==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-JUN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PROTEIN BINDING 10-FEB-11 3QOU . COMPND 2 MOLECULE: PROTEIN YBBN; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR J.LIN,M.A.WILSON . 282 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16687.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 216 76.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 11 3.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 14 5.0 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 17 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 141 50.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 2.5 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 0 0 1 0 0 2 1 3 4 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 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 PARALLEL BRIDGES PER LADDER . 0 0 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 3 A V > 0 0 158 0, 0.0 3,-2.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 22.2 17.4 28.9 43.4 2 4 A E T 3 - 0 0 127 1,-0.3 49,-0.2 46,-0.1 50,-0.1 0.552 360.0 -80.2 56.5 8.6 18.3 31.3 40.6 3 5 A N T 3 S+ 0 0 35 1,-0.2 53,-1.7 48,-0.1 2,-0.5 0.582 105.1 119.9 74.4 13.4 21.1 28.8 40.1 4 6 A I E < -a 56 0A 26 -3,-2.2 2,-0.5 51,-0.2 -1,-0.2 -0.942 41.1-173.0-110.9 125.6 23.1 30.5 42.9 5 7 A V E -a 57 0A 34 51,-2.2 53,-2.3 -2,-0.5 2,-0.6 -0.977 19.8-142.1-117.0 127.1 24.2 28.5 46.0 6 8 A N E -a 58 0A 106 -2,-0.5 2,-0.3 51,-0.2 53,-0.2 -0.775 31.2-132.9 -74.1 123.6 25.8 29.9 49.1 7 9 A I + 0 0 8 51,-3.6 53,-0.4 -2,-0.6 2,-0.2 -0.638 38.5 150.3 -86.3 136.7 28.3 27.3 50.1 8 10 A N > - 0 0 54 -2,-0.3 4,-0.7 51,-0.1 3,-0.5 -0.656 61.1 -66.0-139.1-159.1 28.6 26.1 53.7 9 11 A E T 4 S+ 0 0 131 1,-0.2 4,-0.3 -2,-0.2 3,-0.1 0.808 126.2 46.5 -63.3 -31.6 29.5 23.1 55.8 10 12 A S T 4 S+ 0 0 80 1,-0.2 -1,-0.2 2,-0.1 4,-0.1 0.592 116.3 36.5 -96.1 -13.7 26.6 21.0 54.5 11 13 A N T > S+ 0 0 28 -3,-0.5 4,-1.0 2,-0.1 -1,-0.2 0.289 85.7 91.8-127.8 8.9 26.7 21.5 50.7 12 14 A L H X S+ 0 0 28 -4,-0.7 4,-1.8 2,-0.2 3,-0.2 0.944 97.5 36.2 -68.4 -50.4 30.3 21.8 49.7 13 15 A Q H > S+ 0 0 134 -4,-0.3 4,-1.7 2,-0.2 -1,-0.2 0.797 115.0 57.1 -72.7 -29.8 30.8 18.1 49.0 14 16 A Q H 4 S+ 0 0 121 2,-0.2 -1,-0.2 1,-0.2 -2,-0.2 0.725 115.7 36.3 -75.1 -22.7 27.2 17.8 47.5 15 17 A V H X S+ 0 0 11 -4,-1.0 4,-0.8 -3,-0.2 -2,-0.2 0.653 112.1 59.0-100.1 -23.7 28.0 20.6 45.0 16 18 A L H < S+ 0 0 41 -4,-1.8 -2,-0.2 1,-0.2 -3,-0.2 0.829 112.4 41.5 -66.7 -34.7 31.6 19.4 44.5 17 19 A E T < S+ 0 0 121 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.373 108.0 61.5 -93.9 1.3 30.1 16.0 43.4 18 20 A Q T >> S+ 0 0 87 1,-0.1 4,-1.5 2,-0.1 3,-1.1 0.570 86.4 74.0 -94.0 -16.8 27.4 17.9 41.5 19 21 A S T 3< S+ 0 0 0 -4,-0.8 65,-1.9 1,-0.2 66,-0.2 0.505 70.5 95.6 -64.8 -4.9 30.2 19.4 39.4 20 22 A M T 34 S- 0 0 104 64,-0.2 -1,-0.2 63,-0.2 -2,-0.1 0.802 110.8 -2.0 -62.9 -31.0 30.3 16.0 37.8 21 23 A T T <4 S+ 0 0 134 -3,-1.1 -2,-0.2 1,-0.2 -1,-0.2 0.596 128.3 64.9-125.6 -37.6 28.1 17.1 35.0 22 24 A T S < S- 0 0 34 -4,-1.5 -1,-0.2 32,-0.0 32,-0.1 -0.816 85.1-120.6 -93.8 123.6 27.2 20.7 35.7 23 25 A P - 0 0 13 0, 0.0 32,-3.2 0, 0.0 2,-0.5 -0.374 26.9-151.7 -55.7 132.5 30.1 23.3 35.7 24 26 A V E -bC 55 82A 0 58,-3.6 58,-3.7 30,-0.2 2,-1.0 -0.954 8.0-159.0-115.7 120.9 30.4 25.0 39.1 25 27 A L E -bC 56 81A 0 30,-3.9 32,-2.6 -2,-0.5 2,-0.3 -0.813 14.1-155.3 -95.9 95.3 31.8 28.5 39.3 26 28 A F E -bC 57 80A 1 54,-2.5 54,-2.1 -2,-1.0 2,-0.6 -0.560 6.8-160.8 -68.8 129.9 33.0 28.9 42.9 27 29 A Y E -bC 58 79A 0 30,-3.6 32,-3.0 -2,-0.3 2,-0.8 -0.923 5.2-161.0-121.7 104.7 33.1 32.5 43.9 28 30 A F E +bC 59 78A 0 50,-3.4 50,-1.5 -2,-0.6 2,-0.2 -0.769 33.3 155.0 -88.3 109.6 35.2 33.4 46.9 29 31 A W E -b 60 0A 41 30,-1.8 32,-2.8 -2,-0.8 33,-0.3 -0.760 32.6-152.2-134.4 170.0 33.9 36.8 48.0 30 32 A S > - 0 0 8 -2,-0.2 3,-1.5 30,-0.2 6,-0.2 -0.980 23.5-137.3-149.3 138.8 33.6 39.1 51.0 31 33 A E T 3 S+ 0 0 151 -2,-0.3 -1,-0.0 1,-0.2 29,-0.0 0.560 107.6 60.9 -64.4 -8.6 31.1 41.8 52.0 32 34 A R T 3 S+ 0 0 201 4,-0.0 2,-0.4 2,-0.0 -1,-0.2 0.570 86.9 92.7 -91.3 -12.5 34.2 43.8 53.0 33 35 A S <> - 0 0 21 -3,-1.5 4,-1.1 1,-0.1 3,-0.2 -0.714 56.1-158.4-108.0 132.2 35.9 44.0 49.6 34 36 A Q T 4 S+ 0 0 158 -2,-0.4 4,-0.5 1,-0.2 -1,-0.1 0.687 95.6 60.6 -77.7 -19.9 35.6 46.6 46.9 35 37 A H T 4 S+ 0 0 79 41,-0.2 3,-0.4 1,-0.2 4,-0.3 0.825 106.4 47.6 -69.6 -34.2 36.8 44.2 44.1 36 38 A C T >> S+ 0 0 1 -6,-0.2 4,-3.3 -3,-0.2 3,-1.1 0.824 94.4 75.1 -76.0 -32.6 33.7 42.0 44.9 37 39 A L T 3< S+ 0 0 130 -4,-1.1 -1,-0.2 1,-0.3 -2,-0.1 0.783 109.2 29.1 -55.2 -33.0 31.2 44.9 44.9 38 40 A Q T 34 S+ 0 0 121 -4,-0.5 4,-0.3 -3,-0.4 -1,-0.3 0.344 118.7 57.2-112.0 2.7 31.3 45.2 41.1 39 41 A L T <> S+ 0 0 0 -3,-1.1 4,-2.3 -4,-0.3 -2,-0.2 0.782 98.4 60.5 -90.5 -39.3 32.1 41.5 40.4 40 42 A T H X S+ 0 0 24 -4,-3.3 4,-3.0 2,-0.2 5,-0.3 0.910 104.7 46.7 -55.9 -49.7 29.1 40.1 42.2 41 43 A P H > S+ 0 0 63 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.898 114.0 49.1 -61.7 -41.0 26.5 41.9 40.0 42 44 A I H > S+ 0 0 48 -4,-0.3 4,-0.6 1,-0.2 -2,-0.2 0.861 116.3 44.0 -59.8 -38.0 28.4 40.7 36.9 43 45 A L H X S+ 0 0 1 -4,-2.3 4,-1.6 2,-0.2 3,-0.2 0.901 113.3 46.7 -80.2 -43.4 28.5 37.2 38.2 44 46 A E H X S+ 0 0 72 -4,-3.0 4,-2.3 1,-0.2 5,-0.3 0.916 108.6 55.2 -64.0 -45.7 24.9 36.8 39.5 45 47 A S H X S+ 0 0 83 -4,-1.7 4,-0.7 -5,-0.3 -1,-0.2 0.745 109.2 48.4 -65.9 -23.4 23.3 38.2 36.4 46 48 A L H X S+ 0 0 6 -4,-0.6 4,-2.3 -3,-0.2 -1,-0.3 0.821 107.2 56.6 -80.1 -34.9 25.2 35.6 34.3 47 49 A A H X>S+ 0 0 0 -4,-1.6 4,-0.9 1,-0.2 5,-0.5 0.946 113.2 39.4 -57.4 -50.7 24.0 32.9 36.7 48 50 A A H <5S+ 0 0 26 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.756 114.2 56.5 -70.9 -26.2 20.4 33.8 36.1 49 51 A Q H <5S+ 0 0 120 -4,-0.7 -2,-0.2 -5,-0.3 -1,-0.2 0.879 