==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 01-AUG-06 2J08 . COMPND 2 MOLECULE: DEOXYRIBODIPYRIMIDINE PHOTO-LYASE; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS THERMOPHILUS; . AUTHOR T.KLAR,G.KAISER,U.HENNECKE,T.CARELL,A.BATSCHAUER,L.-O.ESSEN . 419 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 18565.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 271 64.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 20 4.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 18 4.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 39 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 167 39.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 2.1 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 2 1 1 2 0 0 3 1 3 1 0 0 1 0 0 0 1 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 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 . 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 2 A G 0 0 76 0, 0.0 86,-0.2 0, 0.0 85,-0.1 0.000 360.0 360.0 360.0 114.1 51.9 13.0 5.7 2 3 A P - 0 0 32 0, 0.0 86,-1.7 0, 0.0 87,-0.6 -0.413 360.0-123.2 -65.4 155.5 49.0 12.4 8.2 3 4 A L E -ab 28 89A 13 24,-2.5 26,-1.5 84,-0.2 2,-0.5 -0.849 27.2-131.0 -94.4 133.1 48.2 15.0 11.0 4 5 A L E -ab 29 90A 0 85,-2.7 87,-2.1 -2,-0.5 2,-0.6 -0.787 11.8-153.6 -82.3 140.7 48.3 13.4 14.4 5 6 A V E -ab 30 91A 0 24,-3.0 26,-2.4 -2,-0.5 2,-0.8 -0.910 8.9-159.5-108.8 111.7 45.4 13.9 16.8 6 7 A W E -a 31 0A 4 85,-2.2 2,-0.6 -2,-0.6 87,-0.4 -0.790 5.7-163.6 -91.5 108.6 46.6 13.6 20.3 7 8 A H + 0 0 1 24,-2.6 26,-0.4 -2,-0.8 4,-0.1 -0.858 19.5 159.6 -92.0 127.6 43.6 12.9 22.7 8 9 A R S S- 0 0 24 -2,-0.6 2,-2.3 24,-0.1 -1,-0.1 0.391 75.7 -10.2-109.1-119.0 44.3 13.4 26.4 9 10 A G S S+ 0 0 45 1,-0.2 -2,-0.0 84,-0.1 -1,-0.0 -0.456 121.6 83.1 -77.3 62.3 41.4 13.9 28.8 10 11 A D + 0 0 11 -2,-2.3 2,-1.5 209,-0.1 208,-0.2 -0.407 51.7 169.1-159.0 61.6 39.1 14.2 25.8 11 12 A L + 0 0 4 206,-2.1 2,-0.3 -4,-0.1 167,-0.3 -0.433 45.0 91.7 -83.2 69.3 38.3 10.7 24.9 12 13 A R - 0 0 7 -2,-1.5 208,-0.1 165,-0.1 207,-0.1 -0.929 64.4-142.8-153.8 158.1 35.5 11.5 22.4 13 14 A L S S+ 0 0 1 -2,-0.3 3,-0.4 206,-0.2 2,-0.2 0.619 79.4 84.3 -88.6 -29.9 34.8 12.2 18.7 14 15 A H S S+ 0 0 8 1,-0.2 210,-0.1 