==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/DNA 27-JUN-02 1M3H . COMPND 2 MOLECULE: 5'- . SOURCE 2 SYNTHETIC: YES; . AUTHOR S.J.CHUNG,G.L.VERDINE . 314 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14085.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 212 67.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 27 8.6 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 1.3 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 0.3 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 . 13 4.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 37 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 121 38.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.9 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 1 2 0 1 1 2 2 2 0 1 1 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 0 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 9 A G 0 0 99 0, 0.0 9,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -74.7 28.7 -13.7 36.9 2 10 A S + 0 0 113 4,-0.0 2,-0.3 73,-0.0 4,-0.1 0.289 360.0 79.3 -90.2 9.8 24.9 -13.4 37.2 3 11 A E S S+ 0 0 153 2,-0.1 160,-0.1 160,-0.1 2,-0.0 -0.833 81.1 17.5-116.4 154.5 25.5 -10.9 40.0 4 12 A G S S- 0 0 13 -2,-0.3 2,-0.2 158,-0.2 158,-0.0 -0.141 105.6 -29.8 81.0 179.7 26.4 -7.2 39.9 5 13 A H S S- 0 0 22 158,-0.1 -2,-0.1 1,-0.1 2,-0.0 -0.537 70.3-123.7 -73.3 136.0 26.1 -4.7 37.1 6 14 A R - 0 0 32 -2,-0.2 2,-0.3 -4,-0.1 -1,-0.1 -0.280 20.0-160.3 -76.5 163.3 26.5 -6.3 33.6 7 15 A T > - 0 0 30 1,-0.1 4,-1.8 50,-0.0 8,-0.1 -0.941 33.2-111.1-137.6 155.1 29.1 -5.4 31.0 8 16 A L T 4 S+ 0 0 52 -2,-0.3 7,-0.1 1,-0.2 6,-0.1 0.903 118.0 46.4 -55.5 -42.9 28.9 -6.2 27.3 9 17 A A T 4 S+ 0 0 84 1,-0.2 -1,-0.2 2,-0.1 -3,-0.0 0.956 110.0 51.0 -62.8 -55.9 31.8 -8.6 27.6 10 18 A S T 4 S+ 0 0 89 1,-0.2 -1,-0.2 2,-0.1 -2,-0.2 0.794 124.0 21.8 -55.4 -41.3 30.6 -10.5 30.7 11 19 A T >< + 0 0 23 -4,-1.8 3,-3.0 1,-0.1 4,-0.3 -0.323 67.5 164.6-132.9 58.3 27.1 -11.4 29.7 12 20 A P G > S+ 0 0 86 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 0.782 74.9 57.9 -37.2 -50.2 26.9 -11.3 25.8 13 21 A A G 3 S+ 0 0 88 1,-0.3 64,-0.3 64,-0.0 -5,-0.0 0.641 99.7 60.9 -63.8 -14.8 23.7 -13.2 25.6 14 22 A L G < S+ 0 0 30 -3,-3.0 55,-0.5 -6,-0.1 2,-0.3 0.454 91.2 79.1 -95.6 0.8 21.9 -10.6 27.7 15 23 A W < - 0 0 19 -3,-1.5 2,-0.3 -4,-0.3 53,-0.2 -0.724 54.6-165.7-108.7 159.1 22.4 -7.6 25.5 16 24 A A E -A 67 0A 20 51,-1.9 51,-2.8 -2,-0.3 2,-0.2 -0.960 16.9-126.0-137.8 153.5 20.6 -6.4 22.4 17 25 A S E -A 66 0A 53 -2,-0.3 49,-0.2 49,-0.2 47,-0.1 -0.594 12.3-165.6-104.6 164.4 21.6 -3.8 19.8 18 26 A I E -A 65 0A 5 47,-0.7 47,-1.9 -2,-0.2 -2,-0.0 -0.930 37.2-113.5-145.1 112.8 20.0 -0.7 18.4 19 27 A P E +A 64 0A 104 0, 0.0 45,-0.2 0, 0.0 44,-0.0 -0.273 60.8 140.2 -49.1 126.7 21.6 0.7 15.2 20 28 A C - 0 0 6 43,-3.2 41,-0.2 41,-0.0 -2,-0.1 -0.553 40.1-145.3-176.5 104.8 22.9 4.1 16.3 21 29 A P >> - 0 0 54 0, 0.0 3,-1.8 0, 0.0 4,-0.8 -0.364 27.6-118.7 -73.5 155.0 26.3 5.7 15.4 22 30 A R T 34 S+ 0 0 81 40,-1.5 3,-0.1 1,-0.3 41,-0.1 0.749 114.1 70.4 -63.6 -21.9 28.1 7.8 18.0 23 31 A S T 34 S+ 0 0 70 39,-0.3 96,-1.0 1,-0.2 -1,-0.3 0.768 105.9 38.7 -65.0 -23.2 27.6 10.7 15.5 24 32 A E T <4 S+ 0 0 24 -3,-1.8 2,-0.3 1,-0.3 -1,-0.2 0.585 131.8 13.4-101.3 -13.7 24.0 10.5 16.5 25 33 A L < - 0 0 0 -4,-0.8 2,-0.5 -3,-0.1 -1,-0.3 -0.880 48.9-173.3-167.0 130.1 24.5 9.8 20.3 26 34 A R >> - 0 0 55 93,-2.1 4,-2.0 -2,-0.3 3,-1.6 -0.921 8.4-166.4-127.6 101.4 27.3 10.0 22.8 27 35 A L H 3> S+ 0 0 1 -2,-0.5 4,-2.2 1,-0.3 3,-0.2 0.910 90.5 57.3 -51.6 -47.9 