==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=30-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/DNA 31-JAN-06 2FVQ . COMPND 2 MOLECULE: 5'- . SOURCE 2 SYNTHETIC: YES; . AUTHOR S.P.MONTANO,M.L.COTE,M.J.ROTH,M.M.GEORGIADIS . 255 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13151.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 162 63.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 6 2.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 44 17.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 3 1.2 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 . 23 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 23 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 58 22.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 3 0 1 0 0 0 0 0 0 0 0 0 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 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 . 4 2 0 2 2 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 3 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 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 24 A T > 0 0 136 0, 0.0 4,-1.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 105.2 -2.0 59.7 1.4 2 25 A W H > + 0 0 65 2,-0.2 4,-1.9 1,-0.1 231,-0.0 0.802 360.0 70.6 -91.7 -35.5 1.1 58.0 0.0 3 26 A L H 4 S+ 0 0 102 1,-0.2 7,-0.1 2,-0.2 -1,-0.1 0.786 109.6 37.5 -50.4 -28.0 1.9 56.4 3.3 4 27 A S H 4 S+ 0 0 63 1,-0.1 -1,-0.2 2,-0.0 -2,-0.2 0.849 110.6 55.0 -94.3 -40.9 -1.1 54.2 2.6 5 28 A D H < S+ 0 0 107 -4,-1.0 -2,-0.2 1,-0.3 -3,-0.1 0.694 115.6 40.0 -68.3 -19.0 -1.0 53.7 -1.2 6 29 A F X + 0 0 21 -4,-1.9 4,-0.9 1,-0.1 -1,-0.3 -0.598 63.0 162.6-133.9 74.1 2.6 52.2 -1.0 7 30 A P T 4 S+ 0 0 76 0, 0.0 3,-0.5 0, 0.0 6,-0.2 0.900 78.5 46.7 -55.1 -50.3 2.9 50.0 2.1 8 31 A Q T 4 S+ 0 0 93 1,-0.2 6,-0.1 5,-0.1 5,-0.1 0.834 104.3 61.1 -64.6 -37.7 6.1 48.2 1.0 9 32 A A T 4 S+ 0 0 2 221,-0.1 222,-3.5 4,-0.1 2,-0.4 0.737 90.7 75.9 -66.5 -26.8 8.0 51.4 -0.1 10 33 A W B >X -a 231 0A 4 -4,-0.9 4,-3.8 -3,-0.5 3,-1.4 -0.741 69.9-144.1 -95.7 136.3 8.1 53.1 3.3 11 34 A A H 3> S+ 0 0 26 220,-2.4 4,-0.9 -2,-0.4 -1,-0.1 0.862 103.2 60.5 -58.4 -35.7 10.4 52.1 6.1 12 35 A E H 34 S+ 0 0 100 219,-0.4 -1,-0.3 1,-0.1 4,-0.1 0.686 123.0 17.5 -67.0 -19.6 7.7 52.9 8.5 13 36 A T H <4 S+ 0 0 66 -3,-1.4 -2,-0.2 -6,-0.2 -1,-0.1 0.704 121.6 53.2-122.8 -34.9 5.3 50.4 7.0 14 37 A G H < S- 0 0 25 -4,-3.8 -3,-0.2 1,-0.2 -2,-0.1 0.561 93.9-136.4 -83.5 -7.9 7.3 47.9 4.9 15 38 A G < - 0 0 37 -4,-0.9 -1,-0.2 -5,-0.4 -2,-0.1 -0.118 54.5 -14.7 78.0 177.1 9.8 46.9 7.6 16 39 A M S S- 0 0 60 1,-0.1 114,-0.1 -4,-0.1 213,-0.0 -0.209 79.1-120.2 -51.9 137.5 13.5 46.4 7.1 17 40 A G - 0 0 2 112,-0.3 212,-0.2 113,-0.1 2,-0.2 -0.207 26.5-174.6 -78.6 171.9 14.5 46.2 3.4 18 41 A L - 0 0 58 210,-2.3 2,-1.7 118,-0.0 117,-0.2 -0.717 26.6-132.6-168.2 111.1 16.2 43.4 1.5 19 42 A A > - 0 0 0 115,-2.8 3,-1.6 -2,-0.2 117,-0.3 -0.546 25.7-175.2 -74.5 88.5 17.3 43.8 -2.2 20 43 A V T 3 S+ 0 0 86 -2,-1.7 -1,-0.2 207,-0.9 208,-0.1 0.661 77.2 54.9 -58.7 -24.8 15.9 40.5 -3.5 21 44 A R T 3 S+ 0 0 171 206,-0.5 2,-0.6 -3,-0.1 -1,-0.3 0.576 91.2 91.0 -88.2 -9.5 17.3 40.8 -7.0 22 45 A Q S < S- 0 0 18 -3,-1.6 114,-0.3 1,-0.0 3,-0.1 -0.775 76.9-129.2 -96.0 122.6 20.8 41.3 -5.8 23 46 A A - 0 0 72 -2,-0.6 115,-0.1 1,-0.1 3,-0.1 -0.318 43.6 -88.4 -61.1 143.0 23.1 38.4 -5.3 24 47 A P - 0 0 47 0, 0.0 113,-0.3 0, 0.0 2,-0.2 -0.315 55.6-106.9 -54.4 135.8 24.8 38.3 -1.9 25 48 A L B -c 137 0B 24 111,-2.9 113,-2.9 -3,-0.1 2,-0.5 -0.436 25.1-155.5 -74.6 135.7 28.0 40.3 -2.1 26 49 A I - 0 0 109 -2,-0.2 -1,-0.0 111,-0.2 -3,-0.0 -0.941 11.8-148.4-107.9 127.5 31.5 38.7 -2.2 27 50 A I - 0 0 11 -2,-0.5 2,-0.2 111,-0.2 117,-0.0 -0.842 11.1-142.5-102.5 107.4 34.3 41.0 -1.0 28 51 A P - 0 0 86 0, 0.0 72,-2.0 0, 0.0 2,-0.2 -0.470 12.7-144.5 -71.3 134.1 37.6 40.3 -2.7 29 52 A L B -D 99 0C 69 70,-0.3 70,-0.3 -2,-0.2 69,-0.1 -0.571 28.2 -93.1 -92.7 159.3 40.7 40.7 -0.5 30 53 A K > - 0 0 70 68,-2.5 3,-1.4 -2,-0.2 -1,-0.1 -0.354 45.1-103.0 -66.5 154.9 44.1 42.0 -1.7 31 54 A A T 3 S+ 0 0 106 1,-0.3 -1,-0.1 -3,-0.1 -2,-0.1 0.766 119.1 36.8 -49.9 -37.0 46.5 39.3 -2.9 32 55 A T T 3 S+ 0 0 133 2,-0.0 -1,-0.3 66,-0.0 -2,-0.0 0.430 86.1 131.9-100.3 -0.4 48.6 39.3 0.2 33 56 A S < + 0 0 27 -3,-1.4 -4,-0.1 65,-0.2 65,-0.0 -0.211 28.5 179.2 -59.5 140.2 45.9 39.9 2.8 34 57 A T - 0 0 99 0, 0.0 -4,-0.1 0, 0.0 -2,-0.0 -0.943 41.2 -80.1-135.1 151.0 45.8 37.8 5.9 35 58 A P - 0 0 61 0, 0.0 2,-0.4 0, 0.0 36,-0.1 -0.213 39.3-157.4 -56.3 140.0 43.2 38.0 8.8 36 59 A V - 0 0 22 2,-0.0 36,-2.0 -3,-0.0 2,-0.5 -0.977 2.9-162.7-121.7 133.0 43.8 40.7 11.5 37 60 A S B -e 72 0D 81 -2,-0.4 2,-0.4 34,-0.3 36,-0.2 -0.838 7.7-170.1-121.5 92.2 42.2 40.4 15.0 38 61 A I - 0 0 48 34,-3.4 2,-0.0 -2,-0.5 -2,-0.0 -0.679 26.4-116.9 -83.4 130.9 42.1 43.7 16.8 39 62 A K - 0 0 154 -2,-0.4 2,-0.4 1,-0.1 -1,-0.1 -0.329 26.6-109.9 -68.3 146.7 41.2 43.5 20.5 40 63 A Q - 0 0 27 34,-0.1 -1,-0.1 33,-0.1 3,-0.1 -0.637 31.5-124.8 -78.4 125.7 38.0 45.1 21.8 41 64 A Y - 0 0 117 -2,-0.4 34,-0.1 34,-0.2 -1,-0.1 -0.494 41.7 -89.7 -69.2 138.8 38.8 48.1 24.0 42 65 A P - 0 0 139 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.173 45.8-145.3 -50.0 137.4 37.1 47.8 27.4 43 66 A M - 0 0 36 -3,-0.1 33,-0.0 33,-0.0 -3,-0.0 -0.929 9.8-122.4-115.0 132.3 33.6 49.3 27.3 44 67 A S > - 0 0 67 -2,-0.4 4,-2.7 1,-0.1 5,-0.2 -0.309 27.2-115.6 -65.0 151.8 32.0 51.1 30.2 45 68 A Q H > S+ 0 0 126 1,-0.2 4,-3.2 2,-0.2 5,-0.2 0.897 116.7 55.5 -56.9 -40.3 28.7 49.7 31.4 46 69 A E H > S+ 0 0 103 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.954 109.7 44.7 -57.2 -51.0 27.0 53.0 30.3 47 70 A A H > S+ 0 0 3 1,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.944 115.3 49.2 -57.5 -48.9 28.3 52.7 26.8 48 71 A R H X S+ 0 0 47 -4,-2.7 4,-2.8 1,-0.2 -2,-0.2 0.894 110.9 48.7 -58.9 -44.3 27.4 49.0 26.7 49 72 A L H < S+ 0 0 86 -4,-3.2 -1,-0.2 1,-0.2 -2,-0.2 0.862 110.6 50.9 -66.1 -36.3 23.9 49.6 27.9 50 73 A G H < S+ 0 0 23 -4,-2.3 4,-0.4 -5,-0.2 -1,-0.2 0.847 116.6 41.5 -69.1 -32.9 23.3 52.4 