108.6 43.7 -74.5 -39.1 21.0 34.4 32.4 50 52 A Y H <5S- 0 0 27 -4,-2.3 3,-0.3 4,-0.1 -1,-0.2 0.657 95.7-152.2 -82.1 -17.2 22.4 30.9 31.7 51 53 A N T <5S- 0 0 118 -4,-0.9 -3,-0.1 1,-0.2 -48,-0.1 0.907 71.0 -19.7 45.4 70.4 19.7 29.2 33.8 52 54 A G S - b 0 29A 43 -2,-0.6 4,-3.1 -53,-0.4 -30,-0.2 -0.600 10.5-159.1 -68.1 111.0 31.6 33.9 52.0 61 63 A C T 4 S+ 0 0 15 -32,-2.8 -1,-0.2 -2,-0.7 -31,-0.1 0.702 88.8 48.5 -75.7 -23.1 35.2 34.2 53.1 62 64 A D T 4 S+ 0 0 49 -33,-0.3 3,-0.3 1,-0.1 -1,-0.2 0.832 119.9 38.5 -77.3 -36.0 34.5 35.9 56.4 63 65 A A T 4 S+ 0 0 65 1,-0.2 2,-0.5 2,-0.1 -2,-0.2 0.803 122.4 41.0 -84.4 -32.5 31.7 33.4 57.2 64 66 A E X + 0 0 20 -4,-3.1 4,-1.6 1,-0.2 -1,-0.2 -0.663 64.6 149.5-119.7 73.5 33.4 30.3 56.0 65 67 A Q H > S+ 0 0 139 -2,-0.5 4,-2.1 -3,-0.3 5,-0.2 0.840 70.9 53.7 -79.2 -34.6 37.0 30.6 57.0 66 68 A M H > S+ 0 0 125 2,-0.2 4,-1.4 -3,-0.2 -1,-0.2 0.941 112.6 43.2 -62.3 -49.5 37.8 26.9 57.4 67 69 A I H 4 S+ 0 0 10 1,-0.2 4,-0.3 2,-0.2 -2,-0.2 0.879 113.0 52.8 -66.9 -38.1 36.6 26.0 53.9 68 70 A A H ><>S+ 0 0 8 -4,-1.6 5,-1.6 1,-0.2 3,-1.2 0.905 108.3 49.4 -63.7 -44.1 38.3 29.0 52.4 69 71 A A H ><5S+ 0 0 79 -4,-2.1 3,-0.8 1,-0.2 -1,-0.2 0.826 107.3 56.8 -62.3 -32.5 41.7 28.1 53.9 70 72 A Q T 3<5S+ 0 0 134 -4,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.505 100.3 59.0 -79.5 -4.8 41.2 24.5 52.6 71 73 A F T < 5S- 0 0 51 -3,-1.2 -1,-0.2 -4,-0.3 -2,-0.2 0.533 114.4-114.4 -95.5 -10.0 40.9 25.9 49.1 72 74 A G T < 5 - 0 0 55 -3,-0.8 -3,-0.2 -4,-0.4 -2,-0.1 0.695 45.8-170.3 85.4 22.2 44.3 27.5 49.2 73 75 A L < + 0 0 39 -5,-1.6 -1,-0.2 1,-0.1 3,-0.1 -0.198 21.3 164.7 -58.5 127.5 42.8 30.9 49.0 74 76 A R + 0 0 224 1,-0.3 2,-0.3 -3,-0.1 -1,-0.1 0.547 60.6 22.1-121.1 -15.6 45.4 33.7 48.4 75 77 A A S S- 0 0 31 18,-0.0 -1,-0.3 -47,-0.0 -47,-0.1 -0.993 78.3-100.5-150.7 151.2 43.3 36.7 47.3 76 78 A I S S+ 0 0 61 -2,-0.3 -41,-0.2 1,-0.2 -47,-0.1 -0.987 102.4 34.5-115.2 126.1 39.8 38.1 47.5 77 79 A P S S+ 0 0 0 0, 0.0 16,-2.7 0, 0.0 2,-0.4 0.533 76.9 163.1 -82.3 156.1 38.0 37.8 45.2 78 80 A T E -CD 28 92A 0 -50,-1.5 -50,-3.4 14,-0.2 2,-0.4 -0.996 16.1-166.0-129.5 134.5 38.9 34.5 43.7 79 81 A V E -CD 27 91A 0 12,-2.6 12,-1.9 -2,-0.4 2,-0.4 -0.974 6.1-173.7-115.1 133.0 36.8 32.5 41.2 80 82 A Y E -CD 26 90A 83 -54,-2.1 -54,-2.5 -2,-0.4 2,-0.5 -0.987 18.7-137.1-125.2 138.8 37.5 28.9 40.4 81 83 A L E -CD 25 89A 0 8,-4.0 7,-2.4 -2,-0.4 8,-0.8 -0.819 21.9-166.3 -95.0 125.3 35.8 26.8 37.8 82 84 A F E +CD 24 87A 14 -58,-3.7 -58,-3.6 -2,-0.5 2,-0.3 -0.949 19.1 147.7-119.7 123.3 34.9 23.2 38.9 83 85 A Q E > + D 0 86A 41 3,-2.6 3,-2.7 -2,-0.5 -63,-0.2 -0.972 64.1 19.5-147.8 160.8 33.8 20.4 36.6 84 86 A N T 3 S- 0 0 111 -65,-1.9 -64,-0.2 -2,-0.3 -1,-0.1 0.753 131.1 -65.2 47.5 26.2 34.2 16.6 36.6 85 87 A G T 3 S+ 0 0 14 1,-0.2 -1,-0.3 -66,-0.2 -65,-0.1 0.184 118.4 96.5 91.4 -15.9 34.9 17.0 40.4 86 88 A Q E < S-D 83 0A 125 -3,-2.7 -3,-2.6 -67,-0.2 2,-0.2 -0.732 78.6-109.3-118.0 151.1 38.1 19.0 39.7 87 89 A P E +D 82 0A 71 0, 0.0 -5,-0.2 0, 0.0 3,-0.1 -0.595 37.5 166.8 -73.2 140.5 39.3 22.6 39.4 88 90 A V E - 0 0 56 -7,-2.4 2,-0.3 1,-0.5 -6,-0.1 0.514 57.2 -10.3-135.2 -16.7 40.1 23.5 35.8 89 91 A D E +D 81 0A 58 -8,-0.8 -8,-4.0 2,-0.0 -1,-0.5 -0.955 62.5 131.2-176.8 167.1 40.5 27.3 35.6 90 92 A G E -D 80 0A 17 -2,-0.3 2,-0.3 -10,-0.3 -10,-0.2 -0.949 27.1-138.1 171.1-155.0 39.9 30.5 37.5 91 93 A F E -D 79 0A 33 -12,-1.9 -12,-2.6 -2,-0.3 2,-0.4 -0.891 14.1-119.4 174.9 157.9 41.6 33.8 38.6 92 94 A Q E S+D 78 0A 100 -2,-0.3 -14,-0.2 -14,-0.2 -16,-0.1 -0.940 72.2 33.2-114.7 147.2 42.0 36.3 41.4 93 95 A G S S- 0 0 14 -16,-2.7 2,-0.2 -2,-0.4 -14,-0.1 -0.382 94.1 -57.4 103.1 172.6 40.9 39.9 41.2 94 96 A P - 0 0 48 0, 0.0 -58,-0.1 0, 0.0 -2,-0.1 -0.612 57.1-177.9 -90.5 155.2 38.0 41.7 39.5 95 97 A Q - 0 0 57 -2,-0.2 -2,-0.0 -60,-0.2 5,-0.0 -0.979 29.5 -85.2-154.3 156.1 37.5 41.4 35.8 96 98 A P > - 0 0 83 0, 0.0 4,-1.3 0, 0.0 3,-0.5 -0.183 43.6-111.4 -61.2 157.9 35.4 42.5 32.7 97 99 A E H > S+ 0 0 86 1,-0.2 4,-1.1 2,-0.2 -58,-0.0 0.763 117.2 53.7 -65.6 -27.9 32.2 40.6 31.8 98 100 A E H > S+ 0 0 137 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.744 100.2 60.4 -82.7 -25.1 33.8 39.2 28.6 99 101 A A H > S+ 0 0 35 -3,-0.5 4,-1.9 2,-0.2 -2,-0.2 0.930 106.0 48.4 -57.8 -47.4 36.8 37.8 30.5 100 102 A I H X S+ 0 0 0 -4,-1.3 4,-2.7 2,-0.2 -2,-0.2 0.827 109.3 53.5 -65.8 -33.6 34.3 35.7 32.5 101 103 A R H X S+ 0 0 70 -4,-1.1 4,-4.6 2,-0.2 5,-0.3 0.994 102.9 55.4 -59.3 -64.6 32.6 34.6 29.3 102 104 A A H X S+ 0 0 59 -4,-2.5 4,-0.9 1,-0.2 -2,-0.2 0.863 111.8 46.5 -30.9 -55.4 36.0 33.5 27.8 103 105 A L H >X S+ 0 0 9 -4,-1.9 3,-0.8 1,-0.2 4,-0.6 0.973 119.9 37.5 -50.5 -61.4 36.2 31.3 31.0 104 106 A L H >X S+ 0 0 0 -4,-2.7 4,-1.8 1,-0.2 3,-0.9 0.860 104.4 71.0 -63.4 -37.4 32.6 30.0 30.7 105 107 A D H 3< S+ 0 0 102 -4,-4.6 -1,-0.2 1,-0.3 -2,-0.2 0.742 94.6 54.4 -55.6 -30.1 32.7 29.8 26.9 106 108 A X H << S+ 0 0 164 -4,-0.9 -1,-0.3 -3,-0.8 -2,-0.2 0.878 116.2 33.9 -70.5 -40.5 35.1 26.8 26.9 107 109 A V H << S+ 0 0 27 -3,-0.9 -2,-0.2 -4,-0.6 -1,-0.2 0.634 96.1 93.6 -97.1 -17.8 33.0 24.5 29.2 108 110 A L S < S- 0 0 17 -4,-1.8 -54,-0.1 1,-0.1 -55,-0.0 -0.562 83.3-102.8 -84.8 141.0 29.5 25.5 28.2 109 111 A P - 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0 0 68 -6,-0.5 4,-2.4 -7,-0.2 -1,-0.2 -0.264 17.8-128.2 -50.0 133.6 25.5 16.5 12.6 146 148 A G H > S+ 0 0 2 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.860 103.7 52.1 -61.3 -41.0 24.2 12.9 12.4 147 149 A E H > S+ 0 0 138 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.922 113.6 43.3 -66.7 -39.2 22.8 12.6 15.9 148 150 A I H > S+ 0 0 9 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.883 108.6 61.5 -68.9 -36.1 20.8 15.7 15.6 149 151 A G H X S+ 0 0 0 -4,-2.4 4,-2.9 1,-0.2 -2,-0.2 0.910 101.1 53.2 -51.7 -46.1 19.8 14.5 