26.1 8.6 26.1 28 36 A D H 34 S+ 0 0 44 1,-0.2 -1,-0.3 2,-0.2 13,-0.0 0.711 112.2 43.3 -59.5 -19.8 29.2 10.1 27.8 29 37 A L H <4 S+ 0 0 0 -3,-1.6 -1,-0.2 90,-0.1 -2,-0.2 0.755 122.9 31.8 -99.6 -26.0 28.1 13.5 26.6 30 38 A V H ><>S+ 0 0 0 -4,-2.0 3,-0.8 -3,-0.2 5,-0.5 0.891 109.2 59.1 -98.1 -42.0 24.3 13.3 27.3 31 39 A L T 3<5S+ 0 0 2 -4,-2.2 8,-0.5 1,-0.2 3,-0.2 0.708 115.8 30.4 -61.5 -27.8 23.8 11.2 30.4 32 40 A P T 3 5S+ 0 0 57 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.386 94.0 95.0-113.4 7.8 25.9 13.2 32.9 33 41 A S T < 5S- 0 0 10 -3,-0.8 -2,-0.1 -4,-0.1 280,-0.1 0.133 106.2 -87.7 -88.0 23.0 25.4 16.7 31.4 34 42 A G T 5S+ 0 0 13 2,-0.5 3,-0.2 -3,-0.2 -3,-0.1 0.686 102.6 101.7 86.6 16.5 22.5 17.9 33.5 35 43 A Q S S-B 46 0A 28 3,-1.1 3,-2.6 -3,-0.2 5,-0.0 -0.932 113.3 -74.0-131.6 153.3 31.7 0.4 34.8 44 52 A P T 3 S- 0 0 115 0, 0.0 3,-0.1 0, 0.0 -2,-0.1 -0.273 118.6 -2.5 -55.3 128.3 33.8 2.2 32.2 45 53 A A T 3 S+ 0 0 53 1,-0.2 2,-0.5 -4,-0.1 15,-0.4 0.571 110.9 111.2 67.5 10.0 31.6 3.2 29.3 46 54 A H E < -B 43 0A 24 -3,-2.6 -3,-1.1 13,-0.1 2,-0.5 -0.964 49.7-166.1-117.6 121.3 28.6 1.5 30.9 47 55 A W E - C 0 58A 21 11,-3.4 11,-3.2 -2,-0.5 2,-0.4 -0.910 3.3-169.0-111.7 129.3 25.8 3.6 32.2 48 56 A S E +BC 40 57A 0 -8,-3.2 -8,-2.2 -2,-0.5 2,-0.3 -0.903 24.0 116.9-118.8 145.8 23.1 2.3 34.5 49 57 A G E - C 0 56A 0 7,-2.1 7,-3.0 -2,-0.4 2,-0.5 -0.978 60.5 -66.4 179.2 179.6 19.8 3.9 35.6 50 58 A V E + C 0 55A 16 -12,-0.4 2,-0.4 -2,-0.3 5,-0.2 -0.764 44.4 172.7 -94.2 130.2 16.0 3.6 35.6 51 59 A L E > S- C 0 54A 5 3,-3.0 3,-1.0 -2,-0.5 35,-0.1 -0.976 71.1 -11.9-139.4 120.0 14.2 3.9 32.3 52 60 A A T 3 S- 0 0 65 -2,-0.4 -1,-0.1 1,-0.2 3,-0.1 0.937 128.8 -53.5 54.1 50.7 10.5 3.3 31.9 53 61 A D T 3 S+ 0 0 133 1,-0.1 2,-0.3 116,-0.1 -1,-0.2 0.583 121.6 88.2 62.9 17.1 10.3 1.7 35.4 54 62 A Q E < S-C 51 0A 52 -3,-1.0 -3,-3.0 -5,-0.0 2,-0.4 -0.955 79.6-108.7-138.2 155.8 13.0 -0.8 34.9 55 63 A V E -CD 50 70A 1 15,-1.1 15,-2.5 -2,-0.3 2,-0.3 -0.723 39.2-178.8 -89.4 135.0 16.8 -0.7 35.5 56 64 A W E -CD 49 69A 1 -7,-3.0 -7,-2.1 -2,-0.4 2,-0.4 -0.901 22.6-151.4-128.7 159.0 19.0 -0.7 32.4 57 65 A T E -CD 48 68A 1 11,-1.6 11,-1.5 -2,-0.3 2,-0.4 -0.998 22.7-167.1-127.4 129.8 22.7 -0.6 31.7 58 66 A L E +CD 47 67A 0 -11,-3.2 -11,-3.4 -2,-0.4 2,-0.3 -0.926 15.3 160.1-122.5 147.8 23.7 1.0 28.4 59 67 A T E - D 0 66A 9 7,-2.0 7,-3.3 -2,-0.4 2,-0.3 -0.970 20.1-144.1-159.1 152.0 26.9 1.1 26.4 60 68 A Q E - D 0 65A 17 -15,-0.4 5,-0.2 -2,-0.3 2,-0.2 -0.918 10.5-164.4-132.5 155.0 27.9 1.8 22.8 61 69 A T - 0 0 54 3,-2.6 -39,-0.1 -2,-0.3 -41,-0.0 -0.533 55.8 -79.3-113.1-175.8 30.2 0.8 20.0 62 70 A E S S+ 0 0 128 -2,-0.2 -40,-1.5 1,-0.2 -39,-0.3 0.869 127.4 14.3 -58.6 -38.7 30.8 2.9 16.9 63 71 A E S S+ 0 0 54 -42,-0.2 -43,-3.2 -41,-0.1 2,-0.3 0.516 120.2 64.8-114.7 -8.9 27.6 1.8 15.2 64 72 A Q E -A 19 0A 56 -45,-0.2 -3,-2.6 -47,-0.1 2,-0.6 -0.881 57.7-148.4-124.4 151.1 25.5 0.2 17.9 65 73 A L E -AD 18 60A 0 -47,-1.9 -47,-0.7 -2,-0.3 2,-0.4 -0.963 28.3-150.4-109.9 112.5 23.8 1.2 21.2 66 74 A H E -AD 17 59A 23 -7,-3.3 -7,-2.0 -2,-0.6 2,-0.4 -0.741 15.6-171.3 -90.0 131.5 24.0 -1.9 23.4 67 75 A C E +AD 16 58A 0 -51,-2.8 -51,-1.9 -2,-0.4 2,-0.3 -0.930 13.1 177.0-126.7 145.6 21.2 -2.4 25.9 68 76 A T E - D 0 57A 0 -11,-1.5 -11,-1.6 -2,-0.4 2,-0.4 -0.989 12.7-155.8-142.2 148.8 20.5 -4.7 28.8 69 77 A V E - D 0 56A 1 -55,-0.5 2,-0.5 7,-0.4 7,-0.3 -0.958 10.4-155.1-132.1 147.7 17.6 -4.8 31.3 70 78 A Y E D 0 55A 16 -15,-2.5 -15,-1.1 -2,-0.4 5,-0.0 -0.949 360.0 360.0-121.4 108.1 17.0 -6.1 34.8 71 79 A R 0 0 97 -2,-0.5 -1,-0.1 -17,-0.1 3,-0.0 0.542 360.0 360.0 -85.3 360.0 13.4 -6.9 35.5 72 ! 