25.4 51 74 A I H >X S+ 0 0 0 -4,-1.9 4,-1.8 -5,-0.2 3,-1.1 0.847 95.0 80.3 -81.4 -39.4 24.5 50.2 22.6 52 75 A K H 3X S+ 0 0 82 -4,-2.8 4,-2.6 1,-0.2 5,-0.2 0.806 87.9 54.4 -37.1 -54.2 22.8 46.9 23.7 53 76 A P H 3> S+ 0 0 76 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.878 108.5 48.9 -54.5 -42.7 19.3 47.8 22.2 54 77 A H H <> S+ 0 0 57 -3,-1.1 4,-2.3 -4,-0.4 -2,-0.2 0.935 112.7 48.4 -64.1 -43.6 20.6 48.5 18.8 55 78 A I H X S+ 0 0 2 -4,-1.8 4,-2.0 1,-0.2 -1,-0.2 0.886 111.1 49.9 -64.1 -39.5 22.6 45.2 18.8 56 79 A Q H X S+ 0 0 82 -4,-2.6 4,-2.6 -5,-0.2 -1,-0.2 0.911 110.3 50.5 -67.1 -40.3 19.5 43.3 20.0 57 80 A R H X S+ 0 0 102 -4,-2.2 4,-2.5 -5,-0.2 6,-0.2 0.920 110.3 49.3 -62.2 -43.9 17.4 44.8 17.2 58 81 A L H <>S+ 0 0 7 -4,-2.3 5,-2.6 2,-0.2 6,-1.3 0.886 112.0 48.7 -63.8 -38.7 19.9 43.9 14.5 59 82 A L H ><5S+ 0 0 37 -4,-2.0 3,-1.0 2,-0.2 -1,-0.2 0.923 111.1 50.1 -66.0 -43.1 20.1 40.4 15.8 60 83 A D H 3<5S+ 0 0 123 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.882 112.3 47.8 -60.6 -39.5 16.3 40.2 15.8 61 84 A Q T 3<5S- 0 0 68 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.2 0.503 113.6-121.2 -79.3 -5.9 16.4 41.5 12.3 62 85 A G T < 5S+ 0 0 29 -3,-1.0 -3,-0.2 -4,-0.4 -2,-0.1 0.674 81.7 120.6 73.6 15.4 19.0 39.0 11.3 63 86 A I S + 0 0 3 -2,-1.2 4,-3.2 1,-0.2 3,-0.4 0.159 37.4 113.7 -95.5 17.3 36.9 48.9 10.0 93 116 A R H > S+ 0 0 163 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.861 76.7 50.0 -59.4 -36.8 40.1 50.6 9.0 94 117 A E H 4 S+ 0 0 54 -3,-0.4 4,-0.5 2,-0.2 -1,-0.2 0.827 114.7 44.8 -71.1 -30.7 42.3 47.5 9.3 95 118 A V H >> S+ 0 0 0 -3,-0.4 3,-1.3 2,-0.2 4,-0.8 0.918 110.2 55.0 -75.1 -45.8 39.8 45.5 7.3 96 119 A N H >< S+ 0 0 24 -4,-3.2 3,-1.2 1,-0.3 -2,-0.2 0.901 103.3 56.2 -52.3 -44.9 39.5 48.3 4.7 97 120 A K T 3< S+ 0 0 123 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.744 109.8 46.8 -60.8 -23.9 43.3 48.2 4.2 98 121 A R T <4 S+ 0 0 65 -3,-1.3 -68,-2.5 -4,-0.5 2,-0.4 0.497 92.4 92.5 -98.9 -4.0 43.1 44.5 3.4 99 122 A V B << S-D 29 0C 0 -3,-1.2 -70,-0.3 -4,-0.8 2,-0.0 -0.750 86.2-108.1 -92.7 135.0 40.2 44.7 0.9 100 123 A E - 0 0 96 -72,-2.0 -2,-0.1 -2,-0.4 -1,-0.1 -0.372 40.0-114.5 -61.1 135.6 41.0 45.1 -2.8 101 124 A D - 0 0 102 -4,-0.1 2,-0.3 -2,-0.0 -1,-0.1 -0.345 28.4-160.2 -70.9 152.9 40.2 48.6 -4.0 102 125 A I - 0 0 68 -2,-0.1 72,-0.0 0, 0.0 -1,-0.0 -0.872 34.8 -84.4-127.2 163.4 37.5 49.2 -6.6 103 126 A H - 0 0 150 -2,-0.3 2,-0.8 1,-0.1 0, 0.0 -0.540 42.1-120.5 -72.7 128.3 36.9 52.2 -8.8 104 127 A P + 0 0 92 0, 0.0 -1,-0.1 0, 0.0 67,-0.0 -0.574 41.1 167.7 -69.4 107.0 34.9 55.0 -7.1 105 128 A T + 0 0 55 -2,-0.8 -2,-0.0 2,-0.1 69,-0.0 0.588 36.3 110.4 -99.8 -12.8 31.9 55.3 -9.3 106 129 A V - 0 0 35 1,-0.1 93,-0.1 93,-0.0 68,-0.1 -0.507 68.8-131.7 -65.3 120.2 29.7 57.5 -7.1 107 130 A P - 0 0 44 0, 0.0 -2,-0.1 0, 0.0 -1,-0.1 -0.367 21.4-104.9 -71.5 149.2 29.6 60.9 -8.9 108 131 A N > - 0 0 79 1,-0.1 4,-2.3 -2,-0.1 3,-0.4 -0.497 33.3-113.8 -72.7 146.9 30.2 64.1 -6.9 109 132 A P H > S+ 0 0 32 0, 0.0 