==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=23-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/DNA 06-AUG-98 8MHT . COMPND 2 MOLECULE: 5'-D(P*GP*TP*CP*AP*GP*CP*GP*CP*AP*TP*GP*G)-3'; . SOURCE 2 SYNTHETIC: YES; . AUTHOR M.O'GARA,J.R.HORTON,R.J.ROBERTS,X.CHENG . 328 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16095.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 218 66.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 25 7.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 31 9.5 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 0.3 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 . 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 . 25 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 45 13.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 70 21.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.8 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 1 0 0 2 0 0 1 2 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 1 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 0 PARALLEL BRIDGES PER LADDER . 2 1 2 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 ANTIPARALLEL 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 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 1 A M 0 0 96 0, 0.0 2,-0.1 0, 0.0 283,-0.1 0.000 360.0 360.0 360.0 160.5 -29.7 33.0 72.1 2 2 A I - 0 0 61 307,-0.0 2,-0.5 282,-0.0 0, 0.0 -0.301 360.0-111.9 -87.6 171.4 -29.7 33.6 68.4 3 3 A E - 0 0 179 -2,-0.1 2,-0.6 0, 0.0 -1,-0.0 -0.954 21.2-155.9-115.7 125.5 -29.8 30.9 65.7 4 4 A I + 0 0 30 -2,-0.5 3,-0.1 26,-0.2 308,-0.0 -0.873 18.5 170.3-101.5 119.6 -26.8 30.1 63.5 5 5 A K S S+ 0 0 207 -2,-0.6 2,-1.1 1,-0.2 -1,-0.2 0.756 72.7 62.7 -93.7 -33.6 -27.5 28.5 60.1 6 6 A D S S- 0 0 82 1,-0.0 2,-2.3 2,-0.0 -1,-0.2 -0.750 79.5-154.9 -94.0 88.8 -24.0 28.8 58.7 7 7 A K > + 0 0 112 -2,-1.1 3,-1.3 1,-0.2 24,-0.1 -0.365 17.8 176.9 -70.5 78.9 -22.0 26.7 61.1 8 8 A Q T 3 + 0 0 39 -2,-2.3 -1,-0.2 1,-0.2 24,-0.1 0.466 69.0 52.8 -61.7 -4.5 -18.5 28.3 60.7 9 9 A L T > + 0 0 4 22,-1.9 3,-1.6 19,-0.1 -1,-0.2 0.409 67.1 145.2-118.7 8.8 -16.8 26.1 63.3 10 10 A T T < + 0 0 102 -3,-1.3 23,-0.2 21,-0.5 3,-0.1 -0.053 68.0 22.3 -50.0 138.2 -17.4 22.5 62.5 11 11 A G T 3 S+ 0 0 69 21,-0.9 2,-0.2 1,-0.3 -1,-0.2 0.429 93.9 115.7 87.7 -2.8 -14.6 20.1 63.3 12 12 A L < - 0 0 31 -3,-1.6 22,-2.1 20,-0.2 2,-0.3 -0.679 50.7-144.4 -99.9 158.3 -12.8 22.2 65.9 13 13 A R E +a 34 0A 104 -2,-0.2 60,-2.4 20,-0.2 61,-1.2 -0.927 17.5 176.4-123.7 149.8 -12.2 21.3 69.6 14 14 A F E -ab 35 74A 0 20,-2.1 22,-2.0 -2,-0.3 23,-0.6 -0.864 21.9-128.8-142.9 171.2 -12.1 23.5 72.7 15 15 A I E -ab 37 75A 0 59,-1.2 61,-1.7 -2,-0.3 2,-0.7 -0.951 15.8-136.9-125.4 147.5 -11.8 23.3 76.5 16 16 A D E > -ab 38 76A 2 21,-1.8 23,-1.9 -2,-0.3 3,-0.6 -0.765 23.2-174.3-108.4 87.8 -14.0 25.0 79.1 17 17 A L E 3 S+ab 39 77A 2 59,-2.1 61,-0.8 -2,-0.7 23,-0.1 -0.624 73.3 6.5 -86.1 140.8 -12.0 26.6 82.0 18 18 A F T 3 S- 0 0 4 21,-1.0 -1,-0.3 -2,-0.3 60,-0.2 0.960 87.1-176.5 54.5 54.0 -13.8 28.1 85.0 19 19 A A X> + 0 0 1 20,-1.9 3,-2.1 -3,-0.6 4,-0.5 0.783 12.9 166.9 -54.3 -45.5 -16.9 26.7 83.5 20 20 A G T 34 S- 0 0 6 1,-0.3 29,-0.2 2,-0.1 -1,-0.2 -0.413 78.8 -11.6 64.3-121.5 -19.7 27.9 85.7 21 21 A L T 34 S- 0 0 3 -2,-0.3 -1,-0.3 280,-0.2 -2,-0.1 0.633 100.7-103.4 -86.0 -17.0 -23.0 27.2 83.9 22 22 A G T <> + 0 0 0 -3,-2.1 4,-1.8 -4,-0.1 3,-0.5 0.713 66.5 152.1 99.2 25.6 -21.3 26.5 80.6 23 23 A G H X S+ 0 0 0 306,-1.4 4,-1.5 -4,-0.5 -3,-0.1 0.884 74.6 51.4 -54.8 -43.4 -22.1 29.8 78.9 24 24 A F H > S+ 0 0 3 305,-0.6 4,-2.0 -5,-0.3 -1,-0.2 0.832 107.9 55.4 -63.4 -31.9 -19.0 29.5 76.7 25 25 A R H > S+ 0 0 16 -3,-0.5 4,-2.9 2,-0.2 5,-0.3 0.930 104.9 48.3 -68.7 -49.5 -20.1 25.9 75.7 26 26 A L H X S+ 0 0 31 -4,-1.8 4,-2.0 2,-0.2 -1,-0.2 0.933 112.2 52.9 -56.2 -42.9 -23.6 26.8 74.4 27 27 A A H < S+ 0 0 0 -4,-1.5 4,-0.3 -5,-0.2 -2,-0.2 0.953 116.4 35.4 -58.5 -55.7 -22.0 29.7 72.4 28 28 A L H ><>S+ 0 0 3 -4,-2.0 5,-1.5 1,-0.2 3,-1.4 0.881 114.9 54.1 -70.5 -41.7 -19.4 27.5 70.6 29 29 A E H ><5S+ 0 0 71 -4,-2.9 3,-1.6 1,-0.3 -1,-0.2 0.879 98.9 63.7 -61.8 -34.6 -21.4 24.4 70.2 30 30 A S T 3<5S+ 0 0 25 -4,-2.0 -1,-0.3 -5,-0.3 -26,-0.2 0.737 105.1 48.8 -61.5 -18.2 -24.2 26.3 68.5 31 31 A C T < 5S- 0 0 0 -3,-1.4 -22,-1.9 -4,-0.3 -21,-0.5 0.474 127.6 -96.2 -96.5 -10.9 -21.6 27.0 65.8 32 32 A G T < 5S+ 0 0 20 -3,-1.6 -21,-0.9 -4,-0.5 -3,-0.2 0.455 77.6 130.2 112.9 -1.8 -20.4 23.4 65.4 33 33 A A < - 0 0 11 -5,-1.5 2,-0.4 -23,-0.2 -1,-0.2 -0.161 48.8-124.9 -75.9 178.6 -17.3 23.0 67.6 34 34 A E E -a 13 0A 125 -22,-2.1 -20,-2.1 -24,-0.0 2,-0.5 -0.989 6.0-136.2-135.0 131.9 -16.8 20.2 70.2 35 35 A C E +a 14 0A 14 -2,-0.4 -20,-0.2 -22,-0.2 3,-0.1 -0.733 27.3 165.0 -88.2 123.5 -16.0 20.2 73.9 36 36 A V E + 0 0 48 -22,-2.0 2,-0.3 -2,-0.5 -21,-0.2 