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 73 83 A S 0 0 142 0, 0.0 2,-0.2 0, 0.0 -2,-0.1 0.000 360.0 360.0 360.0 164.3 11.8 -14.0 36.0 74 84 A Q - 0 0 85 1,-0.1 2,-0.2 -3,-0.0 -3,-0.1 -0.416 360.0-108.6 -66.4 131.5 14.6 -15.5 34.0 75 85 A A + 0 0 66 -2,-0.2 2,-0.3 -5,-0.0 -1,-0.1 -0.421 55.8 156.6 -61.2 125.0 17.3 -13.1 32.9 76 86 A S - 0 0 52 -7,-0.3 -7,-0.4 -2,-0.2 -62,-0.1 -0.926 45.4 -80.1-145.7 169.4 17.0 -12.5 29.2 77 87 A R - 0 0 34 -64,-0.3 -62,-0.2 -2,-0.3 -9,-0.1 -0.223 62.0 -85.8 -67.0 159.8 17.9 -10.0 26.5 78 88 A P - 0 0 12 0, 0.0 -1,-0.1 0, 0.0 -11,-0.0 -0.327 43.9-122.6 -65.8 154.1 15.6 -7.0 26.1 79 89 A T > - 0 0 54 -3,-0.1 4,-2.9 1,-0.1 5,-0.2 -0.530 26.1-104.6 -92.2 164.8 12.5 -7.5 23.8 80 90 A P H > S+ 0 0 98 0, 0.0 4,-1.5 0, 0.0 -1,-0.1 0.833 123.0 50.4 -56.5 -34.7 11.8 -5.3 20.7 81 91 A D H > S+ 0 0 131 2,-0.2 4,-1.3 1,-0.2 0, 0.0 0.933 110.4 48.0 -69.2 -48.0 9.1 -3.5 22.7 82 92 A E H >> S+ 0 0 31 1,-0.2 4,-1.0 2,-0.2 3,-0.8 0.935 111.2 51.7 -58.3 -46.3 11.4 -2.8 25.7 83 93 A L H >X S+ 0 0 23 -4,-2.9 4,-2.5 1,-0.3 3,-0.6 0.858 101.5 61.0 -58.8 -36.1 14.1 -1.6 23.3 84 94 A E H 3X S+ 0 0 100 -4,-1.5 4,-2.7 1,-0.3 -1,-0.3 0.871 98.0 58.2 -59.6 -35.5 11.6 0.8 21.7 85 95 A A H S+ 0 0 65 -4,-2.5 5,-2.5 1,-0.2 6,-0.3 0.877 112.5 46.9 -56.4 -38.6 14.5 4.5 21.3 88 98 A K H ><5S+ 0 0 150 -4,-2.7 3,-1.2 3,-0.2 -1,-0.2 0.881 107.3 56.1 -71.5 -39.1 11.8 6.8 22.6 89 99 A Y H 3<5S+ 0 0 29 -4,-1.9 35,-3.0 1,-0.3 -2,-0.2 0.859 115.8 37.5 -60.5 -38.3 13.8 7.9 25.6 90 100 A F T 3<5S- 0 0 0 -4,-2.1 -1,-0.3 33,-0.2 -2,-0.2 0.242 105.1-130.1 -96.9 11.3 16.6 9.1 23.3 91 101 A Q T X 5 + 0 0 38 -3,-1.2 3,-1.6 1,-0.2 -3,-0.2 0.884 37.3 177.0 38.2 52.1 14.2 10.3 20.6 92 102 A L T 3 < + 0 0 22 -5,-2.5 -1,-0.2 1,-0.3 -4,-0.1 0.501 67.7 71.0 -63.8 -3.9 16.2 8.4 18.1 93 103 A D T 3 S+ 0 0 133 -6,-0.3 2,-0.6 -5,-0.1 -1,-0.3 0.828 79.3 83.8 -80.6 -33.0 13.7 9.4 15.4 94 104 A V S < S- 0 0 32 -3,-1.6 2,-0.6 -4,-0.1 -1,-0.0 -0.616 85.2-135.3 -72.6 114.0 15.0 12.9 15.5 95 105 A T > - 0 0 66 -2,-0.6 4,-1.5 1,-0.2 5,-0.1 -0.621 16.1-165.7 -76.8 115.8 18.1 12.9 13.2 96 106 A L H > S+ 0 0 0 -2,-0.6 4,-3.0 1,-0.2 5,-0.3 0.820 87.0 60.3 -71.8 -31.4 21.0 14.7 14.8 97 107 A A H > S+ 0 0 60 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.916 106.1 48.5 -62.4 -41.1 23.0 14.9 11.6 98 108 A Q H > S+ 0 0 133 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.912 114.7 44.8 -64.2 -43.9 20.1 16.9 10.0 99 109 A L H X S+ 0 0 24 -4,-1.5 4,-2.8 2,-0.2 5,-0.3 0.940 112.1 50.0 -66.7 -49.0 20.0 19.2 13.0 100 110 A Y H X S+ 0 0 32 -4,-3.0 4,-3.0 1,-0.2 5,-0.2 0.906 109.4 54.6 -56.0 -42.5 23.7 19.8 13.3 101 111 A H H X S+ 0 0 127 -4,-2.1 4,-2.5 -5,-0.3 -1,-0.2 0.967 111.4 42.7 -55.6 -56.8 23.8 20.5 9.6 102 112 A H H X S+ 0 0 85 -4,-2.0 4,-2.0 2,-0.2 5,-0.2 0.924 115.7 47.0 -57.9 -50.6 21.2 23.2 9.8 103 113 A W H X S+ 0 0 1 -4,-2.8 4,-1.4 1,-0.2 8,-0.3 0.927 113.9 49.8 -58.8 -43.8 22.6 24.9 13.0 104 114 A G H < S+ 0 0 5 -4,-3.0 7,-0.3 -5,-0.3 -1,-0.2 0.885 107.1 55.4 -61.2 -39.3 26.0 24.7 11.5 105 115 A S H < S+ 0 0 74 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.900 116.7 34.8 -60.4 -45.0 24.8 26.3 8.2 106 116 A V H < S+ 0 0 71 -4,-2.0 2,-0.3 1,-0.2 -1,-0.2 0.553 121.5 48.9 -89.1 -7.8 23.3 29.3 10.0 107 117 A D X - 0 0 12 -4,-1.4 4,-2.5 -5,-0.2 -1,-0.2 -0.769 55.9-171.2-140.2 96.1 26.0 29.6 12.7 108 118 A S H > S+ 0 0 97 -2,-0.3 4,-1.8 1,-0.2 -1,-0.1 