205,-0.2 -2,-0.1 -0.534 100.5 2.9 -87.8 144.3 32.0 14.9 19.3 15 16 A D S S+ 0 0 0 134,-2.4 -1,-0.2 -2,-0.2 209,-0.1 0.928 86.7 151.9 48.1 55.4 32.8 18.6 19.9 16 17 A H > - 0 0 0 -3,-0.4 4,-2.2 134,-0.4 3,-0.4 -0.810 26.7-174.3-122.0 86.3 36.5 17.9 19.4 17 18 A P H > S+ 0 0 15 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.832 84.2 48.0 -55.1 -43.1 38.3 21.0 18.1 18 19 A A H > S+ 0 0 0 2,-0.2 4,-2.1 1,-0.2 5,-0.2 0.929 111.0 52.9 -65.6 -35.4 41.8 19.5 17.6 19 20 A L H > S+ 0 0 0 -3,-0.4 4,-2.6 1,-0.2 -1,-0.2 0.947 116.0 39.0 -61.5 -52.2 40.2 16.5 15.8 20 21 A L H X S+ 0 0 44 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.895 110.5 57.6 -61.8 -47.1 38.3 18.8 13.4 21 22 A E H < S+ 0 0 104 -4,-2.8 4,-0.4 1,-0.2 -2,-0.2 0.908 115.7 39.2 -52.8 -39.3 41.2 21.4 13.0 22 23 A A H >X S+ 0 0 0 -4,-2.1 3,-1.4 -5,-0.2 4,-1.1 0.912 110.3 57.9 -75.8 -45.9 43.3 18.4 11.7 23 24 A L H >< S+ 0 0 43 -4,-2.6 3,-0.8 1,-0.3 -2,-0.2 0.926 102.6 55.0 -58.0 -38.5 40.6 16.7 9.7 24 25 A A T 3< S+ 0 0 95 -4,-2.5 -1,-0.3 1,-0.2 -2,-0.2 0.740 110.3 46.6 -65.1 -17.7 40.1 19.9 7.6 25 26 A R T <4 S- 0 0 119 -3,-1.4 -1,-0.2 -4,-0.4 -2,-0.2 0.619 125.1 -59.0 -94.4 -25.3 43.8 20.0 6.6 26 27 A G S << S- 0 0 20 -4,-1.1 -1,-0.3 -3,-0.8 -23,-0.1 -0.956 78.2 -24.5 163.0-178.0 44.3 16.3 5.7 27 28 A P - 0 0 75 0, 0.0 -24,-2.5 0, 0.0 2,-0.2 -0.260 59.9-151.1 -62.7 148.9 44.2 12.6 6.7 28 29 A V E -a 3 0A 4 -26,-0.2 2,-0.3 -24,-0.1 38,-0.3 -0.773 22.6-168.8-122.8 166.8 44.5 11.9 10.4 29 30 A V E -a 4 0A 5 -26,-1.5 -24,-3.0 -2,-0.2 38,-0.2 -0.938 25.3-140.2-149.9 122.3 45.7 9.2 12.9 30 31 A G E -ac 5 67A 0 36,-2.6 38,-2.5 -2,-0.3 2,-0.3 -0.463 16.1-162.3 -84.0 161.0 44.8 9.6 16.6 31 32 A L E -ac 6 68A 0 -26,-2.4 -24,-2.6 36,-0.2 2,-0.4 -0.972 13.1-173.0-148.3 130.2 47.1 8.9 19.5 32 33 A V E - c 0 69A 1 36,-2.1 38,-2.6 -2,-0.3 2,-0.5 -0.991 11.0-157.6-112.4 147.8 46.8 8.2 23.1 33 34 A V E - c 0 70A 13 -26,-0.4 2,-0.8 -2,-0.4 38,-0.2 -0.988 14.3-140.6-122.2 126.4 49.8 7.9 25.4 34 35 A L E - c 0 71A 3 36,-2.6 38,-2.4 -2,-0.5 3,-0.1 -0.745 30.3-160.0 -86.6 104.1 49.4 6.1 28.7 35 36 A D >> - 0 0 5 -2,-0.8 3,-2.0 36,-0.2 4,-1.9 -0.826 23.1-144.2-100.6 123.1 51.5 8.4 30.8 36 37 A P H 3> S+ 0 0 49 