0.463 64.4 21.1-113.8 -10.9 -13.3 17.7 75.0 37 37 A Y E -a 15 0A 22 -23,-0.6 -21,-1.8 32,-0.1 2,-0.3 -0.974 58.1-179.2-155.3 152.3 -12.4 19.0 78.5 38 38 A S E -a 16 0A 5 -2,-0.3 20,-1.7 -23,-0.2 2,-0.3 -0.974 3.9-169.4-150.3 159.6 -13.9 21.1 81.3 39 39 A N E +ac 17 58A 5 -23,-1.9 -20,-1.9 -2,-0.3 -21,-1.0 -0.926 20.0 141.8-160.5 126.7 -12.9 22.3 84.8 40 40 A E - 0 0 1 18,-2.1 20,-0.0 -2,-0.3 6,-0.0 -0.831 25.9-160.4-166.0 127.9 -14.8 24.1 87.6 41 41 A W + 0 0 137 -2,-0.2 2,-0.5 18,-0.1 19,-0.1 0.497 54.0 110.0 -94.7 -10.2 -14.5 23.5 91.4 42 42 A D > - 0 0 38 1,-0.1 4,-2.2 17,-0.0 3,-0.4 -0.597 65.7-136.8 -72.1 123.5 -17.7 24.9 92.9 43 43 A K H > S+ 0 0 122 -2,-0.5 4,-0.6 1,-0.2 -1,-0.1 0.844 99.6 40.4 -45.2 -47.3 -19.8 22.0 94.2 44 44 A Y H > S+ 0 0 86 2,-0.2 4,-1.9 1,-0.2 3,-0.4 0.816 107.6 58.0 -78.5 -32.3 -23.1 23.3 92.9 45 45 A A H > S+ 0 0 2 -3,-0.4 4,-2.6 1,-0.2 5,-0.2 0.968 104.0 57.9 -59.9 -41.4 -21.9 24.6 89.5 46 46 A Q H X S+ 0 0 35 -4,-2.2 4,-1.7 1,-0.2 -1,-0.2 0.775 104.2 52.3 -56.8 -30.7 -20.8 20.9 89.1 47 47 A E H X S+ 0 0 73 -4,-0.6 4,-2.5 -3,-0.4 -1,-0.2 0.987 110.7 42.6 -72.6 -57.5 -24.5 19.9 89.7 48 48 A V H X S+ 0 0 0 -4,-1.9 4,-2.4 1,-0.2 5,-0.3 0.890 113.3 54.3 -54.5 -45.8 -26.2 22.1 87.0 49 49 A Y H X>S+ 0 0 1 -4,-2.6 4,-3.3 1,-0.2 5,-0.7 0.966 110.6 45.3 -52.3 -53.6 -23.5 21.3 84.5 50 50 A E H X5S+ 0 0 96 -4,-1.7 4,-1.6 1,-0.2 -1,-0.2 0.877 111.5 53.8 -56.9 -43.7 -24.0 17.6 85.0 51 51 A M H <5S+ 0 0 84 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.850 120.1 30.7 -59.5 -40.4 -27.8 18.1 84.8 52 52 A N H <5S+ 0 0 44 -4,-2.4 -2,-0.2 -3,-0.4 -1,-0.2 0.816 135.0 22.4 -92.6 -32.5 -27.6 20.0 81.4 53 53 A F H <5S- 0 0 38 -4,-3.3 -3,-0.2 -5,-0.3 -2,-0.2 0.589 92.2-126.5-111.4 -21.4 -24.6 18.5 79.7 54 54 A G S < - 0 0 39 1,-0.1 3,-1.5 -19,-0.1 -1,-0.2 0.472 51.2-156.2 -8.7 107.6 -8.9 22.7 91.2 61 61 A I G > S+ 0 0 12 1,-0.3 3,-1.5 2,-0.1 -1,-0.1 0.808 86.5 69.4 -64.8 -33.9 -6.9 24.0 88.2 62 62 A T G 3 S+ 0 0 75 1,-0.3 -1,-0.3 3,-0.0 -2,-0.1 0.612 105.1 42.4 -64.0 -11.7 -4.0 25.1 90.3 63 63 A Q G < S+ 0 0 159 -3,-1.5 2,-0.5 -4,-0.1 -1,-0.3 -0.101 87.0 105.2-127.5 39.8 -3.1 21.5 90.9 64 64 A V S < S- 0 0 15 -3,-1.5 2,-0.4 2,-0.0 5,-0.0 -0.981 72.7-122.9-119.4 119.3 -3.6 19.9 87.5 65 65 A N > - 0 0 92 -2,-0.5 3,-2.2 1,-0.1 4,-0.5 -0.495 18.1-134.2 -65.1 122.9 -0.5 19.0 85.6 66 66 A E T 3 S+ 0 0 48 -2,-0.4 3,-0.3 1,-0.3 -1,-0.1 0.639 