==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE, LYASE/DNA 25-OCT-06 2NOL . COMPND 2 MOLECULE: 5'- . SOURCE 2 SYNTHETIC: YES; . AUTHOR A.BANERJEE,C.T.RADOM,G.L.VERDINE . 314 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13598.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 213 67.8 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 . 14 4.5 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 . 120 38.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 2 0 1 2 1 1 1 3 0 0 2 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 0 2 2 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 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 S 0 0 113 0, 0.0 9,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 131.2 28.8 -13.2 36.5 2 10 A E + 0 0 158 4,-0.0 2,-0.3 0, 0.0 4,-0.1 0.467 360.0 82.1 -75.5 0.7 25.1 -12.8 37.2 3 11 A F S S+ 0 0 153 2,-0.1 160,-0.1 160,-0.1 2,-0.0 -0.729 77.0 12.0-111.9 158.9 25.7 -10.1 39.8 4 12 A G S S- 0 0 9 -2,-0.3 2,-0.2 158,-0.2 160,-0.0 -0.181 105.0 -25.8 77.6-174.6 26.4 -6.4 39.8 5 13 A H S S- 0 0 20 158,-0.1 2,-0.1 1,-0.1 -2,-0.1 -0.510 72.2-123.5 -72.8 138.2 26.0 -4.0 36.8 6 14 A R - 0 0 37 -2,-0.2 2,-0.3 -4,-0.1 37,-0.1 -0.363 20.0-160.4 -82.4 162.9 26.3 -5.6 33.4 7 15 A T > - 0 0 32 1,-0.1 4,-2.1 -2,-0.1 3,-0.3 -0.988 31.8-116.5-139.7 145.4 28.7 -4.8 30.6 8 16 A L T 4 S+ 0 0 49 -2,-0.3 7,-0.1 1,-0.2 6,-0.1 0.859 119.0 47.5 -47.3 -40.3 28.4 -5.7 26.9 9 17 A A T 4 S+ 0 0 93 1,-0.2 -1,-0.2 2,-0.1 -3,-0.0 0.874 110.6 51.7 -70.1 -40.2 31.6 -7.8 27.3 10 18 A S T 4 S+ 0 0 56 -3,-0.3 -2,-0.2 1,-0.2 -1,-0.2 0.894 125.9 14.1 -67.7 -46.8 30.5 -9.5 30.5 11 19 A T >< + 0 0 23 -4,-2.1 3,-2.4 1,-0.1 4,-0.2 -0.469 65.3 170.7-135.5 67.9 27.1 -10.9 29.5 12 20 A P G > S+ 0 0 84 0, 0.0 3,-2.1 0, 0.0 -1,-0.1 0.824 74.7 63.6 -40.7 -50.3 26.7 -10.7 25.7 13 21 A A G 3 S+ 0 0 85 1,-0.3 64,-0.4 64,-0.1 -5,-0.0 0.703 97.1 58.4 -55.2 -22.2 23.4 -12.7 25.6 14 22 A L G < S+ 0 0 29 -3,-2.4 55,-0.4 62,-0.1 2,-0.3 0.430 91.6 84.7 -91.8 3.8 21.6 -10.0 27.7 15 23 A W < - 0 0 20 -3,-2.1 2,-0.3 -4,-0.2 53,-0.2 -0.814 50.7-173.3-110.1 148.6 22.1 -7.1 25.3 16 24 A A E -A 67 0A 19 51,-2.2 51,-3.2 -2,-0.3 2,-0.2 -0.948 20.0-127.1-131.5 151.6 20.2 -6.0 22.2 17 25 A S E -A 66 0A 54 -2,-0.3 49,-0.2 49,-0.2 47,-0.1 -0.633 12.6-162.6-105.8 161.0 21.0 -3.3 19.7 18 26 A I E -A 65 0A 7 47,-1.2 47,-2.2 -2,-0.2 2,-0.1 -0.978 37.3-115.1-135.5 116.4 19.4 -0.2 18.3 19 27 A P E +A 64 0A 96 0, 0.0 45,-0.2 0, 0.0 44,-0.0 -0.379 58.2 145.1 -55.0 122.7 21.1 1.1 15.1 20 28 A C - 0 0 6 43,-2.0 41,-0.2 -2,-0.1 -2,-0.1 -0.700 38.9-144.2-167.0 107.1 22.3 4.5 16.1 21 29 A P >> - 0 0 34 0, 0.0 3,-2.4 0, 0.0 4,-0.7 -0.418 28.6-115.8 -72.8 150.8 25.6 6.1 14.9 22 30 A R T 34 S+ 0 0 58 40,-1.5 3,-0.3 1,-0.3 41,-0.1 0.754 115.3 68.5 -59.4 -21.3 27.5 8.2 17.4 23 31 A S T 34 S+ 0 0 56 1,-0.2 96,-1.0 95,-0.1 -1,-0.3 0.736 105.0 42.2 -69.1 -19.8 26.8 11.2 15.2 24 32 A E T <4 S+ 0 0 24 -3,-2.4 2,-0.2 1,-0.3 -1,-0.2 0.547 129.7 14.8-100.2 -12.5 23.2 10.8 16.3 25 33 A L < - 0 0 0 -4,-0.7 2,-0.5 -3,-0.3 -1,-0.3 -0.846 46.9-175.6-167.8 129.4 23.9 10.2 20.0 26 34 A R >> - 0 0 70 93,-2.5 3,-2.3 -2,-0.2 4,-1.3 -0.901 11.8-164.7-126.1 97.5 26.8 10.5 22.5 27 35 A L H >> S+ 0 0 3 -2,-0.5 4,-2.3 1,-0.3 3,-0.7 0.887 89.8 55.6 -48.2 -45.5 25.7 9.0 25.8 28 36 A D H 34 S+ 0 0 59 1,-0.2 -1,-0.3 2,-0.2 13,-0.0 0.608 110.4 44.8 -67.6 -12.1 28.6 10.7 27.6 29 37 A L H <4 S+ 0 0 5 -3,-2.3 -1,-0.2 90,-0.2 -2,-0.2 0.581 122.8 35.2-104.6 -14.0 27.5 14.1 26.3 30 38 A V H X< S+ 0 0 0 -4,-1.3 3,-1.3 -3,-0.7 5,-0.5 0.865 109.6 52.2-103.1 -55.8 23.9 13.7 27.0 31 39 A L