4,-2.8 0, 0.0 5,-0.3 0.898 112.3 58.3 -45.3 -53.0 27.0 66.0 -6.2 110 133 A Y H > S+ 0 0 172 1,-0.2 4,-1.6 2,-0.2 -2,-0.0 0.912 111.8 40.5 -47.0 -52.6 28.0 69.0 -8.3 111 134 A N H > S+ 0 0 92 -3,-0.4 4,-1.0 1,-0.2 -1,-0.2 0.891 111.9 56.7 -65.6 -38.5 28.4 66.9 -11.4 112 135 A L H < S+ 0 0 28 -4,-2.3 3,-0.4 1,-0.2 -1,-0.2 0.893 108.6 47.6 -59.7 -40.8 25.3 64.8 -10.6 113 136 A L H >< S+ 0 0 10 -4,-2.8 3,-1.0 1,-0.2 -1,-0.2 0.853 95.5 71.6 -70.3 -34.5 23.2 68.0 -10.5 114 137 A S H 3< S+ 0 0 87 -4,-1.6 2,-1.2 1,-0.3 -1,-0.2 0.870 86.6 69.4 -49.0 -37.4 24.5 69.4 -13.8 115 138 A G T 3< S+ 0 0 44 -4,-1.0 -1,-0.3 -3,-0.4 -2,-0.1 0.002 77.4 105.5 -73.2 35.2 22.5 66.7 -15.4 116 139 A L < - 0 0 28 -2,-1.2 -1,-0.1 -3,-1.0 -3,-0.0 -0.906 62.3-147.3-122.9 104.4 19.3 68.5 -14.5 117 140 A P - 0 0 47 0, 0.0 3,-0.4 0, 0.0 136,-0.0 -0.276 19.0-126.6 -65.0 149.3 17.5 70.3 -17.3 118 141 A P S S+ 0 0 102 0, 0.0 136,-0.0 0, 0.0 134,-0.0 0.719 103.9 72.1 -69.4 -19.3 15.5 73.6 -16.5 119 142 A S S S+ 0 0 69 1,-0.1 2,-0.8 2,-0.1 88,-0.1 0.905 85.3 65.5 -62.1 -47.9 12.5 71.9 -18.1 120 143 A H + 0 0 21 -3,-0.4 88,-0.3 1,-0.2 -1,-0.1 -0.712 54.7 151.9 -83.0 110.1 11.8 69.4 -15.3 121 144 A Q + 0 0 59 -2,-0.8 2,-0.8 86,-0.6 131,-0.2 0.326 41.1 93.9-122.1 6.8 10.8 71.5 -12.3 122 145 A W E -I 207 0G 45 85,-2.1 85,-2.5 87,-0.1 2,-0.3 -0.895 62.3-168.1-103.3 110.1 8.5 69.1 -10.4 123 146 A Y E -IJ 206 240G 0 117,-2.5 117,-1.6 -2,-0.8 2,-0.4 -0.707 24.5-175.1-107.7 152.6 10.7 67.3 -7.8 124 147 A T E -I 205 0G 0 81,-1.9 81,-3.2 -2,-0.3 2,-0.4 -0.990 12.6-163.9-139.0 125.3 10.4 64.3 -5.5 125 148 A V E -IJ 204 237G 2 112,-2.3 112,-2.0 -2,-0.4 2,-0.4 -0.952 6.7-173.5-116.0 134.7 13.3 63.5 -3.1 126 149 A L E -I 203 0G 2 77,-2.6 77,-2.8 -2,-0.4 2,-0.6 -0.978 14.2-156.8-129.7 141.2 13.6 60.2 -1.4 127 150 A D E -I 202 0G 32 -2,-0.4 105,-2.7 105,-0.3 2,-0.3 -0.976 21.4-137.4-117.0 114.7 16.0 59.0 1.3 128 151 A L B > -B 231 0A 7 73,-2.6 3,-0.6 -2,-0.6 2,-0.4 -0.573 20.5-128.6 -74.5 132.8 16.4 55.3 1.3 129 152 A K T 3 S- 0 0 101 101,-4.1 101,-0.3 -2,-0.3 -112,-0.3 -0.710 80.7 -10.4 -88.0 130.4 16.4 53.9 4.9 130 153 A D T 3> S+ 0 0 59 -2,-0.4 4,-0.6 3,-0.1 -1,-0.3 0.931 78.9 174.4 48.5 52.4 19.2 51.6 5.9 131 154 A A T X4 S+ 0 0 4 -3,-0.6 3,-2.0 1,-0.2 4,-0.5 0.949 71.3 49.6 -52.6 -58.8 20.4 51.4 2.3 132 155 A F G >4 S+ 0 0 26 1,-0.3 3,-2.0 2,-0.2 33,-0.9 0.885 104.7 58.6 -51.3 -46.1 23.6 49.3 3.0 133 156 A F G 34 S+ 0 0 15 1,-0.3 -1,-0.3 31,-0.2 -2,-0.2 0.657 93.0 70.1 -60.6 -15.8 21.7 46.8 5.2 134 157 A C G << S+ 0 0 1 -3,-2.0 -115,-2.8 -4,-0.6 2,-0.6 0.739 85.3 78.7 -73.9 -20.8 19.5 46.1 2.2 135 158 A L S < S- 0 0 1 -3,-2.0 30,-2.2 -4,-0.5 -115,-0.1 -0.781 81.0-134.4 -93.9 119.5 22.4 44.4 0.4 136 159 A R B -L 164 0H 80 -2,-0.6 -111,-2.9 -114,-0.3 2,-0.5 -0.321 11.0-135.2 -68.8 152.4 23.1 40.8 1.5 137 160 A L B -c 25 0B 3 26,-3.0 -111,-0.2 -113,-0.3 5,-0.1 -0.934 24.6-113.9-108.1 129.8 26.7 39.7 2.2 138 161 A H >> - 0 0 62 -113,-2.9 3,-1.8 -2,-0.5 4,-1.0 -0.354 28.4-116.8 -60.0 139.6 27.7 