97.7 66.3 -52.1 -19.0 -0.6 20.9 82.3 67 67 A K T 3 S+ 0 0 135 1,-0.2 -1,-0.3 44,-0.0 -2,-0.1 0.527 87.6 65.3 -87.3 -3.6 0.5 17.8 80.4 68 68 A T S < S+ 0 0 98 -3,-2.2 -1,-0.2 2,-0.1 -2,-0.2 0.794 78.3 107.7 -81.6 -34.2 -2.7 15.7 81.1 69 69 A I S S- 0 0 3 -4,-0.5 3,-0.1 -3,-0.3 -32,-0.1 -0.170 75.4-113.1 -51.2 132.6 -4.8 18.2 79.1 70 70 A P - 0 0 48 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.194 36.9 -94.0 -64.0 155.8 -6.2 17.0 75.7 71 71 A D + 0 0 109 -35,-0.0 2,-0.3 2,-0.0 41,-0.1 -0.499 58.4 163.8 -72.0 146.3 -5.0 18.6 72.5 72 72 A H - 0 0 10 39,-0.3 42,-0.2 -2,-0.1 -58,-0.2 -0.957 43.0-136.0-156.8 172.7 -7.3 21.4 71.3 73 73 A D S S+ 0 0 16 -60,-2.4 42,-1.8 -2,-0.3 2,-0.4 0.629 86.5 34.3-111.8 -20.7 -7.7 24.4 69.0 74 74 A I E -bd 14 115A 4 -61,-1.2 -59,-1.2 40,-0.2 2,-0.6 -0.996 61.6-153.3-143.1 128.6 -9.4 27.1 71.2 75 75 A L E -bd 15 116A 0 40,-2.3 42,-2.6 -2,-0.4 2,-0.5 -0.937 15.0-164.3-106.0 111.0 -9.0 27.8 74.9 76 76 A C E +bd 16 117A 0 -61,-1.7 -59,-2.1 -2,-0.6 2,-0.3 -0.845 18.9 158.1 -97.1 133.0 -12.1 29.4 76.4 77 77 A A E -bd 17 118A 0 40,-2.0 42,-1.0 -2,-0.5 2,-0.6 -0.863 29.3-176.7-162.4 120.0 -11.7 31.1 79.7 78 78 A G - 0 0 1 -61,-0.8 3,-0.1 -2,-0.3 42,-0.1 -0.684 32.8-160.0-112.4 73.0 -13.6 33.7 81.7 79 79 A F - 0 0 6 -2,-0.6 -2,-0.0 1,-0.1 19,-0.0 -0.056 32.2 -66.2 -55.9 154.0 -11.4 34.0 84.8 80 80 A P - 0 0 9 0, 0.0 -1,-0.1 0, 0.0 21,-0.1 -0.026 40.1-168.9 -42.4 136.6 -12.5 35.4 88.2 81 81 A C >> + 0 0 36 1,-0.1 4,-1.6 -3,-0.1 3,-1.5 0.413 58.1 96.5-113.7 2.0 -13.4 39.1 88.5 82 82 A Q T 34 S+ 0 0 53 1,-0.3 8,-0.4 2,-0.2 7,-0.3 0.866 85.8 54.8 -64.5 -29.2 -13.7 40.1 92.2 83 83 A A T 34 S+ 0 0 1 14,-0.2 9,-1.6 1,-0.2 -1,-0.3 0.551 118.4 33.3 -81.3 -1.2 -10.1 41.3 92.4 84 84 A F T <4 S+ 0 0 1 -3,-1.5 -2,-0.2 7,-0.1 -1,-0.2 0.506 88.8 115.7-127.8 -11.2 -10.6 43.8 89.5 85 85 A S >< - 0 0 33 -4,-1.6 3,-1.3 1,-0.1 5,-0.3 -0.233 68.7-126.6 -64.8 151.5 -14.3 44.9 89.8 86 86 A I T 3 S+ 0 0 130 1,-0.3 -1,-0.1 3,-0.1 -4,-0.1 0.516 108.6 60.5 -76.8 -3.0 -15.2 48.5 90.5 87 87 A S T 3 S+ 0 0 72 -5,-0.1 -1,-0.3 0, 0.0 -5,-0.1 0.508 101.8 62.9-100.5 -2.4 -17.4 47.3 93.4 88 88 A G S < S- 0 0 40 -3,-1.3 -5,-0.1 -6,-0.1 -6,-0.0 -0.075 100.8 -82.5-106.5-158.3 -14.5 45.7 95.3 89 89 A K - 0 0 182 -7,-0.3 -6,-0.1 -2,-0.0 -3,-0.1 0.535 53.0-135.3 -85.8 -11.2 -11.2 46.5 97.0 90 90 A Q + 0 0 86 -8,-0.4 -7,-0.1 -5,-0.3 38,-0.1 0.794 46.6 154.9 