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.902 99.7 69.1 -56.9 -29.1 52.9 7.2 34.1 37 38 A N H 34 S+ 0 0 95 1,-0.3 36,-0.0 2,-0.2 -3,-0.0 0.852 114.2 27.3 -58.8 -24.9 52.3 10.7 35.5 38 39 A N H <4 S+ 0 0 88 -3,-2.0 -1,-0.3 1,-0.1 -4,-0.0 0.625 122.1 52.9-104.7 -23.9 48.5 10.1 35.3 39 40 A L H < S+ 0 0 10 -4,-1.9 2,-1.4 1,-0.2 -2,-0.2 0.444 74.8 89.8-106.3 -2.3 48.4 6.3 35.7 40 41 A K S < S+ 0 0 179 -4,-2.0 2,-0.2 -5,-0.2 -1,-0.2 -0.719 75.1 98.1 -79.8 82.9 50.3 5.6 38.8 41 42 A T S S- 0 0 28 -2,-1.4 -2,-0.1 1,-0.2 -3,-0.0 -0.695 83.7 -40.3-151.3-166.9 47.1 6.0 40.8 42 43 A T >> - 0 0 35 -2,-0.2 4,-2.3 1,-0.1 3,-1.0 -0.222 54.6-112.9 -74.0 156.0 44.5 3.5 42.2 43 44 A P H 3> S+ 0 0 77 0, 0.0 4,-2.9 0, 0.0 5,-0.3 0.938 114.3 60.2 -49.9 -42.4 43.4 0.4 40.1 44 45 A R H 3> S+ 0 0 32 1,-0.2 4,-1.7 125,-0.2 5,-0.1 0.793 110.4 39.8 -55.3 -34.3 39.8 1.8 39.8 45 46 A R H <> S+ 0 0 51 -3,-1.0 4,-2.6 2,-0.2 5,-0.2 0.875 111.7 54.7 -90.9 -37.2 41.0 4.9 37.9 46 47 A R H X S+ 0 0 48 -4,-2.3 4,-3.0 2,-0.2 5,-0.2 0.977 113.8 44.6 -53.8 -48.5 43.7 3.2 35.8 47 48 A A H X S+ 0 0 0 -4,-2.9 4,-3.6 -5,-0.2 5,-0.3 0.956 110.9 51.8 -65.3 -44.4 40.9 0.9 34.6 48 49 A W H X S+ 0 0 3 -4,-1.7 4,-1.9 -5,-0.3 -1,-0.2 0.922 115.0 43.5 -57.2 -47.8 38.3 3.7 34.0 49 50 A F H X S+ 0 0 34 -4,-2.6 4,-2.3 1,-0.2 5,-0.2 0.993 115.5 47.7 -61.2 -49.0 40.9 5.6 31.9 50 51 A L H X S+ 0 0 0 -4,-3.0 4,-2.6 -5,-0.2 -2,-0.2 0.873 110.4 51.1 -64.8 -40.9 42.0 2.5 30.0 51 52 A E H X S+ 0 0 39 -4,-3.6 4,-2.8 2,-0.2 -1,-0.2 0.927 108.9 52.0 -65.2 -40.8 38.5 1.3 29.2 52 53 A N H X S+ 0 0 1 -4,-1.9 4,-2.2 -5,-0.3 -2,-0.2 0.910 109.1 50.1 -55.9 -34.0 37.5 4.7 27.8 53 54 A V H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.940 110.5 51.4 -67.7 -44.0 40.7 4.5 25.6 54 55 A R H X S+ 0 0 42 -4,-2.6 4,-1.9 1,-0.3 -2,-0.2 0.919 110.4 46.8 -61.5 -41.7 39.5 1.1 24.6 55 56 A A H X S+ 0 0 23 -4,-2.8 4,-2.0 2,-0.2 -1,-0.3 0.870 107.8 58.1 -69.0 -27.8 36.1 2.5 23.8 56 57 A L H X S+ 0 0 4 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.972 107.4 46.2 -71.5 -37.9 37.7 5.4 21.9 57 58 A R H X S+ 0 0 11 -4,-2.3 4,-4.1 2,-0.2 5,-0.3 0.881 109.3 53.9 -62.1 -40.6 39.5 2.9 19.5 58 59 A E H X S+ 0 0 108 -4,-1.9 4,-2.6 1,-0.2 -1,-0.2 0.910 108.9 51.7 -60.0 -36.0 36.3 0.9 19.0 59 60 A A H X S+ 0 0 25 -4,-2.0 4,-0.7 1,-0.2 -2,-0.2 0.876 113.4 42.2 -67.9 -39.4 34.8 4.3 18.0 60 61 A Y H >X>S+ 0 0 2 -4,-2.3 5,-2.5 2,-0.2 3,-1.2 0.927 114.1 51.1 -68.6 -53.9 37.7 5.0 15.5 61 62 A R H ><5S+ 0 0 124 -4,-4.1 3,-1.3 1,-0.3 -2,-0.2 0.917 107.6 55.8 -51.5 -35.4 37.6 1.3 14.2 62 63 A A H 3<5S+ 0 0 89 -4,-2.6 -1,-0.3 1,-0.3 -2,-0.2 0.689 108.9 44.6 -74.4 -22.9 33.9 1.7 13.7 63 64 A R H <<5S- 0 0 87 -3,-1.2 92,-2.6 -4,-0.7 -1,-0.3 0.293 124.2-102.1-103.1 4.9 34.2 4.8 11.5 64 65 A G T <<5S+ 0 0 48 -3,-1.3 94,-0.3 -4,-0.6 -3,-0.2 0.453 81.7 119.1 99.6 4.4 37.0 3.1 9.6 65 66 A G < - 0 0 7 -5,-2.5 2,-0.4 -6,-0.2 -1,-0.3 -0.416 57.4-108.6-104.3-172.4 40.0 5.0 11.3 66 67 A A - 0 0 3 90,-0.5 -36,-2.6 -38,-0.3 2,-0.5 -0.899 19.6-178.8-126.9 130.9 43.2 4.5 13.3 67 68 A L E -c 30 0A 0 -2,-0.4 2,-0.3 -38,-0.2 -36,-0.2 -0.960 16.3-154.6-130.0 106.1 44.0 5.3 17.1 68 69 A W E -c 31 0A 10 -38,-2.5 -36,-2.1 -2,-0.5 2,-0.4 -0.574 6.0-163.0 -65.1 144.6 47.6 4.5 18.2 69 70 A V E +c 32 0A 2 92,-2.3 2,-0.3 -2,-0.3 -36,-0.2 -0.989 14.8 173.5-131.7 122.3 48.0 3.8 22.0 70 71 A L E -c 33 0A 18 -38,-2.6 -36,-2.6 -2,-0.4 2,-0.4 -0.928 21.6-135.2-126.5 163.9 51.5 3.9 23.3 71 72 A E E +c 34 0A 118 -2,-0.3 2,-0.3 -38,-0.2 -36,-0.2 -0.881 57.4 42.7-126.7 133.4 52.9 3.7 26.7 72 73 A G S S- 0 0 22 -38,-2.4 -2,-0.1 -2,-0.4 3,-0.0 -0.831 94.9 -8.6 131.7-155.9 55.6 5.9 28.5 73 74 A L >> - 0 0 52 -2,-0.3 4,-2.8 -38,-0.1 3,-2.4 -0.564 55.4-134.1 -81.3 135.3 56.5 9.6 28.6 74 75 A P H 3> S+ 0 0 1 0, 0.0 4,-3.5 0, 0.0 -1,-0.1 0.858 106.6 54.5 -50.2 -37.0 54.5 12.0 26.2 75 76 A W H 34 S+ 0 0 19 2,-0.2 -2,-0.1 1,-0.2 29,-0.0 0.413 115.2 41.1 -79.0 -6.0 57.8 13.8 25.1 76 77 A E H <> S+ 0 0 107 -3,-2.4 4,-1.6 3,-0.1 -1,-0.2 0.723 122.8 36.8-105.4 -34.9 59.3 10.4 24.2 77 78 A K H X S+ 0 0 43 -4,-2.8 4,-2.7 2,-0.2 5,-0.3 0.836 108.8 56.6 -91.0 -33.1 56.2 8.9 22.6 78 79 A V H X S+ 0 0 0 -4,-3.5 4,-3.0 -5,-0.3 -1,-0.2 0.980 112.4 46.0 -63.4 -46.1 54.5 11.8 20.7 79 80 A P H > S+ 0 0 5 0, 0.0 4,-2.7 0, 0.0 5,-0.3 0.971 111.0 53.3 -60.9 -40.9 57.8 12.3 18.9 80 81 A E H X S+ 0 0 42 -4,-1.6 4,-3.1 1,-0.2 5,-0.2 0.908 111.2 43.8 -55.5 -48.1 58.1 8.6 18.2 81 82 A A H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 