36.3 0.9 139 162 A P G >4 S+ 0 0 80 0, 0.0 3,-0.5 0, 0.0 -1,-0.1 0.814 114.9 59.3 -47.2 -35.7 28.5 33.9 3.8 140 163 A T G 34 S+ 0 0 106 1,-0.2 4,-0.2 2,-0.2 -114,-0.1 0.812 109.0 42.5 -66.5 -30.6 32.1 33.7 2.6 141 164 A S G <4 S+ 0 0 7 -3,-1.8 3,-0.4 -116,-0.3 4,-0.3 0.529 95.9 81.8 -94.5 -4.8 32.6 37.5 3.1 142 165 A Q S X< S+ 0 0 33 -4,-1.0 3,-1.6 -3,-0.5 20,-0.4 0.912 80.6 59.5 -67.8 -43.8 30.7 37.7 6.4 143 166 A P G > S+ 0 0 46 0, 0.0 3,-1.6 0, 0.0 -72,-0.3 0.787 91.2 75.1 -56.3 -25.7 33.5 36.6 8.8 144 167 A L G 3 S+ 0 0 9 -3,-0.4 -2,-0.2 1,-0.3 -72,-0.1 0.798 95.4 46.9 -56.4 -32.8 35.5 39.5 7.6 145 168 A F G < S+ 0 0 0 -3,-1.6 -1,-0.3 -4,-0.3 17,-0.1 0.113 81.3 141.1-102.4 22.8 33.5 42.1 9.5 146 169 A A < + 0 0 0 -3,-1.6 -73,-1.7 15,-0.1 2,-0.3 -0.195 22.1 175.6 -67.4 153.7 33.3 40.4 12.9 147 170 A F E -G 160 0E 0 13,-2.3 13,-2.6 -75,-0.2 2,-0.3 -0.956 33.1 -96.8-150.2 162.2 33.5 42.2 16.2 148 171 A E E -G 159 0E 51 -75,-0.5 2,-0.5 -2,-0.3 11,-0.2 -0.639 30.0-169.9 -88.9 139.2 33.2 41.2 19.9 149 172 A W - 0 0 6 9,-3.7 2,-0.4 -2,-0.3 7,-0.1 -0.949 4.0-167.2-131.5 115.2 30.0 41.6 21.8 150 173 A R + 0 0 111 -2,-0.5 7,-0.1 5,-0.1 8,-0.0 -0.821 14.9 176.0-102.9 139.3 30.0 41.1 25.6 151 174 A D > - 0 0 20 -2,-0.4 3,-0.7 5,-0.4 -2,-0.0 -0.661 24.6-151.8-139.7 75.5 26.8 40.8 27.6 152 175 A P T 3 S+ 0 0 77 0, 0.0 -1,-0.3 0, 0.0 3,-0.2 0.655 82.9 35.4 -10.9-105.2 28.2 40.1 31.2 153 176 A E T 3 S- 0 0 146 1,-0.2 2,-0.2 2,-0.0 -2,-0.0 0.766 137.0 -34.8 -29.1 -51.3 25.7 38.1 33.2 154 177 A M S < S+ 0 0 142 -3,-0.7 -1,-0.2 -4,-0.0 2,-0.1 -0.728 87.4 99.5 178.5 129.3 24.6 36.1 30.0 155 178 A G + 0 0 35 1,-0.3 2,-0.2 -3,-0.2 -5,-0.1 -0.489 68.2 15.5-169.8-116.0 24.2 36.8 26.3 156 179 A I - 0 0 26 -2,-0.1 -5,-0.4 -7,-0.1 -1,-0.3 -0.507 61.8-126.4 -83.5 153.1 26.3 36.1 23.2 157 180 A S - 0 0 101 2,-0.2 -1,-0.1 -2,-0.2 3,-0.1 0.850 68.4 -75.7 -66.3 -37.1 29.3 33.7 23.3 158 181 A G S S+ 0 0 14 1,-0.3 -9,-3.7 -11,-0.1 2,-0.3 -0.116 99.0 55.1 175.6 -69.6 31.7 36.4 21.9 159 182 A Q E -FG 67 148E 33 -92,-0.6 -92,-2.1 -11,-0.2 -1,-0.3 -0.695 45.1-179.6-100.6 149.0 31.7 37.4 18.2 160 183 A L E -FG 66 147E 0 -13,-2.6 -13,-2.3 -2,-0.3 2,-0.3 -0.923 7.6-176.1-133.7 155.4 29.0 38.7 16.0 161 184 A T E -F 65 0E 2 -96,-2.1 -96,-2.4 -2,-0.3 2,-0.2 -0.961 26.8 -92.6-150.0 167.7 29.2 39.7 12.3 162 185 A W E -F 64 0E 19 -20,-0.4 -98,-0.2 -2,-0.3 -17,-0.2 -0.531 13.5-169.8 -86.6 147.0 27.1 41.2 9.6 163 186 A T S S+ 0 0 20 -100,-1.8 -26,-3.0 -2,-0.2 2,-0.3 0.305 80.2 55.4-109.5 2.5 25.0 39.4 6.9 164 187 A R B S-L 136 0H 25 -101,-0.5 -28,-0.2 -28,-0.3 -31,-0.2 -0.841 106.7 -75.6-130.1 166.1 24.5 42.7 5.1 165 188 A L - 0 0 0 -30,-2.2 2,-0.2 -33,-0.9 -30,-0.2 -0.435 62.9-140.2 -60.1 125.0 26.8 45.4 3.7 166 189 A P > - 0 0 0 0, 0.0 3,-1.0 0, 0.0 6,-0.2 -0.514 8.9-105.8 -99.3 165.1 28.0 47.3 6.7 167 190 A Q T 3 S+ 0 0 100 1,-0.2 3,-0.1 -2,-0.2 -77,-0.1 -0.442 104.6 35.8 -71.4 153.5 28.7 50.9 7.8 168 191 A G T 3 S+ 0 0 45 1,-0.2 2,-0.6 -2,-0.1 -1,-0.2 0.257 81.5 123.5 86.4 -15.3 