59.0 41.2 -9.2 46.4 93.7 91 91 A K > - 0 0 107 1,-0.2 3,-2.5 2,-0.1 4,-0.3 0.331 23.5-175.3 -79.8 4.9 -6.3 44.4 95.0 92 92 A G G > - 0 0 1 -9,-1.6 3,-1.6 1,-0.3 6,-0.2 0.070 66.9 -2.5 39.7-131.1 -5.3 43.0 91.6 93 93 A F G 3 S+ 0 0 70 1,-0.3 -1,-0.3 5,-0.1 6,-0.1 0.449 124.9 71.2 -69.7 -3.9 -2.5 40.5 91.6 94 94 A E G < S+ 0 0 177 -3,-2.5 2,-0.4 -11,-0.1 -1,-0.3 0.415 83.5 84.9 -89.1 -3.6 -2.1 40.8 95.4 95 95 A D S X> S- 0 0 22 -3,-1.6 3,-2.4 -4,-0.3 4,-0.6 -0.869 82.1-135.1 -98.6 133.8 -5.4 39.0 95.9 96 96 A S T 34 S+ 0 0 107 -2,-0.4 -1,-0.1 1,-0.3 -3,-0.1 0.471 110.5 54.9 -67.4 -3.1 -5.2 35.2 95.9 97 97 A R T 34 S+ 0 0 114 -5,-0.2 3,-0.3 2,-0.1 -1,-0.3 0.406 101.2 62.8-102.1 -8.2 -8.2 35.3 93.6 98 98 A G T <4 S+ 0 0 2 -3,-2.4 3,-0.5 -6,-0.2 -2,-0.2 0.673 84.5 70.4 -92.9 -15.0 -6.3 37.6 91.2 99 99 A T >< + 0 0 60 -4,-0.6 3,-1.2 1,-0.2 4,-0.3 0.405 64.1 103.0 -84.3 2.7 -3.4 35.3 90.1 100 100 A L T >> + 0 0 19 -3,-0.3 3,-3.5 1,-0.2 4,-1.0 0.901 64.3 73.5 -54.2 -43.7 -5.4 32.9 88.0 101 101 A F H >> S+ 0 0 1 -3,-0.5 4,-2.2 1,-0.3 3,-0.8 0.803 90.1 59.7 -39.9 -40.9 -4.3 34.4 84.7 102 102 A F H <> S+ 0 0 90 -3,-1.2 4,-1.7 1,-0.3 -1,-0.3 0.639 97.9 57.5 -67.3 -14.8 -0.8 32.9 85.1 103 103 A D H <> S+ 0 0 24 -3,-3.5 4,-2.0 -4,-0.3 -1,-0.3 0.764 105.8 51.7 -83.3 -27.1 -2.2 29.4 85.2 104 104 A I H - E 0 165A 12 -2,-0.2 3,-2.5 44,-0.2 4,-0.5 -0.324 44.3-109.8 -80.3 157.4 -15.0 43.4 83.5 122 122 A K G > S+ 0 0 105 42,-1.2 3,-0.9 1,-0.3 43,-0.1 0.833 115.0 59.7 -48.5 -40.8 -14.9 46.9 82.1 123 123 A N G >> S+ 0 0 36 1,-0.2 4,-1.4 2,-0.2 3,-1.3 0.577 83.7 80.9 -69.2 -6.7 -12.5 48.1 84.8 124 124 A F G <4 S+ 0 0 2 -3,-2.5 3,-0.5 1,-0.3 9,-0.3 0.933 89.1 55.1 -64.8 -40.7 -9.9 45.5 83.9 125 125 A A G <4 S+ 0 0 35 -3,-0.9 -1,-0.3 -4,-0.5 -2,-0.2 0.443 117.7 33.7 -71.8 -1.8 -8.7 47.8 81.1 126 126 A S T X> S+ 0 0 84 -3,-1.3 4,-0.7 -4,-0.1 3,-0.6 0.439 85.7 121.6-131.6 -7.3 -8.2 50.7 83.5 127 127 A H T 3<>S+ 0 0 20 -4,-1.4 5,-0.9 -3,-0.5 3,-0.4 -0.293 79.0 11.0 -63.8 143.8 -7.0 49.1 86.8 128 128 A D T >45S- 0 0 103 1,-0.2 3,-2.6 2,-0.2 -1,-0.2 0.902 134.5 -57.5 52.2 54.3 -3.6 50.1 88.2 129 129 A N T <45S- 0 0 162 -3,-0.6 -1,-0.2 1,-0.3 -2,-0.2 0.883 102.2 -58.6 48.4 40.8 -3.1 53.1 85.9 130 130 A G T 3X5S+ 0 0 26 -4,-0.7 4,-1.3 -3,-0.4 -1,-0.3 0.421 110.7 119.5 71.0 3.7 -3.5 50.7 82.9 131 131 A N H <>5 + 0 0 90 -3,-2.6 4,-2.0 1,-0.2 -3,-0.2 0.871 64.8 61.2 -67.4 -38.0 -0.5 