12.1 150 152 A L H X S+ 0 0 18 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.898 109.4 47.3 -58.9 -42.9 18.2 11.4 13.8 151 153 A L H X S+ 0 0 29 -4,-1.3 4,-2.2 2,-0.2 -1,-0.2 0.905 112.7 49.4 -62.5 -44.4 16.1 13.6 16.1 152 154 A L H X S+ 0 0 0 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.932 111.4 49.0 -62.8 -46.1 15.0 15.9 13.3 153 155 A A H X S+ 0 0 0 -4,-2.9 4,-2.5 1,-0.2 -2,-0.2 0.930 111.1 48.9 -62.0 -46.3 14.0 12.9 11.1 154 156 A E H X S+ 0 0 42 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.908 112.2 50.0 -57.3 -40.6 12.0 11.3 14.0 155 157 A T H X S+ 0 0 0 -4,-2.2 4,-1.5 2,-0.2 -2,-0.2 0.919 109.6 50.1 -67.7 -44.1 10.2 14.7 14.6 156 158 A L H <>S+ 0 0 2 -4,-2.7 5,-3.0 1,-0.2 -1,-0.2 0.903 109.2 52.5 -59.5 -44.4 9.4 15.1 10.8 157 159 A I H ><5S+ 0 0 23 -4,-2.5 3,-1.9 1,-0.2 5,-0.2 0.918 107.3 51.0 -54.0 -47.0 7.9 11.6 10.8 158 160 A A H 3<5S+ 0 0 51 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.816 108.0 54.2 -65.5 -28.6 5.7 12.3 13.8 159 161 A L T 3<5S- 0 0 48 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.237 121.9-108.4 -87.8 12.8 4.5 15.5 12.0 160 162 A N T < 5S+ 0 0 138 -3,-1.9 -3,-0.2 1,-0.1 3,-0.2 0.856 85.2 124.3 63.0 35.7 3.5 13.4 8.9 161 163 A R >< + 0 0 92 -5,-3.0 4,-2.2 -8,-0.1 3,-0.2 -0.429 19.6 149.8-117.3 57.3 6.4 14.7 6.9 162 164 A S H > + 0 0 18 1,-0.2 4,-2.9 -5,-0.2 5,-0.2 0.802 69.1 57.5 -61.7 -33.5 8.0 11.4 6.0 163 165 A E H > S+ 0 0 59 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.939 110.3 43.7 -64.8 -44.6 9.4 12.7 2.6 164 166 A D H > S+ 0 0 57 -3,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.888 113.5 52.6 -62.0 -41.9 11.3 15.5 4.5 165 167 A A H X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.919 107.0 52.3 -60.8 -44.5 12.4 12.9 7.1 166 168 A E H X S+ 0 0 31 -4,-2.9 4,-1.9 1,-0.2 -1,-0.2 0.904 106.2 53.1 -59.5 -41.3 13.7 10.6 4.4 167 169 A A H < S+ 0 0 54 -4,-1.9 4,-0.4 1,-0.2 -1,-0.2 0.905 111.0 47.3 -60.3 -41.4 15.8 13.5 2.9 168 170 A V H >< S+ 0 0 5 -4,-1.8 3,-1.4 1,-0.2 4,-0.3 0.905 108.7 54.4 -66.7 -41.1 17.3 14.1 6.4 169 171 A L H >< S+ 0 0 9 -4,-2.6 3,-1.6 1,-0.3 -1,-0.2 0.843 98.1 64.1 -62.6 -33.8 18.0 10.3 6.8 170 172 A X T 3< S+ 0 0 194 -4,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.717 100.6 54.5 -58.3 -21.9 19.9 10.3 3.5 171 173 A T T < S+ 0 0 51 -3,-1.4 -1,-0.2 -4,-0.4 -2,-0.2 0.476 77.2 115.1 -90.2 -5.9 22.4 12.7 5.1 172 174 A I S < S- 0 0 5 -3,-1.6 -27,-0.1 -4,-0.3 5,-0.1 -0.527 70.6-118.9 -75.2 123.6 23.3 10.5 8.2 173 175 A P > - 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0 0 29 -2,-1.1 4,-2.7 1,-0.1 5,-0.2 -0.255 40.5-119.7 -79.1 155.3 -0.1 -0.3 -4.2 198 200 A P H > S+ 0 0 86 0, 0.0 4,-1.7 0, 0.0 5,-0.2 0.885 116.2 50.9 -54.5 -39.5 -0.8 -2.8 -7.0 199 201 A E H > S+ 0 0 123 2,-0.2 4,-1.6 1,-0.2 5,-0.1 0.878 111.1 47.4 -67.4 -40.5 -3.2 -0.3 -8.6 200 202 A I H > S+ 0 0 0 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.924 