32.4 51.7 7.9 169 192 A F X - 0 0 4 -3,-1.0 3,-2.3 1,-0.1 -1,-0.2 -0.745 62.3-137.6 -84.9 120.3 33.4 49.5 5.0 170 193 A K T 3 S+ 0 0 66 -2,-0.6 4,-0.3 1,-0.3 -1,-0.1 0.748 99.3 48.0 -47.9 -33.2 35.2 51.7 2.4 171 194 A N T 3> S+ 0 0 16 1,-0.2 4,-2.6 2,-0.1 -1,-0.3 0.443 82.4 95.3 -92.5 0.5 33.4 50.2 -0.6 172 195 A S H <> S+ 0 0 0 -3,-2.3 4,-2.9 1,-0.2 5,-0.3 0.937 82.4 50.5 -58.1 -50.0 29.8 50.3 0.7 173 196 A P H > S+ 0 0 50 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.931 115.7 42.3 -53.2 -50.1 28.8 53.6 -0.9 174 197 A T H > S+ 0 0 15 -4,-0.3 4,-2.4 2,-0.2 5,-0.2 0.893 114.9 49.4 -65.1 -42.7 30.1 52.5 -4.4 175 198 A L H X S+ 0 0 35 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.904 114.1 45.7 -65.5 -41.6 28.6 48.9 -4.1 176 199 A F H X S+ 0 0 0 -4,-2.9 4,-2.6 -5,-0.3 5,-0.3 0.944 111.7 51.6 -66.2 -46.7 25.3 50.2 -3.0 177 200 A D H X S+ 0 0 4 -4,-2.6 4,-1.8 -5,-0.3 -2,-0.2 0.920 113.0 44.6 -56.5 -46.2 25.2 52.9 -5.7 178 201 A E H X S+ 0 0 66 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.885 112.3 52.7 -66.3 -39.3 26.0 50.4 -8.5 179 202 A A H X S+ 0 0 0 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.917 110.8 45.6 -63.3 -44.9 23.5 47.8 -7.1 180 203 A L H X S+ 0 0 0 -4,-2.6 4,-1.8 1,-0.2 -1,-0.2 0.844 108.9 57.0 -68.4 -33.3 20.6 50.3 -7.1 181 204 A H H X S+ 0 0 66 -4,-1.8 4,-0.5 -5,-0.3 -1,-0.2 0.908 108.0 47.9 -63.2 -39.2 21.6 51.5 -10.5 182 205 A R H >< S+ 0 0 131 -4,-1.9 3,-0.7 1,-0.2 4,-0.4 0.898 112.3 48.6 -67.2 -41.3 21.2 47.9 -11.8 183 206 A D H 3< S+ 0 0 20 -4,-2.0 4,-0.3 1,-0.2 -1,-0.2 0.767 116.0 43.0 -70.6 -25.8 17.8 47.5 -10.0 184 207 A L H 3X S+ 0 0 0 -4,-1.8 4,-2.0 1,-0.1 -1,-0.2 0.368 83.7 98.0-102.1 4.6 16.5 50.8 -11.5 185 208 A A H S+ 0 0 99 -4,-0.4 4,-2.4 1,-0.2 5,-0.2 0.918 108.7 55.1 -59.3 -46.3 14.4 49.1 -16.3 187 210 A F H > S+ 0 0 7 -4,-0.3 4,-0.9 1,-0.3 -1,-0.2 0.870 105.4 52.9 -56.1 -39.9 12.5 51.9 -14.5 188 211 A R H < S+ 0 0 84 -4,-2.0 3,-0.4 1,-0.2 -1,-0.3 0.898 110.5 49.3 -62.5 -37.9 14.7 54.5 -16.3 189 212 A I H < S+ 0 0 116 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.872 109.3 49.2 -69.7 -38.7 13.7 52.8 -19.6 190 213 A Q H < S+ 0 0 114 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.610 116.7 44.9 -77.9 -9.6 10.0 52.7 -18.9 191 214 A H >< + 0 0 55 -4,-0.9 3,-1.2 -3,-0.4 -1,-0.3 -0.519 65.4 160.8-133.4 65.8 10.1 56.4 -17.9 192 215 A P T 3 S+ 0 0 99 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.805 75.2 53.2 -53.6 -38.7 12.2 58.1 -20.7 193 216 A D T 3 S+ 0 0 122 -3,-0.1 2,-0.1 2,-0.1 15,-0.1 0.645 93.9 87.3 -77.7 -16.3 10.9 61.6 -19.9 194 217 A L < - 0 0 26 -3,-1.2 2,-0.5 -6,-0.2 13,-0.2 -0.446 69.2-140.6 -83.0 158.3 11.7 61.4 -16.2 195 218 A I E -K 206 0G 28 11,-2.2 11,-2.7 -2,-0.1 2,-0.5 -0.962 17.8-172.7-123.8 114.0 15.0 62.4 -14.7 196 219 A L E -K 205 0G 8 -2,-0.5 2,-0.5 9,-0.2 9,-0.2 -0.923 4.0-167.1-111.7 123.1 16.4 60.3 -11.9 197 220 A L E -K 204 0G 11 7,-2.6 7,-2.0 -2,-0.5 2,-0.5 -0.907 5.7-163.4-107.6 133.9 19.5 61.3 -10.0 198 221 A Q E +K 203 0G 2 -2,-0.5 