T 3< S+ 0 0 1 -4,-2.3 8,-0.4 1,-0.2 3,-0.3 0.778 117.1 34.2 -59.5 -34.7 23.3 11.7 30.2 32 40 A P T 3 S+ 0 0 51 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.233 94.4 94.2-105.9 17.1 25.6 13.6 32.7 33 41 A S S < S- 0 0 2 -3,-1.3 -2,-0.1 3,-0.1 4,-0.1 0.109 105.5 -91.1 -97.3 22.1 24.9 17.0 31.2 34 42 A G S S+ 0 0 10 2,-0.5 3,-0.2 -3,-0.3 -3,-0.1 0.759 103.1 99.0 80.3 22.0 22.1 18.3 33.3 35 43 A Q S S+ 0 0 7 1,-0.6 2,-0.4 -5,-0.5 -4,-0.1 0.792 98.3 11.3 -97.1 -62.2 19.1 17.1 31.2 36 44 A S - 0 0 1 -6,-0.4 -1,-0.6 -5,-0.2 -2,-0.5 -0.907 61.3-165.2-113.3 142.0 18.4 14.0 33.3 37 45 A F S S+ 0 0 7 -2,-0.4 113,-0.1 -3,-0.2 -1,-0.1 0.184 72.4 86.2-111.7 17.0 20.1 13.5 36.6 38 46 A R + 0 0 26 -7,-0.1 12,-0.5 12,-0.1 2,-0.4 0.246 68.6 88.8-101.7 12.1 19.2 9.8 36.9 39 47 A W E +B 49 0A 9 -8,-0.4 2,-0.4 -3,-0.3 10,-0.2 -0.932 46.5 179.6-119.0 132.8 22.1 8.3 35.0 40 48 A R E -B 48 0A 99 8,-2.4 8,-2.8 -2,-0.4 2,-1.7 -0.967 32.7-128.4-128.4 144.0 25.5 7.2 36.3 41 49 A E E + 0 0 95 -2,-0.4 6,-0.2 6,-0.2 4,-0.1 -0.565 36.3 168.6 -87.3 74.4 28.5 5.6 34.5 42 50 A Q E S+ 0 0 73 -2,-1.7 -1,-0.2 4,-0.2 5,-0.1 0.822 72.3 26.1 -57.3 -34.8 28.8 2.7 36.9 43 51 A S E > S-B 46 0A 27 3,-1.2 3,-2.9 -3,-0.2 -1,-0.1 -0.967 111.3 -81.3-126.8 145.8 31.2 1.0 34.5 44 52 A P T 3 S+ 0 0 111 0, 0.0 3,-0.1 0, 0.0 -2,-0.1 -0.218 117.1 1.0 -50.2 125.7 33.4 2.8 32.0 45 53 A A T 3 S+ 0 0 54 1,-0.2 2,-0.4 -4,-0.1 15,-0.4 0.583 111.8 105.5 70.5 12.7 31.3 3.6 29.0 46 54 A H E < -B 43 0A 20 -3,-2.9 -3,-1.2 13,-0.1 2,-0.5 -0.986 52.9-162.0-126.2 122.1 28.2 2.0 30.5 47 55 A W E - C 0 58A 20 11,-3.0 11,-2.6 -2,-0.4 2,-0.4 -0.902 5.1-169.3-110.5 125.9 25.4 4.1 31.9 48 56 A S E +BC 40 57A 3 -8,-2.8 -8,-2.4 -2,-0.5 2,-0.3 -0.901 23.4 125.4-115.7 141.9 22.8 2.8 34.3 49 57 A G E -BC 39 56A 0 7,-1.7 7,-2.5 -2,-0.4 2,-0.5 -0.970 58.6 -74.1-173.4 177.0 19.5 4.5 35.3 50 58 A V E + C 0 55A 7 -12,-0.5 2,-0.4 -2,-0.3 5,-0.2 -0.793 45.5 174.5 -94.5 128.5 15.8 4.1 35.6 51 59 A L - 0 0 10 3,-3.3 3,-0.4 -2,-0.5 35,-0.1 -0.972 68.3 -10.9-138.7 119.7 13.9 4.4 32.4 52 60 A A S S- 0 0 61 -2,-0.4 -1,-0.1 1,-0.2 3,-0.1 0.928 128.9 -54.7 59.5 45.3 10.2 3.8 32.0 53 61 A D S S+ 0 0 128 1,-0.2 2,-0.3 116,-0.1 -1,-0.2 0.786 123.1 88.0 59.6 32.4 10.0 2.4 35.5 54 62 A Q S S- 0 0 50 -3,-0.4 -3,-3.3 115,-0.1 2,-0.4 -0.961 79.5-105.8-149.9 159.4 12.7 -0.2 35.0 55 63 A V E +CD 50 70A 1 15,-1.0 15,-2.2 -2,-0.3 2,-0.3 -0.759 39.6 176.2 -96.4 138.1 16.5 -0.2 35.3 56 64 A W E -CD 49 69A 1 -7,-2.5 -7,-1.7 -2,-0.4 2,-0.4 -0.877 23.4-151.7-133.5 164.8 18.7 -0.2 32.2 57 65 A T E -CD 48 68A 0 11,-1.6 11,-1.3 -2,-0.3 2,-0.4 -0.993 20.0-167.2-137.3 129.6 22.4 -0.0 31.3 58 66 A L E +CD 47 67A 0 -11,-2.6 -11,-3.0 -2,-0.4 2,-0.3 -0.921 14.2 161.5-122.7 147.8 23.4 1.5 28.0 59 67 A T E - D 0 66A 9 7,-1.7 7,-3.4 -2,-0.4 2,-0.3 -0.966 20.1-144.0-156.1 155.2 26.6 1.5 26.1 60 68 A Q E - D 0 65A 35 -15,-0.4 5,-0.2 -2,-0.3 2,-0.2 -0.941 10.7-164.8-135.4 155.5 27.5 2.2 22.5 61 69 A T - 0 0 60 3,-2.5 3,-0.2 -2,-0.3 -39,-0.1 -0.523 57.2 -72.5-114.8-174.4 29.8 1.2 19.6 62 70 A E S S+ 0 0 74 1,-0.2 -40,-1.5 -2,-0.2 3,-0.0 0.877 129.2 8.3 -51.3 -43.3 30.5 3.0 16.4 63 71 A E S S+ 0 0 120 -42,-0.2 -43,-2.0 -41,-0.1 2,-0.4 0.300 119.1 70.6-125.1 10.4 27.1 2.3 14.9 64 72 A Q E -A 19 0A 58 -45,-0.2 -3,-2.5 -3,-0.2 2,-0.6 -0.970 55.7-149.1-137.2 147.9 25.0 0.7 17.7 65 73 A L E -AD 18 60A 0 -47,-2.2 -47,-1.2 -2,-0.4 2,-0.5 -0.955 27.4-153.2-107.6 112.5 23.3 1.6 21.0 66 74 A H E -AD 17 59A 21 -7,-3.4 -7,-1.7 -2,-0.6 2,-0.3 -0.803 14.8-171.5 -93.2 128.4 23.5 -1.6 23.1 67 75 A C E +AD 16 58A 0 -51,-3.2 -51,-2.2 -2,-0.5 2,-0.3 -0.912 13.3 