6,-0.3 0.921 111.5 56.7 -68.1 -35.0 54.7 8.3 16.7 82 83 A A H X>S+ 0 0 6 -4,-3.0 5,-2.1 -5,-0.3 4,-0.6 0.923 112.9 39.7 -53.0 -47.7 55.4 11.5 14.8 83 84 A R H ><5S+ 0 0 165 -4,-2.7 3,-0.9 3,-0.2 -2,-0.2 0.916 114.3 52.8 -70.2 -54.7 58.5 9.9 13.2 84 85 A R H 3<5S+ 0 0 123 -4,-3.1 -2,-0.2 -5,-0.3 -3,-0.2 0.911 121.0 32.6 -59.4 -21.6 57.0 6.5 12.7 85 86 A L H 3<5S- 0 0 20 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.2 0.471 101.7-127.8-102.8 -9.1 54.1 8.0 10.8 86 87 A K T <<5 - 0 0 175 -3,-0.9 -3,-0.2 -4,-0.6 -4,-0.1 0.886 39.2-170.8 61.5 43.4 55.9 10.9 9.2 87 88 A A < - 0 0 7 -5,-2.1 -84,-0.2 -6,-0.3 -1,-0.1 -0.351 25.1-149.2 -70.6 149.7 53.3 13.3 10.6 88 89 A K S S- 0 0 72 -86,-1.7 2,-0.3 1,-0.3 -85,-0.2 0.598 77.2 -14.4 -84.9 -22.8 53.4 16.9 9.4 89 90 A A E -b 3 0A 6 -87,-0.6 -85,-2.7 24,-0.2 2,-0.4 -0.972 60.6-124.8-168.8 162.7 52.0 18.2 12.7 90 91 A V E -bd 4 115A 0 24,-2.2 26,-2.8 -2,-0.3 2,-0.4 -0.935 21.4-160.0-122.1 145.8 50.3 17.2 15.9 91 92 A Y E +bd 5 116A 6 -87,-2.1 -85,-2.2 -2,-0.4 2,-0.3 -0.981 19.3 149.6-123.3 142.6 47.0 18.7 17.3 92 93 A A E - d 0 117A 0 24,-2.1 26,-3.0 -2,-0.4 2,-0.4 -0.958 46.5 -88.2-160.8 172.5 45.6 18.8 20.8 93 94 A L E - d 0 118A 6 -87,-0.4 -84,-0.1 -2,-0.3 24,-0.1 -0.739 51.5-107.3 -90.5 129.4 43.4 20.7 23.3 94 95 A T - 0 0 37 24,-2.9 2,-0.4 -2,-0.4 26,-0.2 -0.208 29.5-154.4 -51.0 146.9 45.2 23.3 25.4 95 96 A S - 0 0 30 2,-0.1 9,-0.1 5,-0.1 -1,-0.1 -0.993 10.2-167.8-124.9 123.9 45.7 22.4 29.1 96 97 A H + 0 0 59 -2,-0.4 -1,-0.1 4,-0.1 -2,-0.0 0.298 53.4 108.4 -97.0 17.0 46.1 25.2 31.5 97 98 A T S > S- 0 0 63 1,-0.1 4,-3.6 0, 0.0 5,-0.3 -0.458 82.1-109.5 -90.6 162.3 47.3 23.1 34.4 98 99 A P H > S+ 0 0 71 0, 0.0 4,-1.5 0, 0.0 5,-0.1 0.915 120.6 41.1 -70.6 -21.3 50.8 23.0 35.8 99 100 A Y H > S+ 0 0 56 2,-0.2 4,-3.7 1,-0.2 5,-0.3 0.911 112.2 55.8 -87.3 -43.6 51.5 19.5 34.4 100 101 A G H > S+ 0 0 1 1,-0.2 4,-2.4 2,-0.2 5,-0.3 0.952 111.2 44.7 -38.8 -56.0 49.7 20.3 31.2 101 102 A R H X S+ 0 0 127 -4,-3.6 4,-2.1 1,-0.2 -2,-0.2 0.863 115.3 47.8 -65.7 -37.1 52.0 23.2 30.7 102 103 A Y H X S+ 0 0 114 -4,-1.5 4,-2.2 -5,-0.3 -1,-0.2 0.937 116.5 40.7 -72.4 -47.1 55.1 21.3 31.7 103 104 A R H X S+ 0 0 17 -4,-3.7 4,-3.5 2,-0.2 