0.841 93.3 50.9 -48.8 -39.2 29.7 29.5 11.8 109 119 A H H > S+ 0 0 48 2,-0.2 4,-2.1 1,-0.2 5,-0.3 0.928 106.7 51.5 -68.7 -45.0 30.5 29.3 15.5 110 120 A F H > S+ 0 0 0 -7,-0.2 4,-3.3 1,-0.2 5,-0.2 0.927 107.4 56.5 -56.9 -42.2 28.2 26.4 16.2 111 121 A Q H X S+ 0 0 117 -4,-2.5 4,-1.8 -7,-0.3 -1,-0.2 0.932 107.6 46.4 -53.8 -51.5 29.8 24.6 13.3 112 122 A E H X S+ 0 0 64 -4,-1.8 4,-0.7 2,-0.2 3,-0.4 0.972 118.3 40.0 -55.7 -61.6 33.3 24.9 14.8 113 123 A V H >X S+ 0 0 32 -4,-2.1 3,-1.3 1,-0.2 4,-0.8 0.925 111.2 59.7 -53.1 -50.5 32.3 23.7 18.3 114 124 A A H >< S+ 0 0 9 -4,-3.3 3,-1.3 -5,-0.3 -1,-0.2 0.845 91.0 67.1 -48.4 -45.6 30.0 21.0 16.9 115 125 A Q H 3< S+ 0 0 87 -4,-1.8 3,-0.3 -3,-0.4 -1,-0.3 0.863 107.5 41.2 -46.5 -40.9 32.7 19.2 15.0 116 126 A K H << S+ 0 0 151 -3,-1.3 -1,-0.3 -4,-0.7 2,-0.2 0.625 117.4 47.6 -84.5 -16.3 34.3 18.2 18.3 117 127 A F S << S+ 0 0 32 -3,-1.3 3,-0.5 -4,-0.8 -1,-0.2 -0.515 71.0 161.1-130.4 70.6 31.1 17.4 20.2 118 128 A Q + 0 0 30 -3,-0.3 -94,-0.2 -2,-0.2 3,-0.1 -0.382 53.9 39.9 -84.0 162.1 28.8 15.2 18.1 119 129 A G + 0 0 0 -96,-1.0 -93,-2.1 1,-0.2 2,-0.7 0.630 67.6 141.7 77.9 13.6 26.0 13.1 19.5 120 130 A V + 0 0 1 -3,-0.5 2,-0.3 -95,-0.2 -1,-0.2 -0.826 24.5 152.8 -90.8 114.8 24.6 15.6 22.0 121 131 A R - 0 0 0 -2,-0.7 2,-0.5 -95,-0.1 -30,-0.1 -0.802 45.0 -91.7-133.0 174.6 20.8 15.2 21.9 122 132 A L - 0 0 1 -2,-0.3 2,-0.2 -31,-0.1 181,-0.1 -0.792 29.6-135.9 -98.5 131.5 17.8 15.7 24.2 123 133 A L - 0 0 0 -2,-0.5 2,-1.0 -93,-0.1 -33,-0.2 -0.549 18.1-127.7 -77.2 144.8 16.4 12.9 26.4 124 134 A R - 0 0 25 -35,-3.0 124,-0.2 -2,-0.2 2,-0.1 -0.806 40.9-168.3 -95.9 95.1 12.6 12.7 26.5 125 135 A Q - 0 0 4 122,-2.9 -89,-0.0 -2,-1.0 -3,-0.0 -0.402 27.0 -96.8 -88.3 158.6 12.0 12.7 30.2 126 136 A D > - 0 0 78 1,-0.1 4,-2.5 -2,-0.1 5,-0.3 -0.526 34.0-127.7 -71.3 133.8 9.0 12.0 32.5 127 137 A P H > S+ 0 0 5 0, 0.0 4,-2.6 0, 0.0 -1,-0.1 0.882 104.2 45.8 -47.3 -50.1 7.2 15.2 33.4 128 138 A I H > S+ 0 0 10 2,-0.2 4,-2.5 1,-0.2 5,-0.4 0.943 112.9 45.8 -63.3 -55.1 7.3 14.5 37.2 129 139 A E H > S+ 0 0 24 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.909 116.8 48.3 -56.5 -40.3 10.9 13.4 37.6 130 140 A C H X S+ 0 0 0 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.898 109.4 52.0 -68.4 -42.0 11.9 16.4 35.4 131 141 A L H X S+ 0 0 0 -4,-2.6 4,-1.4 -5,-0.3 -2,-0.2 0.975 118.7 34.4 -59.5 -55.9 9.8 18.8 37.4 132 142 A F H X S+ 0 0 0 -4,-2.5 4,-1.5 2,-0.2 -2,-0.2 0.867 113.8 57.0 -72.5 -34.3 11.2 17.9 40.8 133 143 A S H < S+ 0 0 1 -4,-2.5 3,-0.4 -5,-0.4 4,-0.4 0.967 114.5 40.4 -60.3 -47.2 14.7 17.1 39.7 134 144 A F H X S+ 0 0 4 -4,-2.0 4,-0.7 1,-0.3 3,-0.4 0.743 103.9 64.2 -75.4 -20.5 15.0 20.6 38.3 135 145 A I H < S+ 0 0 0 -4,-1.4 3,-0.5 1,-0.2 -1,-0.3 0.864 105.7 50.5 -64.9 -29.5 13.2 22.2 41.2 136 146 A C T < S+ 0 0 1 -4,-1.5 -1,-0.2 -3,-0.4 -2,-0.2 0.675 98.8 68.5 -78.2 -16.5 16.3 20.8 42.9 137 147 A S T >4 + 0 0 8 -3,-0.4 3,-0.9 -4,-0.4 -1,-0.2 0.702 67.6 116.4 -79.1 -19.9 18.7 22.4 40.4 138 148 A S T 3< S- 0 0 31 -4,-0.7 3,-0.1 -3,-0.5 56,-0.1 -0.240 92.3 -10.2 -56.5 127.9 18.2 26.1 41.3 139 149 A N T 3 S+ 0 0 139 1,-0.2 2,-0.3 -2,-0.0 -1,-0.2 0.939 117.8 101.4 49.1 54.9 21.2 28.0 42.6 140 150 A N S < S- 0 0 35 -3,-0.9 2,-0.2 4,-0.0 -1,-0.2 -0.989 70.6-105.8-162.7 156.6 23.1 24.7 42.9 141 151 A N > - 0 0 88 -2,-0.3 4,-2.6 -3,-0.1 3,-0.3 -0.582 29.5-114.6 -92.9 156.7 25.7 22.5 41.2 142 152 A I H > S+ 0 0 54 1,-0.2 4,-1.9 -2,-0.2 5,-0.1 0.770 112.3 57.3 -56.2 -30.9 25.3 19.3 39.2 143 153 A A H > S+ 0 0 71 2,-0.2 4,-1.5 1,-0.1 -1,-0.2 