48.5 84.0 132 132 A T H >> S+ 0 0 42 -6,-0.4 4,-2.6 -9,-0.3 3,-0.5 0.926 106.8 57.1 -64.4 -43.5 -3.7 45.1 80.8 134 134 A E H 3X S+ 0 0 103 -4,-1.3 4,-3.2 1,-0.2 5,-0.3 0.933 102.5 55.4 -52.2 -49.2 -0.1 45.7 79.5 135 135 A V H 3X S+ 0 0 53 -4,-2.0 4,-1.7 1,-0.2 -1,-0.2 0.855 110.0 44.8 -52.7 -40.5 1.0 42.6 81.5 136 136 A V H S+ 0 0 0 -4,-1.7 5,-1.8 2,-0.2 -2,-0.2 0.903 110.9 49.5 -70.3 -38.2 0.7 36.9 75.1 141 141 A N H ><5S+ 0 0 59 -4,-2.0 3,-2.6 1,-0.2 4,-0.2 0.972 108.7 53.6 -64.0 -49.7 3.1 38.6 72.5 142 142 A E H 3<5S+ 0 0 174 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.796 103.2 55.9 -54.7 -33.0 6.1 36.8 74.1 143 143 A L T 3<5S- 0 0 23 -4,-1.2 -1,-0.3 -5,-0.2 -2,-0.2 0.303 128.5 -99.1 -84.4 10.3 4.4 33.4 73.7 144 144 A D T < 5S+ 0 0 75 -3,-2.6 29,-3.4 1,-0.3 2,-0.3 0.818 82.8 122.3 76.3 40.8 4.1 34.2 70.0 145 145 A Y B < -G 172 0B 0 -5,-1.8 2,-0.3 27,-0.3 -1,-0.3 -0.814 56.7-125.7-124.0 160.8 0.4 35.4 69.8 146 146 A S - 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0 0 25 1,-0.1 5,-0.1 6,-0.0 2,-0.1 0.052 30.1-151.3 -59.4 167.4 -24.8 41.6 96.1 256 256 A G + 0 0 42 4,-0.1 5,-0.3 3,-0.1 -1,-0.1 -0.186 40.4 86.2-119.6-155.3 -26.8 43.2 99.0 257 257 A G S > S- 0 0 37 1,-0.2 3,-0.9 3,-0.1 -18,-0.2 0.279 86.5 -77.7 79.0 157.2 -29.9 45.2 99.6 258 258 A I T 3 S+ 0 0 68 1,-0.3 2,-0.4 -20,-0.3 -1,-0.2 0.819 134.8 49.6 -63.3 -25.7 -33.5 44.2 100.0 259 259 A F T >> S- 0 0 2 -21,-2.1 4,-1.5 -22,-0.1 3,-0.7 -0.462 95.4-169.9-107.9 57.4 -33.6 43.7 96.3 260 260 A A T <4 - 0 0 16 -3,-0.9 2,-1.0 -2,-0.4 3,-0.2 -0.024 51.4 -9.4 -57.1 148.9 -30.5 41.6 96.2 261 261 A K T 34 S+ 0 0 54 -5,-0.3 -9,-1.3 1,-0.2 -1,-0.2 0.210 134.1 42.5 53.9 -8.8 -28.6 40.5 93.0 262 262 A T T <4 S- 0 0 3 -2,-1.0 -13,-0.4 -3,-0.7 -1,-0.2 0.639 97.7-123.1-133.0 -34.6 -31.2 41.7 90.5 263 263 A G < - 0 0 5 -4,-1.5 11,-0.4 -3,-0.2 2,-0.4 -0.320 31.1 -76.7 104.8 167.3 -32.6 45.1 91.4 264 264 A G E -l 241 0D 0 -24,-1.3 -22,-2.3 9,-0.1 2,-0.3 -0.856 42.1-169.2-104.8 145.9 -36.1 46.2 92.1 265 265 A Y E -lM 242 272D 2 7,-2.3 7,-1.8 -2,-0.4 2,-0.8 -0.983 24.1-125.8-135.3 142.8 -38.7 46.9 89.4 266 266 A L E +lM 243 271D 33 -24,-1.6 -22,-0.6 -2,-0.3 2,-0.5 -0.799 35.5 177.0 -88.1 109.1 -42.2 48.5 89.3 267 267 A V E > - M 0 270D 11 3,-3.2 3,-2.3 -2,-0.8 -2,-0.0 -0.943 63.3 -27.7-119.2 119.5 -44.7 46.0 87.7 268 268 A N T 3 S- 0 0 124 -2,-0.5 -1,-0.1 1,-0.3 3,-0.1 0.846 126.7 -45.5 47.3 