179.4-122.9 148.2 20.7 -1.9 25.7 68 76 A T E - D 0 57A 0 -11,-1.3 -11,-1.6 -2,-0.3 2,-0.3 -0.992 12.8-153.5-145.6 133.9 20.1 -4.3 28.6 69 77 A V E - D 0 56A 1 -55,-0.4 2,-0.5 7,-0.4 -13,-0.2 -0.793 8.3-150.5-110.4 155.2 17.1 -4.3 31.1 70 78 A Y E D 0 55A 10 -15,-2.2 -15,-1.0 -2,-0.3 5,-0.0 -0.939 360.0 360.0-124.0 104.2 16.8 -5.6 34.7 71 79 A R 0 0 94 -2,-0.5 -1,-0.1 -17,-0.1 4,-0.1 0.756 360.0 360.0 -99.7 360.0 13.2 -6.7 35.4 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 0 137 0, 0.0 2,-0.1 0, 0.0 -2,-0.1 0.000 360.0 360.0 360.0 169.0 11.8 -13.4 36.0 74 84 A Q - 0 0 86 1,-0.1 2,-0.4 -3,-0.0 -3,-0.1 -0.408 360.0-107.9 -65.5 136.3 14.6 -15.1 34.1 75 85 A A + 0 0 68 -2,-0.1 2,-0.3 -4,-0.1 -1,-0.1 -0.518 54.8 156.0 -68.9 121.5 17.2 -12.6 32.8 76 86 A S - 0 0 53 -2,-0.4 -7,-0.4 -7,-0.2 -62,-0.1 -0.937 46.2 -78.9-143.5 165.8 16.9 -12.1 29.0 77 87 A R - 0 0 54 -64,-0.4 -62,-0.2 -2,-0.3 -9,-0.1 -0.121 63.8 -84.2 -59.9 160.7 17.7 -9.6 26.3 78 88 A P - 0 0 6 0, 0.0 -1,-0.1 0, 0.0 -11,-0.1 -0.364 45.0-121.8 -67.5 150.1 15.3 -6.6 26.0 79 89 A T > - 0 0 58 -3,-0.1 4,-3.0 1,-0.1 5,-0.3 -0.515 25.0-105.6 -89.6 160.3 12.2 -7.1 23.9 80 90 A P H > S+ 0 0 100 0, 0.0 4,-1.8 0, 0.0 5,-0.1 0.891 123.1 50.0 -50.9 -43.3 11.3 -5.0 20.8 81 91 A D H > S+ 0 0 135 2,-0.2 4,-1.0 1,-0.2 3,-0.2 0.945 111.5 47.8 -61.2 -48.5 8.6 -3.2 22.8 82 92 A E H >> S+ 0 0 32 1,-0.2 4,-1.3 2,-0.2 3,-0.8 0.898 109.2 53.8 -58.6 -42.2 11.1 -2.5 25.6 83 93 A L H 3X S+ 0 0 22 -4,-3.0 4,-2.2 1,-0.3 -1,-0.2 0.859 101.7 60.1 -61.5 -34.2 13.7 -1.3 23.1 84 94 A E H 3X S+ 0 0 104 -4,-1.8 4,-2.6 -5,-0.3 -1,-0.3 0.809 97.0 59.9 -63.7 -29.4 11.0 1.1 21.7 85 95 A A H S+ 0 0 58 -4,-2.2 5,-2.0 1,-0.2 4,-0.4 0.929 111.4 47.1 -59.7 -45.8 14.0 4.9 21.3 88 98 A K H ><5S+ 0 0 60 -4,-2.6 3,-1.4 1,-0.2 -1,-0.2 0.922 108.1 56.3 -62.3 -43.0 11.2 7.2 22.5 89 99 A Y H 3<5S+ 0 0 17 -4,-2.5 35,-2.9 1,-0.3 -1,-0.2 0.870 115.5 36.9 -56.4 -40.9 13.3 8.3 25.5 90 100 A F T 3<5S- 0 0 0 -4,-1.9 -1,-0.3 33,-0.2 -2,-0.2 0.337 104.6-129.6 -94.2 5.9 16.1 9.5 23.1 91 101 A Q T X 5 + 0 0 35 -3,-1.4 3,-2.1 -4,-0.4 -3,-0.2 0.869 39.4 174.2 46.4 45.0 13.6 10.7 20.5 92 102 A L T 3 < + 0 0 22 -5,-2.0 -1,-0.1 1,-0.3 -4,-0.1 0.567 63.3 74.9 -59.6 -10.9 15.6 8.8 17.9 93 103 A D T 3 S+ 0 0 140 -6,-0.2 2,-0.5 -5,-0.1 -1,-0.3 0.753 81.7 77.9 -75.3 -21.8 13.0 9.5 15.2 94 104 A V S < S- 0 0 33 -3,-2.1 2,-0.8 1,-0.0 3,-0.1 -0.763 87.3-129.6 -87.7 132.0 14.4 13.1 14.9 95 105 A T >> - 0 0 69 -2,-0.5 4,-1.6 1,-0.2 3,-0.5 -0.726 14.3-163.3 -86.3 109.8 17.6 13.2 12.9 96 106 A L H 3> S+ 0 0 0 -2,-0.8 4,-3.3 1,-0.2 5,-0.2 0.875 89.4 61.7 -58.7 -37.0 20.3 15.1 14.8 97 107 A A H 3> S+ 0 0 53 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.893 103.2 49.2 -56.8 -43.0 22.3 15.4 11.6 98 108 A Q H <> S+ 0 0 131 -3,-0.5 4,-2.1 2,-0.2 -1,-0.2 0.924 113.7 45.5 -63.8 -44.8 19.5 17.3 9.9 99 109 A L H X S+ 0 0 27 -4,-1.6 4,-2.7 1,-0.2 5,-0.3 0.945 112.2 51.0 -63.7 -48.2 19.2 19.7 12.9 100 110 A Y H X S+ 0 0 28 -4,-3.3 4,-2.8 1,-0.2 -1,-0.2 0.882 108.4 53.3 -56.2 -41.4 23.0 20.2 13.1 101 111 A H H X S+ 0 0 133 -4,-2.2 4,-2.1 -5,-0.2 -1,-0.2 0.964 111.6 44.3 -58.1 -55.9 23.2 21.0 9.4 102 112 A H H X S+ 0 0 84 -4,-2.1 4,-1.3 2,-0.2 3,-0.5 0.959 115.4 45.8 -55.0 -57.9 20.6 23.7 9.7 103 113 A W H >X S+ 0 0 1 -4,-2.7 3,-0.9 1,-0.2 4,-0.8 0.939 114.3 50.5 -52.7 -47.4 21.9 25.3 12.8 104 114 A G H 3< S+ 0 0 17 -4,-2.8 3,-0.3 -5,-0.3 7,-0.3 0.809 106.1 54.8 -61.6 -32.0 25.4 25.1 11.4 105 115 A S H 3< S+ 0 0 80 -4,-2.1 -1,-0.3 -3,-0.5 -2,-0.2 0.721 116.7 36.5 -76.1 -20.5 24.4 26.7 8.1 106 116 A V H << S+ 0 0 68 -4,-1.3 2,-0.2 -3,-0.9 -1,-0.2 0.363 120.7 