0.947 112.6 37.8 -68.8 -48.9 27.2 17.2 41.7 144 154 A R H >> S+ 0 0 94 -3,-0.3 4,-2.7 2,-0.2 3,-0.5 0.971 113.2 57.2 -65.4 -52.5 25.0 18.1 44.7 145 155 A I H 3X S+ 0 0 5 -4,-2.6 4,-2.6 1,-0.3 5,-0.3 0.879 105.4 53.0 -43.2 -46.3 21.8 18.0 42.6 146 156 A T H 3X S+ 0 0 21 -4,-1.9 4,-1.5 -5,-0.2 -1,-0.3 0.902 111.5 44.4 -59.1 -45.2 22.7 14.5 41.7 147 157 A G H -E 166 0B 15 3,-3.2 3,-2.9 -2,-0.4 -158,-0.1 -0.997 67.4 -39.9-128.9 124.7 22.9 -4.7 41.7 164 174 A D T 3 S- 0 0 99 -2,-0.4 -160,-0.1 1,-0.3 -2,-0.0 -0.395 125.8 -28.7 54.4-128.8 26.1 -5.0 43.8 165 175 A D T 3 S+ 0 0 147 -3,-0.1 2,-0.6 2,-0.0 -1,-0.3 0.151 119.1 102.1-101.9 18.3 25.5 -2.6 46.7 166 176 A V E < -E 163 0B 37 -3,-2.9 -3,-3.2 2,-0.0 2,-0.5 -0.904 52.4-165.9-106.5 122.5 23.3 -0.3 44.7 167 177 A T E -E 162 0B 46 -2,-0.6 2,-0.3 -5,-0.2 -5,-0.2 -0.930 17.1-143.4-104.6 124.3 19.5 -0.5 45.2 168 178 A Y E - 0 0 18 -7,-2.9 -8,-3.3 -2,-0.5 2,-0.3 -0.634 13.9-164.4 -91.2 148.9 17.6 1.3 42.5 169 179 A H E -E 159 0B 32 -2,-0.3 -10,-0.2 -10,-0.2 2,-0.2 -0.948 19.7-123.4-129.2 148.7 14.4 3.3 43.1 170 180 A G - 0 0 4 -12,-2.8 3,-0.1 -2,-0.3 -14,-0.1 -0.523 50.6 -85.0 -81.8 160.6 11.7 4.6 40.8 171 181 A F - 0 0 29 -14,-0.2 -1,-0.1 -2,-0.2 -42,-0.1 -0.405 57.1 -93.8 -66.7 141.5 11.1 8.3 41.0 172 182 A P - 0 0 2 0, 0.0 -15,-0.2 0, 0.0 -1,-0.1 -0.146 39.2-119.8 -55.7 149.2 8.7 9.3 43.8 173 183 A S > - 0 0 54 -17,-0.5 4,-2.4 1,-0.1 5,-0.2 -0.341 23.7-108.4 -83.8 170.4 5.0 9.7 42.9 174 184 A L H > S+ 0 0 7 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.943 120.7 50.7 -64.1 -46.9 3.0 12.9 43.4 175 185 A Q H > S+ 0 0 123 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.939 110.7 49.6 -55.5 -49.3 1.1 11.4 46.4 176 186 A A H >4 S+ 0 0 32 1,-0.2 3,-1.0 2,-0.2 -1,-0.2 0.937 112.8 44.6 -57.8 -50.5 4.4 10.4 48.0 177 187 A L H 3< S+ 0 0 0 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.817 111.7 55.0 -65.8 -27.7 6.0 13.8 47.6 178 188 A A H 3< S+ 0 0 15 -4,-2.3 -1,-0.2 24,-0.2 -2,-0.2 0.667 88.6 122.2 -77.6 -16.0 2.8 15.5 48.8 179 189 A G S X< S- 0 0 15 -4,-1.0 3,-1.2 -3,-1.0 4,-0.3 0.258 73.4 -79.6 -45.8 164.6 2.9 13.4 52.0 180 190 A P T 3 S+ 0 0 115 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 -0.492 111.7 4.8 -71.8 135.3 2.9 14.6 55.6 181 191 A E T 3> S+ 0 0 162 -2,-0.2 4,-2.0 -3,-0.1 5,-0.2 0.607 86.3 132.0 68.3 14.4 6.3 15.7 57.0 182 192 A V H <> + 0 0 4 -3,-1.2 4,-2.7 1,-0.2 5,-0.2 0.945 69.5 52.4 -60.8 -48.3 8.0 15.2 53.6 183 193 A E H > S+ 0 0 68 -4,-0.3 4,-2.6 1,-0.2 -1,-0.2 0.932 107.9 50.0 -53.5 -51.6 9.6 18.6 53.8 184 194 A A H > S+ 0 0 55 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.909 112.0 49.0 -55.7 -41.1 11.1 17.9 57.2 185 195 A H H X S+ 0 0 82 -4,-2.0 4,-0.8 1,-0.2 -1,-0.2 0.912 110.1 50.6 -65.6 -40.7 12.5 14.6 55.8 186 196 A L H ><>S+ 0 0 0 -4,-2.7 5,-1.8 1,-0.2 3,-0.6 0.876 104.9 57.5 -63.7 -38.4 13.9 16.3 52.8 187 197 A R H ><5S+ 0 0 111 -4,-2.6 3,-1.5 1,-0.3 5,-0.4 0.901 105.5 50.5 -58.3 -42.1 15.7 18.9 55.0 188 198 A K H 3<5S+ 0 0 191 -4,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.698 106.2 55.8 -69.1 -20.4 17.4 16.1 56.8 189 199 A L T <<5S- 0 0 35 -4,-0.8 -1,-0.3 -3,-0.6 -2,-0.2 0.311 122.6-108.9 -93.4 7.1 18.5 14.7 53.4 190 200 A G T < 5S+ 0 0 30 -3,-1.5 -3,-0.2 -5,-0.1 -2,-0.1 0.773 75.2 135.5 75.4 30.8 20.1 18.0 52.6 191 201 A L > < - 0 0 0 -5,-1.8 3,-1.4 1,-0.2 -4,-0.2 0.558 48.2-159.6 -84.4 -5.7 17.8 19.6 50.0 192 202 A G T > - 0 0 27 -5,-0.4 3,-2.7 -6,-0.3 4,-0.4 -0.225 61.0 -15.2 62.2-152.9 18.0 22.9 51.9 193 203 A Y T >> S+ 0 0 84 1,-0.3 