2,-0.4 5,-0.2 5,-0.2 -0.977 18.5 169.2-121.8 125.7 21.1 58.7 -7.7 199 222 A Y E > -K 202 0G 68 3,-1.8 3,-3.3 -2,-0.5 2,-0.3 -0.820 68.9 -78.1-132.7 88.7 23.6 59.6 -5.0 200 223 A V T 3 S- 0 0 15 -2,-0.4 -1,-0.2 1,-0.3 -20,-0.0 -0.346 116.8 -7.9 53.0-109.3 24.0 56.4 -3.0 201 224 A D T 3 S+ 0 0 53 -2,-0.3 -73,-2.6 -3,-0.1 2,-0.7 0.356 117.6 93.3 -96.7 6.0 20.8 56.4 -0.9 202 225 A D E < -IK 127 199G 43 -3,-3.3 -3,-1.8 -75,-0.2 2,-0.4 -0.881 57.4-172.5-105.2 111.7 19.7 59.9 -1.9 203 226 A L E -IK 126 198G 0 -77,-2.8 -77,-2.6 -2,-0.7 2,-0.4 -0.827 13.0-170.4-108.2 141.5 17.3 60.0 -4.8 204 227 A L E -IK 125 197G 1 -7,-2.0 -7,-2.6 -2,-0.4 2,-0.5 -0.975 4.2-166.2-131.1 115.7 15.8 62.9 -6.8 205 228 A L E -IK 124 196G 1 -81,-3.2 -81,-1.9 -2,-0.4 2,-0.5 -0.895 9.5-168.9-102.2 127.9 13.0 62.3 -9.3 206 229 A A E +IK 123 195G 0 -11,-2.7 -11,-2.2 -2,-0.5 2,-0.2 -0.975 8.0 174.7-124.5 125.4 12.4 65.3 -11.7 207 230 A A E -I 122 0G 0 -85,-2.5 -85,-2.1 -2,-0.5 -86,-0.6 -0.744 36.7-124.9-121.0 168.8 9.4 65.6 -14.0 208 231 A T S S+ 0 0 74 -88,-0.3 -87,-0.4 -2,-0.2 2,-0.3 0.880 92.3 25.0 -80.7 -40.7 8.1 68.3 -16.4 209 232 A S S > S- 0 0 41 -87,-0.1 4,-1.9 -89,-0.1 5,-0.2 -0.785 79.8-112.9-122.9 165.9 4.7 68.6 -14.9 210 233 A E H > S+ 0 0 99 -2,-0.3 4,-2.0 1,-0.2 5,-0.1 0.825 117.2 54.3 -65.4 -31.7 3.0 67.9 -11.5 211 234 A L H > S+ 0 0 91 2,-0.2 4,-2.4 1,-0.2 5,-0.3 0.904 107.8 47.5 -69.8 -42.4 1.0 65.1 -13.0 212 235 A D H > S+ 0 0 61 1,-0.2 4,-2.8 2,-0.2 -2,-0.2 0.880 112.5 50.6 -65.4 -37.6 4.1 63.3 -14.4 213 236 A C H X S+ 0 0 0 -4,-1.9 4,-3.2 2,-0.2 5,-0.2 0.902 108.9 52.8 -66.7 -39.5 5.8 63.8 -11.0 214 237 A Q H X S+ 0 0 53 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.980 119.5 32.5 -57.3 -60.0 2.6 62.3 -9.3 215 238 A Q H X S+ 0 0 96 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.799 117.7 56.9 -68.3 -31.1 2.6 59.2 -11.5 216 239 A G H X S+ 0 0 2 -4,-2.8 4,-2.1 -5,-0.3 -2,-0.2 0.953 109.3 45.1 -65.1 -47.5 6.4 59.2 -11.7 217 240 A T H X S+ 0 0 0 -4,-3.2 4,-2.6 1,-0.2 5,-0.3 0.858 111.1 53.4 -63.7 -37.6 6.7 59.1 -7.9 218 241 A R H X S+ 0 0 96 -4,-1.9 4,-2.3 -5,-0.2 -1,-0.2 0.914 111.1 46.1 -63.5 -44.1 4.0 56.4 -7.6 219 242 A A H X S+ 0 0 24 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.862 114.0 48.3 -67.6 -37.3 5.9 54.2 -10.1 220 243 A L H X S+ 0 0 0 -4,-2.1 4,-3.4 2,-0.2 5,-0.3 0.968 113.5 44.7 -68.0 -54.2 9.2 54.7 -8.4 221 244 A L H X S+ 0 0 0 -4,-2.6 4,-2.7 1,-0.2 5,-0.2 0.924 114.1 52.6 -55.3 -43.9 8.0 54.1 -4.9 222 245 A Q H X S+ 0 0 87 -4,-2.3 4,-2.0 -5,-0.3 -1,-0.2 0.949 112.9 42.9 -57.1 -51.0 6.2 51.1 -6.3 223 246 A T H X S+ 0 0 40 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.944 113.1 51.4 -61.2 -51.0 9.4 49.7 -7.9 224 247 A L H X>S+ 0 0 0 -4,-3.4 5,-2.6 1,-0.2 4,-0.9 0.909 111.2 48.9 -52.8 -46.8 11.6 50.5 -4.9 225 248 A G H <5S+ 0 0 2 -4,-2.7 3,-0.5 -5,-0.3 -1,-0.2 0.892 111.6 48.4 -62.7 -40.5 9.2 48.6 -2.6 226 249 A N H <5S+ 0 0 79 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.818 109.4 53.4 -70.7 -27.7 9.0 