45.8-111.0 3.7 22.9 29.8 9.9 107 117 A D X - 0 0 11 -4,-0.8 4,-2.5 -3,-0.3 3,-0.5 -0.716 55.4-169.3-153.0 97.7 25.5 30.1 12.7 108 118 A S H > S+ 0 0 107 1,-0.3 4,-2.6 -2,-0.2 5,-0.1 0.878 92.5 54.6 -50.6 -45.2 29.2 29.9 12.2 109 119 A H H > S+ 0 0 52 1,-0.2 4,-2.3 2,-0.2 -1,-0.3 0.897 108.0 48.6 -59.9 -40.8 29.9 29.6 15.9 110 120 A F H > S+ 0 0 0 -3,-0.5 4,-4.0 2,-0.2 5,-0.3 0.935 108.5 54.2 -64.3 -44.7 27.5 26.7 16.2 111 121 A Q H X S+ 0 0 64 -4,-2.5 4,-1.6 -7,-0.3 -2,-0.2 0.943 108.5 50.3 -54.0 -46.0 29.2 25.0 13.3 112 122 A E H < S+ 0 0 66 -4,-2.6 4,-0.4 2,-0.2 -1,-0.2 0.932 116.6 39.5 -59.2 -46.9 32.5 25.4 15.1 113 123 A V H >X S+ 0 0 24 -4,-2.3 3,-2.2 1,-0.2 4,-1.2 0.956 112.1 56.6 -67.0 -49.3 31.2 23.9 18.3 114 124 A A H 3< S+ 0 0 11 -4,-4.0 -1,-0.2 1,-0.3 -2,-0.2 0.741 93.3 69.7 -54.0 -27.4 29.2 21.2 16.6 115 125 A Q T 3< S+ 0 0 85 -4,-1.6 -1,-0.3 -5,-0.3 3,-0.2 0.787 112.8 29.1 -64.5 -24.4 32.4 20.0 14.8 116 126 A K T <4 S+ 0 0 72 -3,-2.2 -2,-0.2 -4,-0.4 -1,-0.2 0.532 119.5 52.7-112.0 -10.8 33.6 18.7 18.2 117 127 A F < + 0 0 39 -4,-1.2 3,-0.5 3,-0.0 -1,-0.2 -0.516 69.6 160.6-127.9 68.6 30.4 17.9 20.1 118 128 A Q + 0 0 76 -2,-0.2 -94,-0.1 1,-0.2 3,-0.1 -0.357 52.5 39.8 -83.8 163.8 28.3 15.6 18.0 119 129 A G + 0 0 0 -96,-1.0 -93,-2.5 1,-0.2 2,-1.0 0.644 68.4 142.8 75.7 16.5 25.5 13.4 19.2 120 130 A V + 0 0 1 -3,-0.5 -1,-0.2 -95,-0.2 2,-0.2 -0.790 23.3 157.1 -93.5 103.1 24.0 15.8 21.7 121 131 A R - 0 0 2 -2,-1.0 2,-0.4 -95,-0.1 -30,-0.1 -0.592 41.6 -97.2-116.0-178.8 20.3 15.3 21.5 122 132 A L - 0 0 0 -2,-0.2 2,-0.2 -32,-0.2 181,-0.1 -0.834 28.0-134.1-105.6 135.8 17.4 16.0 23.8 123 133 A L - 0 0 0 -2,-0.4 2,-0.9 -93,-0.1 -33,-0.2 -0.594 13.1-133.2 -84.3 148.3 15.8 13.4 26.0 124 134 A R - 0 0 87 -35,-2.9 124,-0.2 -2,-0.2 2,-0.2 -0.879 39.2-169.8 -99.5 100.3 11.9 13.1 26.2 125 135 A Q - 0 0 2 122,-2.9 -89,-0.0 -2,-0.9 -35,-0.0 -0.505 28.0 -96.4 -95.9 162.5 11.4 12.9 29.9 126 136 A D > - 0 0 77 -2,-0.2 4,-2.7 1,-0.1 5,-0.2 -0.549 34.6-128.2 -72.3 135.2 8.5 12.2 32.2 127 137 A P H > S+ 0 0 3 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.858 104.0 45.8 -52.8 -45.3 6.7 15.4 33.3 128 138 A I H > S+ 0 0 13 2,-0.2 4,-2.5 1,-0.2 5,-0.4 0.987 115.3 44.3 -65.3 -58.7 6.8 14.6 37.0 129 139 A E H > S+ 0 0 18 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.883 118.4 46.6 -52.0 -41.9 10.4 13.4 37.2 130 140 A C H X S+ 0 0 0 -4,-2.7 4,-2.3 2,-0.2 -1,-0.2 0.940 109.7 51.8 -69.1 -47.7 11.4 16.4 35.1 131 141 A L H X S+ 0 0 0 -4,-2.8 4,-0.8 -5,-0.2 -2,-0.2 0.914 117.2 38.0 -56.7 -46.8 9.5 19.0 37.0 132 142 A F H X S+ 0 0 0 -4,-2.5 4,-1.3 2,-0.2 -1,-0.2 0.834 111.4 57.8 -78.5 -29.7 10.8 18.1 40.4 133 143 A S H >< S+ 0 0 1 -4,-1.9 3,-0.5 -5,-0.4 4,-0.3 0.959 111.7 43.0 -63.4 -47.6 14.4 17.3 39.2 134 144 A F H 3< S+ 0 0 8 -4,-2.3 4,-0.5 1,-0.2 -1,-0.2 0.674 103.8 62.9 -74.2 -15.5 14.7 20.8 37.9 135 145 A I H >< S+ 0 0 0 -4,-0.8 3,-0.5 1,-0.2 -1,-0.2 0.846 106.5 48.9 -72.4 -28.8 13.0 22.4 40.9 136 146 A C T << S+ 0 0 0 -4,-1.3 -2,-0.2 -3,-0.5 -1,-0.2 0.592 100.6 68.9 -80.8 -12.6 16.1 20.9 42.6 137 147 A S T > + 0 0 15 -4,-0.3 3,-0.8 -3,-0.1 -1,-0.2 0.620 69.9 113.2 -85.0 -14.3 18.4 22.4 40.0 138 148 A S T < S- 0 0 29 -3,-0.5 3,-0.1 -4,-0.5 56,-0.1 -0.331 90.5 -5.5 -66.8 138.3 18.1 26.1 40.8 139 149 A N T 3 S+ 0 0 140 1,-0.2 2,-0.3 -2,-0.1 -1,-0.3 0.921 118.3 101.3 46.4 51.5 21.1 28.1 42.2 140 150 A N S < S- 0 0 36 -3,-0.8 2,-0.3 4,-0.0 -1,-0.2 -0.955 71.8-110.9-155.7 166.4 22.9 24.8 42.3 141 151 A N > - 0 0 90 -2,-0.3 4,-2.5 -3,-0.1 3,-0.3 -0.812 30.5-114.1-108.6 149.4 25.5 22.7 40.5 142 152 A I H > S+ 0 0 43 -2,-0.3 4,-2.0 1,-0.2 5,-0.2 