43.1 -48.4 46.7 87.4 269 269 A G T 3 S+ 0 0 72 1,-0.2 2,-0.3 -3,-0.0 -1,-0.3 0.251 124.4 91.4 88.8 -13.4 -48.5 49.0 90.4 270 270 A K E < - M 0 267D 94 -3,-2.3 -3,-3.2 -62,-0.0 2,-0.3 -0.816 67.7-131.2-114.7 155.9 -46.4 46.7 92.7 271 271 A T E + M 0 266D 19 -64,-0.4 -64,-1.7 -2,-0.3 2,-0.3 -0.820 38.0 145.2-105.1 144.2 -42.6 46.5 93.3 272 272 A R E -IM 206 265D 6 -7,-1.8 -7,-2.3 -2,-0.3 -66,-0.2 -0.984 41.2-107.9-165.6 167.8 -40.6 43.2 93.2 273 273 A K - 0 0 50 -68,-1.0 2,-0.2 -2,-0.3 -9,-0.1 -0.531 49.2 -83.0 -99.1 174.2 -37.3 41.5 92.3 274 274 A L - 0 0 5 -11,-0.4 -1,-0.1 -2,-0.2 -11,-0.1 -0.519 33.4-121.1 -85.1 151.8 -36.7 39.1 89.4 275 275 A H > - 0 0 50 -2,-0.2 4,-1.9 1,-0.1 5,-0.2 -0.486 31.2-109.9 -80.9 150.2 -37.4 35.4 89.2 276 276 A P H > S+ 0 0 10 0, 0.0 4,-2.4 0, 0.0 5,-0.1 0.894 121.2 49.4 -47.4 -41.3 -34.5 33.0 88.4 277 277 A R H > S+ 0 0 54 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.917 106.1 52.7 -67.2 -43.5 -36.0 32.4 85.0 278 278 A E H > S+ 0 0 3 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.817 110.0 52.4 -62.4 -24.5 -36.4 36.1 84.2 279 279 A C H X S+ 0 0 2 -4,-1.9 4,-0.6 2,-0.2 3,-0.3 0.939 105.2 53.4 -72.4 -47.0 -32.7 36.2 85.1 280 280 A A H ><>S+ 0 0 1 -4,-2.4 5,-3.0 1,-0.2 3,-0.8 0.895 109.1 52.1 -53.5 -39.3 -31.9 33.4 82.7 281 281 A R H ><5S+ 0 0 57 -4,-2.3 3,-1.4 1,-0.2 -1,-0.2 0.866 103.7 51.9 -69.6 -39.2 -33.7 35.4 80.0 282 282 A V H 3<5S+ 0 0 4 -4,-1.4 -1,-0.2 -3,-0.3 -2,-0.2 0.453 109.2 54.1 -75.4 -3.6 -31.8 38.8 80.5 283 283 A M T <<5S- 0 0 0 -3,-0.8 25,-1.9 -4,-0.6 -1,-0.3 0.246 122.5-111.4-105.0 2.9 -28.6 36.8 80.1 284 284 A G T < 5 + 0 0 5 -3,-1.4 -3,-0.2 1,-0.2 -2,-0.1 0.745 64.0 152.7 75.5 24.7 -29.9 35.4 76.9 285 285 A Y < - 0 0 8 -5,-3.0 -1,-0.2 -6,-0.2 2,-0.2 -0.615 45.2-109.7 -88.8 146.4 -30.4 31.8 78.0 286 286 A P > - 0 0 31 0, 0.0 3,-2.5 0, 0.0 -1,-0.1 -0.483 20.9-118.2 -74.7 144.8 -33.0 29.5 76.4 287 287 A D T 3 S+ 0 0 95 1,-0.3 -6,-0.0 -2,-0.2 -2,-0.0 0.571 110.2 66.8 -57.6 -10.3 -36.2 28.4 78.2 288 288 A S T 3 S+ 0 0 97 2,-0.1 2,-0.6 0, 0.0 -1,-0.3 0.542 71.8 107.1 -89.1 -8.8 -35.0 24.8 77.9 289 289 A Y S < S- 0 0 9 -3,-2.5 2,-0.3 1,-0.0 -9,-0.1 -0.619 70.8-134.3 -73.6 113.7 -32.0 25.2 80.3 290 290 A K - 0 0 124 -2,-0.6 2,-0.2 -242,-0.1 -238,-0.1 -0.571 23.2-149.6 -68.8 125.2 -32.8 23.5 83.6 291 291 A V - 0 0 41 -2,-0.3 4,-0.1 1,-0.1 7,-0.0 -0.533 28.5 -80.7 -93.1 166.3 -31.9 25.8 86.5 