45.6 -4.9 227 250 A L H <5S- 0 0 6 -4,-2.2 -207,-0.9 -5,-0.2 -206,-0.5 0.642 122.2-105.2 -79.8 -15.6 12.8 45.5 -5.2 228 251 A G T <5S+ 0 0 6 -4,-0.9 -210,-2.3 -3,-0.5 -3,-0.2 0.575 78.0 126.3 103.0 9.7 13.2 45.5 -1.4 229 252 A Y < - 0 0 0 -5,-2.6 2,-0.4 -212,-0.2 -1,-0.3 -0.570 44.8-147.2 -95.4 164.9 14.3 49.0 -0.7 230 253 A R - 0 0 26 -101,-0.3 -101,-4.1 -2,-0.2 2,-0.3 -0.986 2.9-154.2-139.7 127.1 12.6 51.4 1.7 231 254 A A B -aB 10 128A 1 -222,-3.5 -220,-2.4 -2,-0.4 2,-0.7 -0.665 31.6-103.9 -96.5 152.4 12.3 55.2 1.6 232 255 A S > - 0 0 11 -105,-2.7 4,-1.7 -2,-0.3 -105,-0.3 -0.669 24.8-164.3 -80.0 112.5 11.8 57.4 4.6 233 256 A A T 4 S+ 0 0 26 -2,-0.7 -1,-0.2 1,-0.2 -230,-0.1 0.889 89.1 52.6 -62.6 -38.9 8.2 58.5 4.9 234 257 A K T 4 S+ 0 0 178 1,-0.2 -1,-0.2 -3,-0.1 -2,-0.0 0.916 114.9 37.8 -64.0 -46.8 9.1 61.2 7.3 235 258 A K T 4 S+ 0 0 136 -108,-0.1 -1,-0.2 2,-0.1 -2,-0.2 0.690 87.4 125.0 -80.0 -19.7 11.9 62.8 5.2 236 259 A A < - 0 0 22 -4,-1.7 2,-0.6 -109,-0.1 -110,-0.2 -0.077 45.0-160.5 -47.4 133.1 10.1 62.4 1.9 237 260 A Q E -J 125 0G 31 -112,-2.0 -112,-2.3 7,-0.1 2,-0.3 -0.913 17.9-160.3-118.5 98.2 9.6 65.6 -0.2 238 261 A I E - 0 0 35 -2,-0.6 -114,-0.2 -114,-0.2 -115,-0.1 -0.641 53.9 -31.6 -91.9 140.5 6.8 64.8 -2.7 239 262 A C E S+ 0 0 14 -2,-0.3 -115,-0.2 -26,-0.2 2,-0.2 0.659 85.5 153.6 25.2 44.0 6.0 66.7 -5.9 240 263 A Q E -J 123 0G 110 -117,-1.6 -117,-2.5 -3,-0.3 -1,-0.1 -0.574 48.7-141.8 -89.9 157.4 7.3 70.0 -4.5 241 264 A K S S+ 0 0 95 -119,-0.2 11,-0.7 -2,-0.2 2,-0.4 0.439 95.5 45.4 -95.8 -2.3 8.6 72.7 -6.9 242 265 A Q E S+M 251 0I 84 -119,-0.1 2,-0.3 9,-0.1 -1,-0.2 -0.994 74.4 157.6-140.6 128.8 11.2 73.4 -4.3 243 266 A V E -M 250 0I 3 7,-1.6 7,-2.6 -2,-0.4 2,-0.5 -0.979 39.5-115.2-150.4 162.7 13.2 70.8 -2.4 244 267 A K E +M 249 0I 128 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.876 39.4 166.3-101.2 127.5 16.3 70.2 -0.4 245 268 A Y E > -M 248 0I 6 3,-2.4 3,-1.2 -2,-0.5 -2,-0.1 -0.940 62.2 -17.3-149.4 123.2 18.8 67.7 -2.0 246 269 A L T 3 S- 0 0 40 -2,-0.3 3,-0.1 1,-0.3 -1,-0.0 0.828 127.1 -50.5 55.2 37.7 22.4 67.0 -1.3 247 270 A G T 3 S+ 0 0 80 1,-0.3 2,-0.3 0, 0.0 -1,-0.3 0.682 117.3 112.9 77.0 16.8 22.8 70.2 0.7 248 271 A Y E < -M 245 0I 62 -3,-1.2 -3,-2.4 2,-0.0 2,-0.7 -0.894 64.2-135.7-120.8 152.1 21.3 72.3 -2.1 249 272 A L E -M 244 0I 69 -2,-0.3 2,-0.7 -5,-0.2 -5,-0.2 -0.921 22.6-157.0-106.8 106.9 18.1 74.3 -2.3 250 273 A L E +M 243 0I 5 -7,-2.6 -7,-1.6 -2,-0.7 2,-0.3 -0.781 28.4 150.8 -89.1 117.2 16.6 73.5 -5.7 251 274 A K E > -MN 242 254I 92 3,-0.7 3,-1.1 -2,-0.7 -9,-0.1 -0.962 68.6 -7.6-149.7 126.4 14.2 76.3 -6.7 252 275 A E T 3 S- 0 0 118 -11,-0.7 3,-0.1 -2,-0.3 -10,-0.1 0.848 126.8 -61.1 56.9 33.7 13.3 77.5 -10.2 253 276 A G T 3 S+ 0 0 29 1,-0.2 2,-0.3 -132,-0.1 -1,-0.3 0.834 102.1 145.6 62.8 33.2 16.0 75.2 -11.5 254 277 A Q B < N 251 0I 110 -3,-1.1 -3,-0.7 1,-0.2 -1,-0.2 -0.816 360.0 360.0-107.6 146.2 18.7 77.1 -9.5 255 278 A R 0 0 190 -2,-0.3 -1,-0.2 -5,-0.1 -2,-0.1 0.971 360.0 360.0 73.5 360.0 21.8 75.7 -7.8