4,-0.7 2,-0.2 3,-0.5 0.646 129.7 72.5 -58.3 -13.8 15.3 25.5 51.3 194 204 A R H <> S+ 0 0 4 -3,-1.4 4,-2.0 1,-0.2 -1,-0.3 0.705 77.3 78.2 -75.3 -17.4 14.3 23.5 48.2 195 205 A A H <> S+ 0 0 0 -3,-2.7 4,-1.8 1,-0.2 -1,-0.2 0.924 93.8 49.5 -54.6 -44.5 12.8 20.9 50.4 196 206 A R H <> S+ 0 0 115 -3,-0.5 4,-2.9 -4,-0.4 -1,-0.2 0.846 106.0 55.9 -64.9 -35.5 9.8 23.2 50.9 197 207 A Y H X S+ 0 0 54 -4,-0.7 4,-3.1 2,-0.2 5,-0.3 0.902 106.2 50.9 -63.8 -41.6 9.4 23.7 47.1 198 208 A V H X S+ 0 0 0 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.957 115.1 41.0 -60.7 -53.3 9.2 20.0 46.5 199 209 A S H X S+ 0 0 5 -4,-1.8 4,-2.4 1,-0.2 5,-0.2 0.959 117.5 48.5 -59.5 -51.8 6.5 19.4 49.1 200 210 A A H X S+ 0 0 32 -4,-2.9 4,-2.8 1,-0.2 -2,-0.2 0.888 112.7 46.8 -57.8 -43.9 4.6 22.6 48.2 201 211 A S H X S+ 0 0 0 -4,-3.1 4,-2.3 -5,-0.2 -1,-0.2 0.853 109.4 54.2 -70.6 -32.9 4.7 21.9 44.4 202 212 A A H X S+ 0 0 0 -4,-2.1 4,-2.1 -5,-0.3 5,-0.2 0.966 113.9 41.8 -63.3 -48.7 3.5 18.3 45.0 203 213 A R H X S+ 0 0 96 -4,-2.4 4,-3.9 1,-0.2 5,-0.4 0.927 112.0 54.8 -63.6 -45.2 0.5 19.5 47.0 204 214 A A H X>S+ 0 0 9 -4,-2.8 4,-2.0 -5,-0.2 5,-1.4 0.923 111.0 45.6 -54.2 -47.8 -0.2 22.4 44.6 205 215 A I H <5S+ 0 0 0 -4,-2.3 6,-3.1 3,-0.2 5,-0.5 0.914 121.2 37.1 -62.2 -46.3 -0.4 20.0 41.6 206 216 A L H <5S+ 0 0 54 -4,-2.1 -2,-0.2 -5,-0.2 -1,-0.2 0.852 128.8 31.8 -77.1 -35.0 -2.5 17.5 43.4 207 217 A E H <5S+ 0 0 146 -4,-3.9 -3,-0.2 -5,-0.2 -2,-0.2 0.486 132.6 20.4-105.6 -3.1 -4.7 19.9 45.4 208 218 A E T <5S+ 0 0 143 -4,-2.0 -3,-0.2 -5,-0.4 -4,-0.1 0.592 120.9 44.7-135.2 -25.0 -5.0 23.0 43.1 209 219 A Q S > S- 0 0 7 -6,-3.1 3,-1.6 1,-0.2 4,-0.9 -0.294 75.5 -17.2 82.9-163.6 -3.3 16.4 39.4 212 222 A L H >> S+ 0 0 73 1,-0.3 4,-2.7 2,-0.2 3,-1.0 0.877 128.8 63.9 -47.7 -45.7 -1.0 14.4 37.1 213 223 A A H 3> S+ 0 0 64 -3,-0.4 4,-0.8 1,-0.3 -1,-0.3 0.809 95.6 58.6 -51.1 -36.3 -3.4 15.1 34.2 214 224 A W H <4 S+ 0 0 41 -3,-1.6 4,-0.4 2,-0.2 -1,-0.3 0.874 112.9 38.7 -63.6 -37.6 -2.7 18.9 34.4 215 225 A L H X< S+ 0 0 0 -3,-1.0 3,-2.0 -4,-0.9 4,-0.3 0.956 115.2 50.6 -76.7 -53.1 1.1 18.3 33.9 216 226 A Q H 3< S+ 0 0 98 -4,-2.7 3,-0.3 1,-0.3 -2,-0.2 0.585 104.3 62.7 -61.4 -10.1 0.7 15.5 31.3 217 227 A Q T >X S+ 0 0 46 -4,-0.8 3,-1.4 -5,-0.3 4,-0.8 0.675 84.3 75.1 -88.1 -19.8 -1.7 17.8 29.5 218 228 A L T <4 S+ 0 0 9 -3,-2.0 8,-0.2 -4,-0.4 -1,-0.2 0.665 80.5 71.9 -66.7 -15.3 1.1 20.4 28.9 219 229 A R T 34 S+ 0 0 86 -3,-0.3 -1,-0.3 -4,-0.3 -2,-0.1 0.779 103.1 40.7 -70.5 -25.8 2.5 18.2 26.2 220 230 A E T <4 S+ 0 0 169 -3,-1.4 -1,-0.2 -4,-0.1 -2,-0.2 0.635 106.4 83.7 -93.0 -18.1 -0.4 19.1 23.9 221 231 A S S < S- 0 0 48 -4,-0.8 2,-0.3 1,-0.1 -3,-0.0 0.025 89.7 -89.0 -72.8-174.4 -0.3 22.7 25.0 222 232 A S > - 0 0 44 1,-0.1 4,-3.3 29,-0.0 5,-0.4 -0.762 29.5-114.1-103.1 149.4 1.9 25.4 23.6 223 233 A Y H > S+ 0 0 20 -2,-0.3 4,-3.2 1,-0.3 5,-0.2 0.894 120.4 48.6 -42.2 -50.5 5.4 26.3 24.8 224 234 A E H > S+ 0 0 124 2,-0.2 4,-1.8 1,-0.2 -1,-0.3 0.924 116.5 41.3 -59.0 -48.3 4.0 29.7 25.9 225 235 A E H >> S+ 0 0 121 2,-0.2 4,-2.4 1,-0.2 3,-0.6 0.994 117.0 48.1 -60.8 -62.6 1.1 28.2 27.7 226 236 A A H 3X S+ 0 0 0 -4,-3.3 4,-2.3 1,-0.3 -2,-0.2 0.867 111.6 50.0 -44.8 -48.8 3.1 25.3 29.2 227 237 A H H 3X S+ 0 0 29 -4,-3.2 4,-1.5 -5,-0.4 -1,-0.3 0.876 110.7 49.2 -63.4 -38.7 5.8 27.6 30.4 228 238 A K H << S+ 0 0 153 -4,-1.8 4,-0.4 -3,-0.6 -1,-0.2 0.901 110.8 50.7 -66.8 -42.2 3.4 30.0 32.1 229 239 A A H >X S+ 0 0 18 -4,-2.4 3,-2.3 1,-0.2 4,-0.6 0.970 107.6 51.7 -59.6 -56.4 1.6 27.2 33.8 230 240 A L H >< S+ 0 0 0 -4,-2.3 