292 292 A H - 0 0 12 -2,-0.2 6,-0.2 1,-0.1 -1,-0.1 -0.380 31.6-130.2 -68.3 136.8 -30.7 24.8 90.0 293 293 A P S S+ 0 0 108 0, 0.0 2,-1.0 0, 0.0 -1,-0.1 0.747 92.9 77.8 -56.6 -28.6 -33.4 23.7 92.5 294 294 A S S > S- 0 0 48 1,-0.2 4,-2.1 2,-0.0 3,-0.4 -0.750 70.4-158.4 -89.9 103.7 -32.0 26.1 95.2 295 295 A T H > S+ 0 0 77 -2,-1.0 4,-1.8 1,-0.2 -1,-0.2 0.872 88.5 57.2 -44.6 -46.7 -33.1 29.6 94.3 296 296 A S H > S+ 0 0 77 1,-0.2 4,-1.5 2,-0.2 3,-0.3 0.929 109.2 42.8 -54.6 -52.4 -30.3 31.1 96.3 297 297 A Q H > S+ 0 0 42 -3,-0.4 4,-2.3 1,-0.2 -1,-0.2 0.856 109.2 60.5 -64.6 -34.6 -27.5 29.4 94.4 298 298 A A H X S+ 0 0 0 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.865 102.6 50.4 -60.0 -40.8 -29.3 30.0 91.1 299 299 A Y H X S+ 0 0 20 -4,-1.8 4,-2.3 -3,-0.3 -1,-0.2 0.936 111.4 48.4 -63.3 -48.2 -29.1 33.8 91.6 300 300 A K H X S+ 0 0 46 -4,-1.5 4,-0.9 1,-0.2 -2,-0.2 0.892 108.9 54.1 -59.4 -42.7 -25.4 33.7 92.3 301 301 A Q H >X S+ 0 0 20 -4,-2.3 4,-0.8 1,-0.2 3,-0.8 0.940 110.2 46.0 -62.5 -43.5 -24.7 31.5 89.3 302 302 A F H >< S+ 0 0 3 -4,-2.0 3,-1.2 1,-0.2 -2,-0.2 0.947 107.1 57.0 -66.7 -41.0 -26.4 33.9 86.9 303 303 A G H 3< S+ 0 0 7 -4,-2.3 -50,-0.4 -51,-0.3 -1,-0.2 0.681 109.2 48.7 -61.9 -16.5 -24.7 37.0 88.4 304 304 A N H << S+ 0 0 37 -4,-0.9 -1,-0.3 -3,-0.8 -2,-0.2 0.634 99.7 87.6 -96.8 -16.7 -21.3 35.4 87.6 305 305 A S S << S- 0 0 1 -3,-1.2 2,-0.3 -4,-0.8 -3,-0.1 0.136 70.7-108.9 -77.3-172.0 -22.0 34.3 84.0 306 306 A V - 0 0 0 23,-0.3 2,-0.3 -23,-0.1 -1,-0.1 -0.783 32.9-101.7-117.9 157.8 -21.7 35.8 80.5 307 307 A V > - 0 0 3 -2,-0.3 4,-1.0 1,-0.1 -23,-0.2 -0.653 27.3-148.7 -79.7 136.2 -24.3 36.9 77.9 308 308 A I H > S+ 0 0 0 -25,-1.9 4,-1.7 -2,-0.3 3,-0.1 0.956 88.3 57.7 -71.8 -48.8 -24.8 34.2 75.2 309 309 A N H > S+ 0 0 9 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.850 106.1 47.9 -51.2 -46.5 -25.7 36.4 72.3 310 310 A V H > S+ 0 0 2 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.905 109.8 53.5 -65.8 -39.0 -22.5 38.5 72.3 311 311 A L H X S+ 0 0 0 -4,-1.0 4,-1.5 2,-0.2 -1,-0.2 0.856 107.7 53.6 -63.1 -33.1 -20.4 35.4 72.6 312 312 A Q H >X S+ 0 0 0 -4,-1.7 4,-2.1 2,-0.2 3,-0.5 0.993 106.7 46.7 -66.4 -59.9 -22.1 34.0 69.5 313 313 A Y H 3X S+ 0 0 58 -4,-1.9 4,-2.0 1,-0.3 3,-0.3 0.930 115.8 47.1 -49.5 -51.7 -21.5 36.9 67.1 314 314 A I H 3X S+ 0 0 0 -4,-2.0 4,-1.5 1,-0.2 -1,-0.3 0.845 108.3 56.4 -59.7 -35.0 -17.8 37.0 68.2 315 315 A A H