0.791 111.5 58.0 -49.5 -38.5 24.9 19.4 38.6 143 153 A A H > S+ 0 0 76 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.975 113.1 37.8 -59.7 -54.7 27.0 17.3 40.9 144 154 A R H >> S+ 0 0 92 -3,-0.3 4,-2.3 1,-0.2 3,-0.7 0.931 112.3 57.7 -62.2 -48.1 24.9 18.2 44.0 145 155 A I H 3X S+ 0 0 5 -4,-2.5 4,-2.5 1,-0.3 5,-0.2 0.883 103.6 55.0 -49.1 -44.1 21.6 18.2 42.1 146 156 A T H 3X S+ 0 0 17 -4,-2.0 4,-1.2 -5,-0.2 -1,-0.3 0.871 108.2 48.2 -58.8 -40.0 22.3 14.6 41.1 147 157 A G H -E 166 0B 11 3,-2.6 3,-2.5 -2,-0.5 2,-0.3 -0.990 69.8 -39.9-122.2 119.2 22.8 -4.0 41.5 164 174 A D T 3 S- 0 0 99 -2,-0.5 -160,-0.1 1,-0.3 -2,-0.0 -0.486 124.9 -30.1 61.9-121.0 26.0 -4.3 43.6 165 175 A D T 3 S+ 0 0 143 -2,-0.3 2,-0.6 -3,-0.1 -1,-0.3 0.157 117.9 103.2-111.4 17.5 25.4 -1.9 46.5 166 176 A V E < -E 163 0B 36 -3,-2.5 -3,-2.6 2,-0.0 2,-0.6 -0.894 54.0-162.9-103.7 122.5 23.2 0.5 44.4 167 177 A T E -E 162 0B 56 -2,-0.6 2,-0.3 -5,-0.2 -5,-0.2 -0.920 11.3-146.3-107.5 119.4 19.5 0.3 44.9 168 178 A Y E - 0 0 21 -7,-2.8 -8,-4.0 -2,-0.6 -7,-0.4 -0.659 14.7-170.6 -88.6 138.3 17.3 1.9 42.2 169 179 A H E -E 159 0B 27 -2,-0.3 -10,-0.2 -10,-0.3 2,-0.1 -0.852 23.5-117.1-121.9 157.1 14.1 3.6 42.9 170 180 A G - 0 0 2 -12,-2.8 -14,-0.1 -2,-0.3 3,-0.1 -0.476 49.5 -84.7 -84.6 165.4 11.4 4.9 40.7 171 181 A F - 0 0 25 -14,-0.2 -1,-0.1 -2,-0.1 -42,-0.1 -0.527 56.5 -99.6 -71.5 137.9 10.7 8.6 40.7 172 182 A P - 0 0 3 0, 0.0 -15,-0.2 0, 0.0 2,-0.2 -0.075 35.2-119.7 -54.5 155.7 8.2 9.6 43.6 173 183 A S > - 0 0 59 -17,-0.5 4,-2.8 1,-0.1 5,-0.2 -0.524 24.8-107.6 -93.5 164.5 4.5 10.1 42.8 174 184 A L H > S+ 0 0 7 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.945 120.7 53.9 -54.5 -50.0 2.7 13.4 43.5 175 185 A Q H 4 S+ 0 0 122 1,-0.2 4,-0.3 2,-0.2 -1,-0.2 0.873 110.5 45.9 -53.0 -43.5 0.9 11.8 46.4 176 186 A A H >4 S+ 0 0 30 1,-0.2 3,-1.5 2,-0.2 -1,-0.2 0.949 114.2 47.4 -66.9 -47.0 4.1 10.8 48.0 177 187 A L H 3< S+ 0 0 0 -4,-2.8 -2,-0.2 1,-0.3 26,-0.2 0.797 112.0 51.3 -63.8 -27.3 5.7 14.2 47.4 178 188 A A T 3< S+ 0 0 13 -4,-2.7 -1,-0.3 -5,-0.2 -2,-0.2 0.493 89.1 123.8 -86.3 -3.7 2.6 15.8 48.8 179 189 A G S X S- 0 0 14 -3,-1.5 3,-1.3 -4,-0.3 4,-0.3 -0.020 73.6 -82.7 -57.3 160.2 2.8 13.6 51.9 180 190 A P T 3 S+ 0 0 114 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 -0.419 110.2 6.8 -68.0 135.5 3.0 15.0 55.4 181 191 A E T 3> S+ 0 0 161 -2,-0.1 4,-1.7 -3,-0.1 5,-0.1 0.659 83.6 133.3 68.7 19.1 6.4 16.1 56.7 182 192 A V H <> S+ 0 0 2 -3,-1.3 4,-3.1 2,-0.2 5,-0.2 0.920 70.2 52.1 -64.9 -43.8 8.0 15.6 53.3 183 193 A E H > S+ 0 0 68 -4,-0.3 4,-2.8 2,-0.2 5,-0.2 0.948 107.9 49.3 -57.7 -52.9 9.8 19.0 53.5 184 194 A A H > S+ 0 0 53 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.908 114.3 47.9 -52.5 -43.0 11.3 18.4 56.9 185 195 A H H X S+ 0 0 83 -4,-1.7 4,-0.6 2,-0.2 -2,-0.2 0.932 110.0 49.6 -65.4 -47.5 12.5 15.1 55.6 186 196 A L H ><>S+ 0 0 0 -4,-3.1 5,-1.9 1,-0.2 3,-0.7 0.864 108.4 56.4 -60.2 -35.3 13.9 16.5 52.4 187 197 A R H ><5S+ 0 0 109 -4,-2.8 3,-2.2 1,-0.3 5,-0.4 0.946 105.3 48.7 -61.1 -48.3 15.7 19.1 54.6 188 198 A K H 3<5S+ 0 0 185 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.604 108.1 57.9 -68.5 -7.4 17.4 16.4 56.6 189 199 A L T <<5S- 0 0 37 -3,-0.7 -1,-0.3 -4,-0.6 -2,-0.2 0.369 122.1-109.0 -98.9 -1.3 18.3 14.9 53.2 190 200 A G T < 5S+ 0 0 32 -3,-2.2 -3,-0.2 -5,-0.1 -2,-0.1 0.713 76.8 131.6 84.0 24.8 20.1 18.2 52.2 191 201 A L > < - 0 0 0 -5,-1.9 3,-1.4 1,-0.2 -4,-0.2 0.518 50.1-157.5 -85.2 -3.0 17.8 19.8 49.6 192 202 A G T > - 0 0 27 -5,-0.4 3,-2.8 -6,-0.3 4,-0.3 -0.212 63.5 -16.8 61.9-153.6 17.9 23.1 51.4 193 203 A Y T >> S+ 0 0 96 1,-0.3 4,-1.0 2,-0.2 