109.3 54.5 -65.4 -44.3 -0.6 2.5 -8.5 201 203 A Q H X S+ 0 0 85 -4,-2.7 4,-1.8 1,-0.2 -2,-0.2 0.874 109.7 45.8 -57.2 -40.0 2.0 0.3 -9.9 202 204 A Q H X S+ 0 0 124 -4,-1.7 4,-1.5 2,-0.2 -1,-0.2 0.818 113.9 48.5 -79.3 -29.0 -0.1 -0.7 -13.0 203 205 A L H X S+ 0 0 24 -4,-1.6 4,-2.1 2,-0.2 -2,-0.2 0.867 109.1 54.2 -69.0 -39.9 -1.1 3.0 -13.5 204 206 A Q H X S+ 0 0 67 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.895 109.6 47.9 -63.3 -41.1 2.5 4.0 -13.3 205 207 A Q H X S+ 0 0 94 -4,-1.8 4,-1.9 -5,-0.2 -1,-0.2 0.916 110.8 50.7 -60.7 -43.7 3.4 1.5 -16.0 206 208 A Q H X S+ 0 0 80 -4,-1.5 4,-0.9 1,-0.2 -2,-0.2 0.819 110.9 48.6 -68.9 -29.4 0.6 2.8 -18.1 207 209 A V H < S+ 0 0 22 -4,-2.1 3,-0.2 2,-0.2 -1,-0.2 0.887 107.5 55.0 -74.6 -42.4 1.7 6.4 -17.7 208 210 A A H < S+ 0 0 68 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.878 110.7 47.2 -51.3 -42.1 5.3 5.4 -18.6 209 211 A E H < S+ 0 0 137 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.738 127.5 24.7 -74.3 -26.6 3.9 3.8 -21.8 210 212 A N >< + 0 0 78 -4,-0.9 3,-1.9 -3,-0.2 -1,-0.2 -0.514 68.1 167.6-139.9 67.5 1.8 6.9 -22.7 211 213 A P T 3 S+ 0 0 70 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.616 74.9 58.7 -65.5 -12.6 3.4 9.9 -21.1 212 214 A E T 3 S+ 0 0 126 -5,-0.0 2,-1.0 4,-0.0 3,-0.1 0.607 76.1 104.0 -86.8 -11.5 1.3 12.4 -23.1 213 215 A D <> - 0 0 60 -3,-1.9 4,-1.9 -6,-0.2 5,-0.1 -0.596 47.4-177.1 -79.3 104.0 -2.1 11.0 -21.9 214 216 A A H > S+ 0 0 13 -2,-1.0 4,-2.1 1,-0.2 -1,-0.2 0.838 79.8 57.7 -72.1 -33.5 -3.2 13.6 -19.3 215 217 A A H > S+ 0 0 43 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.891 108.5 47.0 -64.9 -38.4 -6.3 11.7 -18.4 216 218 A L H > S+ 0 0 20 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.942 111.9 49.0 -64.2 -50.9 -4.2 8.7 -17.4 217 219 A A H X S+ 0 0 0 -4,-1.9 4,-2.7 1,-0.2 -2,-0.2 0.838 109.2 54.1 -59.7 -34.2 -1.8 10.8 -15.4 218 220 A T H X S+ 0 0 7 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.909 107.1 50.0 -68.7 -42.3 -4.7 12.4 -13.7 219 221 A Q H X S+ 0 0 107 -4,-1.8 4,-1.8 2,-0.2 -2,-0.2 0.951 113.7 46.6 -54.6 -53.0 -6.1 9.0 -12.6 220 222 A L H X S+ 0 0 9 -4,-2.6 4,-2.3 1,-0.2 5,-0.2 0.902 108.6 54.3 -58.3 -45.5 -2.7 8.1 -11.3 221 223 A A H X S+ 0 0 0 -4,-2.7 4,-2.7 1,-0.2 -1,-0.2 0.902 107.1 52.7 -59.1 -38.9 -2.3 11.4 -9.5 222 224 A L H X S+ 0 0 60 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.931 110.5 45.6 -59.7 -45.6 -5.6 10.8 -7.7 223 225 A Q H X S+ 0 0 68 -4,-1.8 4,-0.6 2,-0.2 -2,-0.2 0.795 112.2 52.2 -72.1 -30.0 -4.5 7.3 -6.5 224 226 A L H ><>S+ 0 0 5 -4,-2.3 5,-2.5 2,-0.2 3,-1.1 0.923 109.8 49.4 -65.7 -47.5 -1.1 8.7 -5.4 225 227 A H H ><5S+ 0 0 39 -4,-2.7 3,-1.8 1,-0.2 -2,-0.2 0.904 103.3 60.8 -57.2 -40.3 -2.9 11.5 -3.4 226 228 A Q H 3<5S+ 0 0 115 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.710 108.7 42.2 -67.1 -18.4 -5.2 8.9 -1.8 227 229 A V T <<5S- 0 0 55 -3,-1.1 -1,-0.3 -4,-0.6 -2,-0.2 0.199 124.8 -99.6-110.6 13.1 -2.1 7.1 -0.2 228 230 A G T < 5S+ 0 0 33 -3,-1.8 2,-1.7 -4,-0.2 3,-0.3 0.551 81.4 133.3 89.0 8.5 -0.4 10.4 0.8 229 231 A R >< + 0 0 36 -5,-2.5 4,-1.9 1,-0.2 -1,-0.1 -0.481 21.5 146.4 -86.5 69.2 2.0 10.6 -2.1 230 232 A N H > + 0 0 23 -2,-1.7 4,-3.1 2,-0.2 5,-0.3 0.810 59.9 60.3 -82.3 -32.1 1.2 14.2 -2.7 231 233 A E H > S+ 0 0 82 -3,-0.3 4,-1.9 1,-0.2 -1,-0.2 0.941 113.8 41.0 -59.3 -44.3 4.6 15.5 -3.8 232 234 A E H > S+ 0 0 80 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.918 115.0 50.6 -70.2 -43.2 4.4 13.0 -6.7 233 235 A A H X S+ 0 0 0 -4,-1.9 4,-2.2 1,-0.2 5,-0.2 0.936 115.1 41.6 -61.1 -50.1 0.7 13.6 -7.4 234 236 A L H X S+ 0 0 0 -4,-3.1 4,-2.6 2,-0.2 5,-0.2 0.878 113.1 52.4 -67.5 -37.9 1.0 17.4 -7.6 235 237 A E H X S+ 0 0 132 -4,-1.9 4,-2.1 -5,-0.3 -1,-0.2 0.924 111.3 49.0 -61.4 -43.4 4.3 17.4 -9.6 236 238 A L H X S+ 0 0 41 -4,-2.2 4,-1.3 1,-0.2 -2,-0.2 0.930 115.2 41.7 -64.3 -49.7 2.6 15.0 -12.1 237 239 A L H X S+ 0 0 0 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.901 112.6 53.9 -63.5 -43.0 -0.5 17.1 -12.5 238 240 A F H X S+ 0 0 19 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.896 103.1 57.7 -65.9 -38.5 1.3 20.4 -12.6 239 241 A G H X S+ 0 0 28 -4,-2.1 4,-1.0 -5,-0.2 -1,-0.2 0.895 108.9 45.9 -54.0 -43.3 3.6 19.1 -15.4 240 242 A H H X S+ 0 0 13 -4,-1.3 4,-2.4 2,-0.2 3,-0.4 0.903 111.0 51.9 -65.3 -42.0 0.5 18.5 -17.5 241 243 A L H < S+ 0 0 3 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.866 103.2 58.5 -64.7 -36.4 -1.0 21.9 -16.6 242 244 A R H < S+ 0 0 179 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.837 112.6 40.9 -59.9 -33.8 2.2 23.7 -17.7 243 245 A X H < S+ 0 0 159 -4,-1.0 2,-0.3 -3,-0.4 -2,-0.2 0.853 137.5 1.7 -78.0 -38.5 1.8 22.1 -21.1 244 246 A D >< - 0 0 78 -4,-2.4 3,-1.9 -5,-0.1 -1,-0.3 -0.842 52.5-158.1-159.9 110.3 -1.9 22.7 -21.3 245 247 A L T 3 S+ 0 0 61 -2,-0.3 8,-0.3 1,-0.3 -4,-0.1 0.785 100.4 51.9 -63.6 -26.2 -4.3 24.4 -18.8 246 248 A T T >> S+ 0 0 95 -5,-0.1 4,-1.3 6,-0.1 3,-0.8 0.196 82.3 156.5 -94.9 15.7 -7.2 22.5 -20.3 247 249 A A G X4> + 0 0 4 -3,-1.9 5,-1.7 1,-0.2 3,-0.8 -0.045 66.0 10.8 -47.3 141.7 -5.6 19.1 -20.0 248 250 A A G >45S- 0 0 30 1,-0.2 3,-1.9 3,-0.2 -1,-0.2 0.859 135.3 -62.8 47.8 43.6 -7.9 16.1 -19.9 249 251 A D G <45S- 0 0 171 -3,-0.8 -1,-0.2 1,-0.3 -2,-0.2 0.828 103.8 -45.9 59.6 37.1 -10.8 18.3 -20.9 250 252 A G G 5S+ 0 0 68 -3,-1.9 4,-2.6 -5,-0.2 5,-0.3 0.810 71.2 57.8 -70.8 -32.2 -10.1 17.4 -15.4 252 254 A T H > S+ 0 0 84 -6,-0.5 4,-2.8 -8,-0.3 5,-0.2 0.889 114.0 52.6 -62.0 -40.9 -6.9 21.3 -13.3 254 256 A X H X S+ 0 0 147 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.935 112.3 43.6 -65.1 -44.9 -10.1 20.2 -11.4 255 257 A T H X S+ 0 0 9 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.895 112.4 53.8 -66.3 -41.9 -8.3 17.2 -9.7 256 258 A F H X S+ 0 0 0 -4,-2.2 4,-2.1 -5,-0.3 -2,-0.2 0.952 112.2 43.8 -56.2 -51.9 -5.3 19.4 -9.0 257 259 A Q H X S+ 0 0 76 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.868 111.8 53.6 -60.7 -39.8 -7.5 22.0 -7.2 258 260 A E H X S+ 0 0 102 -4,-2.3 4,-1.9 -5,-0.2 -1,-0.2 0.885 108.9 49.5 -66.5 -37.3 -9.5 19.3 -5.4 259 261 A I H X S+ 0 0 3 -4,-2.4 4,-1.7 2,-0.2 -2,-0.2 0.929 109.7 50.1 -65.6 -45.1 -6.2 17.9 -4.0 260 262 A L H X S+ 0 0 7 -4,-2.1 4,-1.1 1,-0.2 -2,-0.2 0.913 111.5 49.8 -60.0 -42.4 -5.0 21.3 -2.8 261 263 A A H < S+ 0 0 76 -4,-2.4 3,-0.2 1,-0.2 -1,-0.2 0.879 109.4 51.2 -60.2 -40.2 -8.3 21.8 -1.1 262 264 A A H < S+ 0 0 70 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.752 106.8 54.3 -70.2 -27.1 -8.1 18.4 0.6 263 265 A L H < S- 0 0 36 -4,-1.7 -1,-0.2 -3,-0.2 -2,-0.2 0.762 107.2-140.9 -77.9 -25.9 -4.6 19.2 1.9 264 266 A G >< - 0 0 26 -4,-1.1 3,-1.3 -3,-0.2 6,-0.1 0.125 24.1 -75.8 84.4 164.6 -5.9 22.4 3.5 265 267 A T T 3 S+ 0 0 132 1,-0.3 -1,-0.1 -4,-0.1 -4,-0.0 0.712 123.0 63.8 -73.5 -19.9 -4.5 25.9 3.9 266 268 A G T 3 S+ 0 0 83 -3,-0.1 2,-0.5 4,-0.0 -1,-0.3 0.456 78.2 103.7 -79.1 -1.1 -2.0 24.9 6.6 267 269 A D <> - 0 0 52 -3,-1.3 4,-2.3 1,-0.1 5,-0.1 -0.729 59.3-155.7 -90.8 124.6 -0.1 22.5 4.3 268 270 A A H > S+ 0 0 78 -2,-0.5 4,-2.1 2,-0.2 -1,-0.1 0.854 94.7 50.3 -69.7 -35.6 3.3 23.9 3.1 269 271 A L H > S+ 0 0 42 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.943 112.4 47.2 -65.7 -48.7 3.4 21.7 0.0 270 272 A A H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.879 109.6 54.8 -58.0 -37.9 -0.1 22.8 -0.9 271 273 A S H X S+ 0 0 52 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.923 106.5 50.6 -65.3 -43.8 0.8 26.4 -0.3 272 274 A X H X S+ 0 0 148 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.930 113.8 45.7 -53.9 -47.7 3.8 26.2 -2.7 273 275 A Y H X S+ 0 0 13 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.827 106.9 56.9 -72.7 -32.1 1.5 24.8 -5.3 274 276 A R H X S+ 0 0 69 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.889 110.2 46.2 -59.4 -43.5 -1.3 27.3 -4.8 275 277 A R H X S+ 0 0 194 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.911 113.0 48.3 -71.8 -42.2 1.1 30.1 -5.5 276 278 A Q H X S+ 0 0 52 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.902 111.5 51.7 -61.4 -39.9 2.6 28.4 -8.6 277 279 A L H X S+ 0 0 13 -4,-2.5 4,-3.0 2,-0.2 5,-0.2 0.919 107.9 50.6 -65.5 -44.7 -0.9 27.7 -9.9 278 280 A Y H X S+ 0 0 158 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.937 111.6 47.6 -60.2 -47.2 -2.1 31.3 -9.5 279 281 A A H < S+ 0 0 70 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.882 114.7 47.7 -59.7 -37.9 1.0 32.5 -11.4 280 282 A L H < S+ 0 0 58 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.929 115.8 42.7 -69.2 -46.0 0.4 29.9 -14.1 281 283 A L H < 0 0 31 -4,-3.0 -2,-0.2 -5,-0.2 -1,-0.2 0.814 360.0 360.0 -67.8 -35.7 -3.3 30.6 -14.6 282 284 A Y < 0 0 185 -4,-2.2 -3,-0.2 -5,-0.2 -2,-0.2 0.579 360.0 360.0-123.9 360.0 -3.3 34.4 -14.5