3,-1.2 1,-0.3 -1,-0.2 0.859 98.7 66.4 -49.3 -41.4 4.7 25.6 35.3 231 241 A C T 3< S+ 0 0 46 -4,-1.5 -1,-0.3 1,-0.3 5,-0.2 0.672 87.4 69.5 -58.9 -17.3 5.8 29.0 36.7 232 242 A I T <4 S+ 0 0 96 -3,-2.3 -1,-0.3 -4,-0.4 -2,-0.2 0.918 81.5 91.3 -64.8 -44.5 2.8 28.9 39.1 233 243 A L S X< S- 0 0 3 -3,-1.2 3,-1.8 -4,-0.6 -32,-0.1 -0.223 91.8 -99.1 -58.2 136.7 4.5 26.0 41.0 234 244 A P T 3 S+ 0 0 45 0, 0.0 -33,-0.2 0, 0.0 -1,-0.1 -0.322 106.8 15.5 -59.1 127.9 6.7 26.9 44.0 235 245 A G T 3 S+ 0 0 22 1,-0.2 2,-0.7 -4,-0.1 -97,-0.2 0.437 99.3 114.1 87.7 -1.1 10.4 26.9 43.2 236 246 A V < + 0 0 7 -3,-1.8 -1,-0.2 -5,-0.2 2,-0.1 -0.884 36.7 158.9-110.1 106.1 9.8 26.9 39.5 237 247 A G > - 0 0 37 -2,-0.7 4,-3.0 -3,-0.1 5,-0.2 -0.246 59.5 -70.4-106.0-162.4 10.9 30.0 37.7 238 248 A T H > S+ 0 0 81 2,-0.2 4,-2.4 1,-0.2 5,-0.1 0.917 131.0 46.7 -58.9 -47.7 11.7 30.8 34.0 239 249 A K H > S+ 0 0 69 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.959 117.0 41.4 -60.8 -55.0 14.9 28.8 34.0 240 250 A V H > S+ 0 0 6 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.928 115.1 52.9 -59.8 -45.1 13.4 25.7 35.7 241 251 A A H X S+ 0 0 0 -4,-3.0 4,-2.6 1,-0.2 -1,-0.2 0.890 108.1 50.8 -57.7 -42.3 10.3 26.0 33.6 242 252 A D H X S+ 0 0 12 -4,-2.4 4,-3.4 -5,-0.2 5,-0.3 0.920 107.1 52.7 -63.4 -44.9 12.3 26.1 30.4 243 253 A C H X S+ 0 0 4 -4,-2.2 4,-3.4 1,-0.2 5,-0.3 0.947 112.6 45.6 -55.6 -49.2 14.3 22.9 31.3 244 254 A I H X>S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 5,-1.7 0.913 113.5 49.5 -60.8 -43.7 11.0 21.1 31.9 245 255 A C H <5S+ 0 0 0 -4,-2.6 6,-2.3 -5,-0.2 4,-0.3 0.939 118.2 39.8 -60.0 -47.0 9.5 22.5 28.7 246 256 A L H <5S+ 0 0 4 -4,-3.4 -2,-0.2 4,-0.2 -1,-0.2 0.888 125.4 33.4 -69.5 -43.2 12.6 21.5 26.7 247 257 A M H <5S+ 0 0 14 -4,-3.4 -122,-2.9 -5,-0.3 -3,-0.2 0.597 134.2 13.6 -95.6 -14.0 13.3 18.1 28.4 248 258 A A T <5S+ 0 0 2 -4,-2.3 -3,-0.2 -5,-0.3 -2,-0.1 0.582 118.6 55.5-133.0 -24.4 9.8 16.7 29.3 249 259 A L S + 0 0 12 -6,-2.3 3,-1.7 -7,-0.2 -1,-0.2 -0.730 22.8 175.2-108.1 81.1 9.0 22.0 23.5 252 262 A P T 3 S+ 0 0 23 0, 0.0 50,-1.3 0, 0.0 51,-0.9 0.548 73.4 61.9 -65.0 -6.9 12.3 21.8 21.5 253 263 A Q T 3 S+ 0 0 48 48,-0.2 2,-0.1 47,-0.2 47,-0.1 0.554 76.8 111.8 -94.0 -10.5 12.5 25.6 21.0 254 264 A A < - 0 0 0 -3,-1.7 -3,-0.0 45,-0.1 -12,-0.0 -0.440 50.3-165.7 -65.4 134.9 12.7 26.2 24.7 255 265 A V - 0 0 1 -2,-0.1 2,-0.4 50,-0.1 -12,-0.1 -0.924 12.5-141.9-128.8 107.5 16.1 27.6 25.8 256 266 A P - 0 0 5 0, 0.0 2,-0.6 0, 0.0 5,-0.2 -0.497 17.0-154.5 -70.3 122.7 17.1 27.6 29.5 257 267 A V + 0 0 13 -2,-0.4 2,-0.2 4,-0.1 -18,-0.1 -0.873 35.1 124.2-107.2 118.5 19.0 30.8 30.3 258 268 A E S > S- 0 0 40 -2,-0.6 4,-1.8 -19,-0.1 5,-0.2 -0.750 75.5 -54.0-147.0-167.7 21.5 30.7 33.2 259 269 A V H > S+ 0 0 112 -2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.824 127.0 53.9 -48.6 -42.1 25.1 31.5 33.9 260 270 A H H > S+ 0 0 52 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.965 109.7 43.6 -61.3 -55.4 26.5 29.1 31.2 261 271 A M H > S+ 0 0 0 1,-0.2 4,-3.0 2,-0.2 -1,-0.2 0.815 110.9 57.6 -62.3 -28.7 24.5 30.5 28.3 262 272 A W H X S+ 0 0 10 -4,-1.8 4,-2.4 2,-0.2 -1,-0.2 0.944 108.1 45.4 -66.6 -45.2 25.3 34.0 29.4 263 273 A H H X S+ 0 0 95 -4,-2.0 4,-3.4 2,-0.2 5,-0.4 0.940 115.0 48.7 -61.7 -47.2 29.0 33.5 29.2 264 274 A I H X>S+ 0 0 2 -4,-2.4 4,-2.8 1,-0.2 5,-0.6 0.948 110.1 50.8 -57.7 -51.4 28.6 31.7 25.9 265 275 A A H X5S+ 0 0 0 -4,-3.0 6,-2.6 1,-0.2 4,-1.0 0.909 118.0 39.1 -53.9 -44.4 26.5 34.5 24.5 266 276 A Q H X5S+ 0 0 92 -4,-2.4 4,-0.6 4,-0.3 -2,-0.2 0.916 