3,-0.6 0.644 126.3 80.3 -58.4 -13.0 15.2 25.6 50.8 194 204 A R H <> S+ 0 0 3 -3,-1.4 4,-2.1 1,-0.2 -1,-0.3 0.802 77.8 74.0 -62.5 -28.7 14.4 23.5 47.8 195 205 A A H <> S+ 0 0 0 -3,-2.8 4,-1.8 1,-0.2 -1,-0.2 0.904 94.3 46.4 -51.9 -50.8 12.7 21.2 50.3 196 206 A R H <> S+ 0 0 29 -3,-0.6 4,-3.2 -4,-0.3 5,-0.3 0.884 108.8 57.9 -62.6 -37.7 9.7 23.5 50.7 197 207 A Y H X S+ 0 0 81 -4,-1.0 4,-3.2 1,-0.2 5,-0.3 0.933 105.5 48.4 -57.6 -50.1 9.4 23.9 46.9 198 208 A V H X S+ 0 0 0 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.928 116.6 42.7 -57.7 -48.0 9.0 20.2 46.3 199 209 A S H X S+ 0 0 6 -4,-1.8 4,-2.8 -5,-0.2 5,-0.2 0.975 117.3 45.5 -63.5 -54.8 6.3 19.9 49.0 200 210 A A H X S+ 0 0 40 -4,-3.2 4,-2.3 1,-0.2 -2,-0.2 0.887 114.5 47.4 -57.6 -44.4 4.5 23.1 48.0 201 211 A S H X S+ 0 0 0 -4,-3.2 4,-2.1 -5,-0.3 -1,-0.2 0.883 113.0 49.3 -66.7 -36.7 4.5 22.3 44.3 202 212 A A H X S+ 0 0 0 -4,-1.9 4,-1.5 -5,-0.3 -24,-0.2 0.939 113.9 45.4 -66.2 -45.5 3.4 18.8 44.8 203 213 A R H X S+ 0 0 88 -4,-2.8 4,-3.8 -26,-0.2 -2,-0.2 0.873 112.8 52.1 -65.1 -37.2 0.5 19.9 47.1 204 214 A A H X>S+ 0 0 11 -4,-2.3 5,-2.0 -5,-0.2 4,-1.0 0.892 109.2 46.5 -67.2 -44.0 -0.4 22.7 44.6 205 215 A I H <5S+ 0 0 0 -4,-2.1 6,-3.1 3,-0.2 -1,-0.2 0.836 122.8 38.4 -67.1 -33.4 -0.7 20.5 41.5 206 216 A L H <5S+ 0 0 52 -4,-1.5 -2,-0.2 -5,-0.2 4,-0.2 0.911 126.3 32.4 -84.1 -47.5 -2.7 18.0 43.5 207 217 A E H <5S+ 0 0 139 -4,-3.8 -2,-0.2 -5,-0.2 -3,-0.2 0.222 135.7 15.6 -99.4 14.5 -4.8 20.3 45.6 208 218 A E T <5S+ 0 0 146 -4,-1.0 -3,-0.2 -5,-0.1 -4,-0.1 0.459 119.9 49.9-150.7 -37.9 -5.3 23.3 43.3 209 219 A Q S > S- 0 0 9 -6,-3.1 3,-1.2 1,-0.2 4,-0.9 -0.159 76.2 -23.0 78.6-166.3 -3.7 16.7 39.6 212 222 A L H 3> S+ 0 0 68 1,-0.3 4,-2.3 2,-0.2 3,-0.3 0.817 126.2 66.5 -54.2 -35.8 -1.4 14.9 37.2 213 223 A A H 3> S+ 0 0 65 -3,-0.4 4,-2.8 1,-0.2 -1,-0.3 0.862 94.1 59.6 -56.2 -38.7 -3.7 15.5 34.3 214 224 A W H <> S+ 0 0 40 -3,-1.2 4,-1.0 -4,-0.3 -1,-0.2 0.931 108.5 43.5 -56.1 -48.2 -3.0 19.2 34.6 215 225 A L H >< S+ 0 0 0 -4,-0.9 3,-0.8 -3,-0.3 4,-0.3 0.957 115.3 47.3 -63.4 -52.1 0.7 18.6 33.9 216 226 A Q H >< S+ 0 0 89 -4,-2.3 3,-1.7 1,-0.2 4,-0.3 0.844 104.9 59.5 -60.3 -36.1 0.2 16.1 31.2 217 227 A Q H >X S+ 0 0 55 -4,-2.8 3,-2.2 1,-0.3 4,-1.2 0.819 91.3 71.7 -62.9 -29.6 -2.4 18.4 29.4 218 228 A L T << S+ 0 0 9 -4,-1.0 -1,-0.3 -3,-0.8 8,-0.3 0.704 82.8 70.8 -58.0 -21.3 0.3 21.0 29.1 219 229 A R T <4 S+ 0 0 57 -3,-1.7 -1,-0.3 -4,-0.3 -2,-0.2 0.754 104.4 39.5 -68.6 -23.6 2.0 18.8 26.5 220 230 A E T <4 S+ 0 0 169 -3,-2.2 -2,-0.2 -4,-0.3 -1,-0.2 0.707 103.0 89.1 -94.7 -26.0 -0.8 19.7 24.1 221 231 A S S < S- 0 0 44 -4,-1.2 2,-0.1 1,-0.1 -3,-0.0 -0.048 89.8 -88.0 -64.0 172.1 -0.9 23.3 25.2 222 232 A S > - 0 0 46 1,-0.1 4,-3.0 29,-0.0 5,-0.3 -0.400 32.4-112.5 -81.4 160.8 1.2 26.0 23.6 223 233 A Y H > S+ 0 0 20 1,-0.2 4,-2.6 2,-0.2 5,-0.3 0.933 122.8 48.3 -58.5 -45.9 4.7 26.9 24.7 224 234 A E H > S+ 0 0 130 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.916 114.4 49.7 -58.3 -42.9 3.5 30.3 25.9 225 235 A E H > S+ 0 0 112 2,-0.2 4,-2.6 1,-0.2 3,-0.3 0.990 113.6 41.2 -54.6 -71.9 0.6 28.4 27.6 226 236 A A H X S+ 0 0 0 -4,-3.0 4,-3.3 -8,-0.3 5,-0.3 0.877 113.2 52.7 -46.5 -53.3 2.7 25.8 29.4 227 237 A H H X S+ 0 0 29 -4,-2.6 4,-1.9 -5,-0.3 -1,-0.2 0.908 111.7 47.1 -55.4 -43.2 5.5 28.1 30.5 228 238 A K H < S+ 0 0 78 -4,-1.9 4,-0.3 -3,-0.3 -1,-0.2 0.925 113.3 49.4 -63.6 -44.6 2.9 30.5 32.0 229 239 A A H >< S+ 0 0 21 -4,-2.6 3,-1.7 1,-0.2 4,-0.4 0.948 110.6 48.8 -59.5 -51.9 1.2 27.5 33.7 230 240 A L H >< S+ 0 0 0 -4,-3.3 3,-1.3 1,-0.3 -1,-0.2 0.846 98.2 67.3 -58.7 -37.6 4.4 26.1 35.2 231 241 A C T 