16.6 7.0 11.6 331 334 A E T > S+ 0 0 122 1,-0.2 3,-2.3 2,-0.1 7,-0.2 0.212 73.9 122.0 -94.1 17.5 13.0 7.5 12.6 332 335 A R G X + 0 0 26 -3,-2.0 -34,-2.5 1,-0.3 3,-0.8 0.667 57.4 72.8 -63.1 -15.5 12.6 4.1 14.1 333 336 A K G 3 S+ 0 0 87 -3,-0.4 -34,-0.3 1,-0.2 -1,-0.3 0.748 117.0 24.1 -62.0 -27.9 11.6 5.4 17.6 334 337 A Y G <> S+ 0 0 64 -3,-2.3 4,-2.8 -36,-0.1 -1,-0.2 0.179 86.3 117.2-122.2 20.8 8.3 6.2 15.9 335 338 A S H <> S+ 0 0 7 -3,-0.8 4,-2.9 1,-0.2 5,-0.2 0.855 75.6 55.1 -68.0 -28.3 8.2 3.8 13.0 336 339 A V H > S+ 0 0 11 -4,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.963 112.6 42.8 -61.6 -48.4 5.1 2.0 14.3 337 340 A W H > S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.933 114.0 51.9 -61.8 -43.9 3.2 5.3 14.4 338 341 A I H X S+ 0 0 20 -4,-2.8 4,-2.7 1,-0.2 5,-0.2 0.928 107.5 51.3 -60.6 -43.3 4.6 6.3 11.0 339 342 A G H X S+ 0 0 0 -4,-2.9 4,-2.2 1,-0.2 -1,-0.2 0.900 111.3 48.9 -59.6 -41.0 3.5 3.1 9.4 340 343 A G H X S+ 0 0 0 -4,-2.0 4,-2.8 -5,-0.2 -1,-0.2 0.905 109.7 52.1 -61.5 -45.7 0.1 3.7 10.8 341 344 A S H X S+ 0 0 7 -4,-2.6 4,-1.5 2,-0.2 -2,-0.2 0.913 109.9 48.7 -57.1 -42.5 0.1 7.2 9.5 342 345 A I H < S+ 0 0 75 -4,-2.7 3,-0.5 2,-0.2 4,-0.4 0.975 115.5 44.0 -64.4 -44.5 1.0 6.0 5.9 343 346 A L H >< S+ 0 0 52 -4,-2.2 3,-1.7 1,-0.2 -2,-0.2 0.960 113.5 48.9 -66.0 -49.5 -1.7 3.4 6.0 344 347 A A H 3< S+ 0 0 10 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.725 105.5 58.6 -68.9 -16.8 -4.4 5.6 7.4 345 348 A S T 3< S+ 0 0 58 -4,-1.5 2,-1.7 -3,-0.5 -1,-0.3 0.432 77.0 101.1 -91.4 0.7 -3.7 8.4 4.9 346 349 A L X + 0 0 71 -3,-1.7 3,-1.8 -4,-0.4 -1,-0.1 -0.569 44.8 171.9 -88.7 80.9 -4.4 6.1 1.9 347 350 A S G > S+ 0 0 77 -2,-1.7 3,-1.8 1,-0.3 -1,-0.2 0.715 70.1 72.0 -65.6 -19.4 -7.9 7.4 1.2 348 351 A T G 3 S+ 0 0 121 1,-0.3 3,-0.4 -3,-0.2 -1,-0.3 0.836 101.4 47.6 -60.4 -29.5 -8.0 5.4 -2.0 349 352 A F G X S+ 0 0 128 -3,-1.8 3,-2.6 1,-0.2 4,-0.4 0.080 73.1 127.2 -99.6 29.6 -8.3 2.4 0.4 350 353 A Q G X + 0 0 127 -3,-1.8 3,-1.4 1,-0.3 -1,-0.2 0.796 62.1 69.5 -62.4 -23.8 -11.0 4.1 2.5 351 354 A Q G 3 S+ 0 0 143 -3,-0.4 -1,-0.3 1,-0.2 4,-0.1 0.739 85.6 70.0 -65.9 -18.5 -13.2 1.0 2.1 352 355 A M G < S+ 0 0 83 -3,-2.6 -1,-0.2 2,-0.1 -2,-0.2 0.731 77.5 96.5 -72.1 -18.8 -10.7 -1.0 4.4 353 356 A W S < S- 0 0 36 -3,-1.4 2,-0.6 -4,-0.4 -223,-0.2 -0.429 81.6-126.1 -61.3 150.1 -11.8 1.1 7.4 354 357 A I E -E 129 0A 14 -225,-3.0 -225,-2.2 4,-0.0 2,-0.1 -0.873 31.5-150.7 -93.1 115.4 -14.5 -0.8 9.5 355 358 A T E > -E 128 0A 50 -2,-0.6 4,-2.3 -227,-0.2 -227,-0.3 -0.481 24.9-110.0 -85.6 165.5 -17.4 1.7 9.7 356 359 A K H > S+ 0 0 54 -229,-2.2 4,-2.1 1,-0.2 5,-0.2 0.902 120.1 53.5 -60.0 -36.0 -19.9 1.9 12.6 357 360 A Q H > S+ 0 0 135 -230,-0.3 4,-1.9 1,-0.2 -1,-0.2 0.901 107.8 49.7 -66.9 -39.3 -22.6 0.6 10.2 358 361 A E H > S+ 0 0 77 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.927 110.7 49.7 -64.7 -39.4 -20.5 -2.5 9.3 359 362 A Y H X S+ 0 0 19 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.898 110.3 50.4 -64.2 -41.0 -19.8 -3.2 12.9 360 363 A D H < S+ 0 0 105 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.858 117.2 40.6 -65.3 -35.7 -23.4 -3.0 13.8 361 364 A E H < S+ 0 0 156 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.811 124.4 32.8 -84.4 -31.4 -24.4 -5.3 11.0 362 365 A A H < S- 0 0 52 -4,-2.7 3,-0.3 1,-0.2 -3,-0.2 0.670 95.3-138.8-103.4 -19.7 -21.6 -7.9 11.2 363 366 A G >< - 0 0 22 -4,-2.0 3,-0.8 -5,-0.3 -1,-0.2 -0.437 47.8 -44.0 93.2-169.0 -20.7 -8.2 14.9 364 367 A P G > S+ 0 0 59 0, 0.0 3,-1.4 0, 0.0 4,-0.2 0.741 122.4 74.2 -74.3 -24.0 -17.3 -8.4 16.6 365 368 A S G > S+ 0 0 79 -3,-0.3 3,-1.1 1,-0.3 -2,-0.1 0.715 79.4 79.6 -64.3 -17.9 -15.9 -11.0 14.2 366 369 A I G < S+ 0 0 51 -3,-0.8 -1,-0.3 1,-0.2 -3,-0.1 0.639 77.5 66.3 -66.1 -19.4 -15.6 -8.3 11.6 367 370 A V G < S+ 0 0 8 -3,-1.4 -1,-0.2 -4,-0.1 -236,-0.2 0.627 89.6 83.3 -82.9 -9.5 -12.3 -6.7 12.9 368 371 A H < 0 0 27 -3,-1.1 -258,-0.0 -4,-0.2 -3,-0.0 -0.560 360.0 360.0 -92.5 154.9 -10.3 -9.8 12.1 369 372 A R 0 0 238 -2,-0.2 -1,-0.2 0, 0.0 -2,-0.0 0.847 360.0 360.0 41.4 360.0 -8.7 -10.9 8.8