123.1 37.8 -75.0 -44.3 29.0 37.2 25.6 267 277 A R H <5S+ 0 0 127 -4,-3.4 -3,-0.2 -5,-0.2 -2,-0.2 0.915 127.9 30.1 -75.3 -44.8 32.3 35.3 24.8 268 278 A D H <5S+ 0 0 42 -4,-2.8 -3,-0.2 -5,-0.4 -2,-0.2 0.599 135.7 22.3 -95.6 -10.9 31.3 33.5 21.6 269 279 A Y H < - 0 0 24 1,-0.1 4,-3.1 -4,-0.1 5,-0.4 -0.956 70.0 -89.0-170.7 159.0 17.9 39.8 34.9 283 293 A P H > S+ 0 0 115 0, 0.0 4,-1.5 0, 0.0 5,-0.1 0.894 126.8 44.0 -46.5 -45.1 14.4 38.6 34.2 284 294 A Q H > S+ 0 0 29 2,-0.2 4,-1.6 1,-0.2 -8,-0.1 0.949 117.0 44.6 -66.6 -47.5 14.1 40.9 31.1 285 295 A T H > S+ 0 0 0 -5,-0.2 4,-3.2 2,-0.2 5,-0.2 0.891 110.3 53.3 -65.1 -42.1 17.6 40.2 29.8 286 296 A N H X S+ 0 0 47 -4,-3.1 4,-2.5 1,-0.2 -1,-0.2 0.909 109.4 50.2 -59.6 -41.5 17.4 36.4 30.2 287 297 A K H X S+ 0 0 141 -4,-1.5 4,-1.6 -5,-0.4 -1,-0.2 0.868 111.7 48.6 -62.8 -38.4 14.2 36.4 28.3 288 298 A E H X S+ 0 0 19 -4,-1.6 4,-2.8 2,-0.2 -2,-0.2 0.929 109.2 51.3 -68.1 -46.7 15.8 38.5 25.5 289 299 A L H X S+ 0 0 0 -4,-3.2 4,-2.3 1,-0.2 5,-0.2 0.938 108.6 53.4 -56.5 -44.7 18.9 36.2 25.4 290 300 A G H X S+ 0 0 3 -4,-2.5 4,-1.4 1,-0.2 -1,-0.2 0.875 109.6 47.5 -57.8 -38.5 16.4 33.3 25.1 291 301 A N H X S+ 0 0 74 -4,-1.6 4,-2.6 2,-0.2 5,-0.3 0.903 107.2 57.0 -68.9 -41.6 14.8 35.0 22.1 292 302 A F H X S+ 0 0 58 -4,-2.8 4,-1.9 1,-0.2 -2,-0.2 0.930 107.8 47.8 -54.3 -48.8 18.2 35.7 20.5 293 303 A F H X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 5,-0.3 0.828 109.5 52.8 -65.4 -32.8 19.0 32.0 20.5 294 304 A R H X S+ 0 0 52 -4,-1.4 4,-3.0 -5,-0.2 -1,-0.2 0.944 110.3 46.3 -68.9 -45.5 15.7 31.0 19.1 295 305 A S H < S+ 0 0 100 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.847 116.0 48.6 -65.9 -29.2 16.0 33.4 16.1 296 306 A L H < S+ 0 0 42 -4,-1.9 -2,-0.2 -5,-0.3 -1,-0.2 0.940 126.9 20.9 -74.9 -47.4 19.6 32.2 15.6 297 307 A W H < S- 0 0 2 -4,-2.6 3,-0.4 1,-0.2 -2,-0.2 0.656 97.5-142.8 -99.2 -19.0 18.9 28.4 15.7 298 308 A G >< - 0 0 19 -4,-3.0 3,-1.6 -5,-0.3 -1,-0.2 -0.558 56.3 -13.9 97.3-160.5 15.3 28.0 14.9 299 309 A P T 3 S+ 0 0 96 0, 0.0 3,-0.3 0, 0.0 -1,-0.2 0.717 136.2 46.8 -56.1 -28.1 12.5 25.6 16.2 300 310 A Y T >> S+ 0 0 81 -3,-0.4 4,-1.8 1,-0.2 3,-0.7 -0.033 70.3 128.9-107.6 31.8 15.1 23.3 17.8 301 311 A A H <> + 0 0 0 -3,-1.6 4,-3.3 1,-0.3 5,-0.2 0.882 68.9 59.6 -51.3 -45.4 17.1 26.0 19.5 302 312 A G H 3> S+ 0 0 0 -50,-1.3 4,-1.8 -3,-0.3 -1,-0.3 0.894 105.0 48.5 -51.8 -44.7 16.9 24.2 22.9 303 313 A W H <> S+ 0 0 4 -51,-0.9 4,-1.4 -3,-0.7 -1,-0.2 0.925 112.1 48.6 -62.3 -43.8 18.6 21.1 21.3 304 314 A A H >X S+ 0 0 0 -4,-1.8 4,-1.7 1,-0.2 3,-0.5 0.934 107.2 56.4 -60.1 -47.8 21.3 23.4 19.9 305 315 A Q H 3X S+ 0 0 15 -4,-3.3 4,-3.3 1,-0.3 5,-0.3 0.882 102.3 57.0 -49.8 -42.1 21.7 25.0 23.3 306 316 A A H 3X S+ 0 0 6 -4,-1.8 4,-3.5 -5,-0.2 5,-0.3 0.907 102.6 54.9 -60.2 -40.8 22.4 21.6 24.7 307 317 A V H X S+ 0 0 33 -4,-3.3 4,-1.9 -5,-0.3 3,-0.7 0.943 113.4 44.3 -57.6 -49.1 26.0 23.9 27.0 310 320 A S H 3X S+ 0 0 2 -4,-3.5 4,-1.7 -5,-0.3 -1,-0.2 0.887 112.4 51.0 -63.2 -41.7 27.3 20.3 27.1 311 321 A A H 3< S+ 0 0 10 -4,-2.3 -1,-0.2 -5,-0.3 -2,-0.2 0.601 108.3 55.4 -73.0 -11.0 30.6 21.2 25.3 312 322 A D H X< S+ 0 0 28 -4,-0.9 3,-1.1 -3,-0.7 -2,-0.2 0.894 104.6 49.4 -85.9 -45.9 31.1 24.0 27.8 313 323 A L H 3< S+ 0 0 58 -4,-1.9 2,-0.7 1,-0.3 -2,-0.2 0.906 104.8 62.1 -56.7 -41.4 30.8 21.8 30.9 314 324 A R T 3< 0 0 121 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.1 -0.031 360.0 360.0 -76.1 33.5 33.4 19.5 29.2 315 325 A Q < 0 0 133 -3,-1.1 -3,-0.1 -2,-0.7 0, 0.0 -0.899 360.0 360.0-169.9 360.0 35.9 22.3 29.2