3< S+ 0 0 46 -4,-1.9 -1,-0.3 -5,-0.3 -2,-0.2 0.585 87.5 72.1 -62.4 -7.7 5.5 29.4 36.6 232 242 A I T < S+ 0 0 105 -3,-1.7 -1,-0.3 -4,-0.3 -2,-0.2 0.902 80.2 89.7 -71.7 -42.8 2.6 29.2 39.0 233 243 A L S X S- 0 0 5 -3,-1.3 3,-1.8 -4,-0.4 -32,-0.1 -0.211 90.8 -98.8 -60.9 142.1 4.3 26.4 41.0 234 244 A P T 3 S+ 0 0 45 0, 0.0 -33,-0.2 0, 0.0 -1,-0.1 -0.364 108.6 16.7 -61.5 132.5 6.5 27.2 44.0 235 245 A G T 3 S+ 0 0 20 1,-0.2 2,-0.7 -4,-0.1 -97,-0.1 0.450 98.0 116.6 83.5 0.1 10.2 27.1 43.1 236 246 A V < + 0 0 10 -3,-1.8 -1,-0.2 -6,-0.1 2,-0.1 -0.883 36.0 167.5-108.5 107.5 9.5 27.3 39.4 237 247 A G > - 0 0 39 -2,-0.7 4,-3.0 -3,-0.1 5,-0.2 -0.317 55.9 -81.3-101.2-170.6 10.8 30.4 37.6 238 248 A T H > S+ 0 0 62 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.854 129.6 50.6 -62.3 -34.7 11.1 31.1 33.8 239 249 A Q H > S+ 0 0 53 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.951 114.9 40.3 -69.7 -49.4 14.4 29.2 33.7 240 250 A V H > S+ 0 0 5 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.911 114.7 54.6 -65.6 -39.5 13.1 26.0 35.4 241 251 A A H X S+ 0 0 0 -4,-3.0 4,-2.2 1,-0.2 -1,-0.2 0.902 108.5 49.4 -59.8 -40.1 9.8 26.4 33.5 242 252 A D H X S+ 0 0 15 -4,-2.0 4,-2.8 -5,-0.2 5,-0.3 0.907 106.4 54.4 -65.8 -42.7 11.8 26.5 30.3 243 253 A C H X S+ 0 0 8 -4,-2.2 4,-2.6 1,-0.2 5,-0.2 0.923 112.2 45.3 -56.6 -44.3 13.8 23.3 31.2 244 254 A I H X>S+ 0 0 0 -4,-2.2 4,-2.0 2,-0.2 5,-1.2 0.885 112.1 50.3 -68.1 -40.6 10.5 21.5 31.7 245 255 A C H X5S+ 0 0 0 -4,-2.2 6,-2.0 3,-0.2 4,-0.7 0.939 117.5 40.3 -63.3 -46.1 8.9 22.8 28.5 246 256 A L H <5S+ 0 0 5 -4,-2.8 -2,-0.2 4,-0.2 4,-0.2 0.918 124.7 33.7 -68.9 -46.3 11.8 21.8 26.4 247 257 A M H <5S+ 0 0 13 -4,-2.6 -122,-2.9 -5,-0.3 -2,-0.2 0.614 135.0 15.0 -91.6 -12.2 12.7 18.5 28.0 248 258 A A H <5S+ 0 0 0 -4,-2.0 -3,-0.2 -5,-0.2 -2,-0.1 0.577 119.7 52.9-135.0 -19.1 9.3 17.1 29.0 249 259 A L S < + 0 0 11 -6,-2.0 3,-2.0 -7,-0.1 -1,-0.2 -0.718 21.8 176.0-111.2 77.1 8.4 22.4 23.3 252 262 A P T 3 S+ 0 0 27 0, 0.0 50,-1.8 0, 0.0 51,-0.8 0.587 75.0 58.4 -59.9 -10.1 11.5 22.2 21.2 253 263 A Q T 3 S+ 0 0 52 48,-0.2 2,-0.3 47,-0.2 47,-0.1 0.510 76.5 109.7 -98.0 -6.8 11.7 26.0 20.8 254 264 A A < - 0 0 0 -3,-2.0 -3,-0.0 45,-0.1 -12,-0.0 -0.562 53.9-161.2 -70.8 130.5 11.9 26.7 24.6 255 265 A V - 0 0 0 -2,-0.3 2,-0.1 50,-0.1 -12,-0.1 -0.887 9.1-143.5-119.2 101.5 15.4 28.0 25.4 256 266 A P - 0 0 4 0, 0.0 2,-0.6 0, 0.0 -17,-0.1 -0.408 13.2-156.1 -63.6 131.5 16.4 27.7 29.0 257 267 A V + 0 0 11 -2,-0.1 2,-0.1 4,-0.1 -18,-0.1 -0.896 28.9 148.3-116.2 104.0 18.6 30.7 30.0 258 268 A D > - 0 0 29 -2,-0.6 4,-1.5 -19,-0.1 5,-0.1 -0.359 67.2 -75.6-113.3-165.9 20.9 30.1 32.9 259 269 A V H > S+ 0 0 89 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.919 130.4 53.6 -63.6 -42.8 24.3 31.5 33.8 260 270 A H H > S+ 0 0 58 1,-0.2 4,-2.4 2,-0.2 3,-0.3 0.964 111.7 41.9 -55.1 -58.9 25.9 29.2 31.2 261 271 A M H > S+ 0 0 0 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.751 112.7 57.8 -62.4 -23.1 23.7 30.3 28.3 262 272 A W H X S+ 0 0 13 -4,-1.5 4,-1.3 2,-0.2 -1,-0.2 0.896 109.6 41.3 -74.2 -41.2 24.1 33.9 29.6 263 273 A H H X S+ 0 0 96 -4,-2.3 4,-3.0 -3,-0.3 5,-0.4 0.842 112.5 57.0 -74.7 -31.6 27.9 33.8 29.3 264 274 A I H X>S+ 0 0 2 -4,-2.4 4,-2.3 -5,-0.2 5,-0.6 0.906 104.9 50.5 -64.4 -41.6 27.6 32.0 26.0 265 275 A A H X5S+ 0 0 0 -4,-1.7 6,-2.7 3,-0.2 4,-0.9 0.886 117.2 40.7 -63.9 -38.4 25.5 34.8 24.5 266 276 A Q H X5S+ 0 0 69 -4,-1.3 4,-0.8 4,-0.3 -2,-0.2 0.931 122.6 36.4 -75.6 -49.1 28.0 37.4 25.6 267 277 A R H <5S+ 0 0 149 -4,-3.0 -3,-0.2 2,-0.1 -2,-0.2 0.854 128.3 31.9 -74.5 -38.3 31.2 35.7 24.9 268 278 A D H <5S+ 0 0 42 -4,-2.3 -3,-0.2 -5,-0.4 -2,-0.1 0.681 134.3 23.7 -97.7 -20.4 30.3 33.9 21.7 269 279 A Y H < - 0 0 51 -2,-0.9 4,-3.5 1,-0.1 5,-0.4 -0.724 46.8-105.1-105.1 156.5 16.9 39.7 34.7 283 293 A P H > S+ 0 0 105 0, 0.0 4,-0.9 0, 0.0 -1,-0.1 0.795 123.1 44.1 -48.1 -31.2 13.4 38.4 33.9 284 294 A Q H > S+ 0 0 55 2,-0.2 4,-1.9 3,-0.1 -9,-0.1 0.901 116.5 43.0 -81.8 -45.2 13.3 40.9 31.0 285 295 A T H > S+ 0 0 0 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.933 113.2 52.8 -67.1 -44.8 16.8 40.3 29.6 286 296 A N H X S+ 0 0 26 -4,-3.5 4,-2.1 1,-0.2 -1,-0.2 0.894 108.3 51.9 -57.3 -39.3 16.4 36.5 30.0 287 297 A K H X S+ 0 0 58 -4,-0.9 4,-1.6 -5,-0.4 -1,-0.2 0.935 111.3 47.4 -62.2 -44.5 13.2 36.8 28.0 288 298 A E H X S+ 0 0 34 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.893 107.9 53.7 -64.4 -43.5 15.0 38.7 25.3 289 299 A L H X S+ 0 0 0 -4,-3.0 4,-2.6 1,-0.2 5,-0.3 0.950 106.5 54.3 -56.8 -49.0 18.0 36.3 25.1 290 300 A G H X S+ 0 0 3 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.886 108.9 47.0 -51.9 -44.0 15.6 33.4 24.6 291 301 A N H X S+ 0 0 97 -4,-1.6 4,-3.5 2,-0.2 -1,-0.2 0.902 109.3 55.5 -66.2 -38.6 14.0 35.2 21.6 292 302 A F H X S+ 0 0 63 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.953 111.8 41.9 -56.3 -53.3 17.4 36.0 20.2 293 303 A F H X S+ 0 0 0 -4,-2.6 4,-3.0 2,-0.2 5,-0.4 0.881 114.4 52.3 -62.2 -40.0 18.3 32.3 20.3 294 304 A R H X S+ 0 0 58 -4,-2.4 4,-2.3 -5,-0.3 -2,-0.2 0.939 111.1 47.0 -62.8 -44.4 14.9 31.4 19.0 295 305 A S H < S+ 0 0 108 -4,-3.5 -1,-0.2 1,-0.2 -2,-0.2 0.815 116.1 46.2 -67.9 -28.2 15.3 33.8 16.1 296 306 A L H < S+ 0 0 40 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.843 125.0 24.9 -84.0 -35.7 18.8 32.5 15.4 297 307 A W H < S- 0 0 2 -4,-3.0 3,-0.3 1,-0.2 -3,-0.2 0.696 96.4-138.3-105.3 -21.3 18.2 28.8 15.5 298 308 A G >< - 0 0 19 -4,-2.3 3,-1.8 -5,-0.4 -1,-0.2 -0.588 57.3 -17.0 101.6-164.9 14.6 28.3 14.6 299 309 A P T 3 S+ 0 0 94 0, 0.0 3,-0.2 0, 0.0 -1,-0.2 0.618 136.7 48.1 -54.7 -20.2 11.8 26.0 16.0 300 310 A Y T >> + 0 0 83 -3,-0.3 4,-1.8 1,-0.1 3,-0.8 -0.050 68.3 127.3-114.5 30.1 14.4 23.7 17.6 301 311 A A H <> S+ 0 0 0 -3,-1.8 4,-2.7 1,-0.3 -48,-0.2 0.868 70.2 61.7 -53.9 -38.2 16.4 26.4 19.3 302 312 A G H 3> S+ 0 0 0 -50,-1.8 4,-1.7 1,-0.2 -1,-0.3 0.899 104.5 46.9 -56.2 -42.2 16.0 24.5 22.6 303 313 A W H <> S+ 0 0 10 -51,-0.8 4,-1.3 -3,-0.8 -1,-0.2 0.876 109.8 52.3 -68.5 -38.0 17.9 21.6 21.1 304 314 A A H X S+ 0 0 0 -4,-1.8 4,-1.8 1,-0.2 3,-0.3 0.903 107.7 53.7 -63.8 -39.1 20.6 23.8 19.7 305 315 A Q H X S+ 0 0 12 -4,-2.7 4,-3.3 1,-0.2 5,-0.3 0.899 102.1 58.5 -60.2 -41.3 20.9 25.3 23.2 306 316 A A H X S+ 0 0 6 -4,-1.7 4,-2.2 1,-0.2 -1,-0.2 0.854 104.1 51.7 -58.3 -36.5 21.4 21.8 24.6 307 317 A V H X S+ 0 0 0 -4,-1.3 4,-2.6 -3,-0.3 -1,-0.2 0.948 114.7 41.4 -66.6 -47.9 24.4 21.2 22.4 308 318 A L H X S+ 0 0 5 -4,-1.8 4,-2.6 2,-0.2 -2,-0.2 0.885 113.8 51.4 -68.3 -39.4 26.1 24.4 23.6 309 319 A F H X S+ 0 0 36 -4,-3.3 4,-1.5 2,-0.2 -1,-0.2 0.962 113.1 47.1 -61.2 -48.7 25.1 24.0 27.2 310 320 A S H >X S+ 0 0 0 -4,-2.2 4,-0.7 -5,-0.3 3,-0.6 0.938 113.2 47.3 -56.7 -50.6 26.6 20.5 27.1 311 321 A A H >X S+ 0 0 6 -4,-2.6 4,-2.6 1,-0.2 3,-0.9 0.864 108.4 55.8 -61.2 -36.4 29.8 21.7 25.4 312 322 A D H 3< S+ 0 0 23 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.805 95.4 66.4 -68.7 -26.3 30.2 24.5 27.8 313 323 A L H << S+ 0 0 54 -4,-1.5 -1,-0.2 -3,-0.6 -2,-0.2 0.812 115.3 29.4 -63.6 -27.7 30.1 22.1 30.7 314 324 A R H << 0 0 101 -3,-0.9 -2,-0.2 -4,-0.7 -1,-0.1 0.896 360.0 360.0 -94.9 -57.0 33.4 20.7 29.4 315 325 A Q < 0 0 106 -4,-2.6 -3,-0.0 0, 0.0 0, 0.0 0.316 360.0 360.0 -55.9 360.0 35.1 23.7 27.7