5,-0.3 0.965 116.1 49.9 -64.8 -59.3 54.4 18.2 29.5 104 105 A D H X S+ 0 0 4 -4,-2.4 4,-2.1 -5,-0.3 5,-0.2 0.937 110.9 51.6 -44.1 -38.1 53.2 20.3 26.5 105 106 A G H X S+ 0 0 25 -4,-2.1 4,-1.6 -5,-0.3 -2,-0.2 0.942 112.8 44.2 -62.6 -54.5 56.4 22.4 26.9 106 107 A R H X S+ 0 0 106 -4,-2.2 4,-1.7 1,-0.2 -1,-0.2 0.861 112.0 52.6 -56.8 -41.7 58.6 19.4 26.8 107 108 A V H X S+ 0 0 0 -4,-3.5 4,-2.2 1,-0.2 -1,-0.2 0.878 106.3 54.2 -63.9 -36.2 56.7 17.7 24.0 108 109 A R H < S+ 0 0 126 -4,-2.1 -2,-0.2 -5,-0.3 -1,-0.2 0.881 108.2 49.6 -72.2 -24.9 57.1 20.9 21.9 109 110 A E H < S+ 0 0 144 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.893 113.6 42.9 -74.6 -45.9 60.8 20.9 22.3 110 111 A A H < S+ 0 0 46 -4,-1.7 -2,-0.2 2,-0.0 -1,-0.2 0.826 97.4 88.3 -73.8 -28.2 61.4 17.3 21.3 111 112 A L < - 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0 0 5 0, 0.0 93,-0.1 0, 0.0 6,-0.1 -0.066 37.8-131.4 -47.2 126.7 43.7 27.5 52.3 265 266 A L S S+ 0 0 0 91,-0.4 92,-0.2 -5,-0.1 3,-0.1 0.768 95.2 77.9 -39.7 -43.3 42.6 30.3 49.9 266 267 A D S > S- 0 0 53 90,-2.6 3,-2.2 1,-0.2 4,-0.2 -0.744 75.6-151.7 -83.8 113.5 41.6 32.3 53.0 267 268 A P G > S+ 0 0 84 0, 0.0 3,-1.7 0, 0.0 4,-0.4 0.833 93.3 67.8 -49.8 -32.8 44.9 33.7 54.5 268 269 A R G 3 S+ 0 0 35 1,-0.3 3,-0.3 2,-0.1 150,-0.1 0.818 100.0 48.6 -67.5 -19.6 43.2 33.7 57.9 269 270 A F G X S+ 0 0 4 -3,-2.2 3,-0.7 1,-0.2 -1,-0.3 0.424 79.9 97.0 -93.5 4.5 43.2 29.8 57.9 270 271 A Q T < S+ 0 0 89 -3,-1.7 2,-0.5 1,-0.3 -1,-0.2 0.822 87.5 46.5 -75.1 -25.8 46.9 29.2 56.9 271 272 A A T 3 S+ 0 0 83 -4,-0.4 -1,-0.3 -3,-0.3 145,-0.1 -0.489 78.6 141.9-105.5 62.3 47.9 28.7 60.5 272 273 A F < - 0 0 10 -3,-0.7 2,-1.5 -2,-0.5 -3,-0.1 -0.862 55.0-121.8-101.7 138.9 45.1 26.4 61.6 273 274 A P - 0 0 66 0, 0.0 -2,-0.1 0, 0.0 139,-0.0 -0.617 32.1-174.3 -89.0 79.1 46.2 23.6 64.0 274 275 A W - 0 0 58 -2,-1.5 2,-0.6 1,-0.0 51,-0.2 -0.263 18.3-140.3 -50.8 147.0 45.3 20.3 62.3 275 276 A Q - 0 0 90 49,-1.9 2,-0.1 48,-0.2 -1,-0.0 -0.977 10.0-151.3-122.2 99.5 45.9 17.3 64.5 276 277 A E + 0 0 102 -2,-0.6 2,-0.2 49,-0.2 49,-0.0 -0.498 26.7 164.4 -66.3 155.1 47.3 14.5 62.5 277 278 A D > - 0 0 71 -2,-0.1 4,-2.4 1,-0.1 5,-0.2 -0.552 29.7-156.7 177.7 96.0 46.2 11.3 64.2 278 279 A E H > S+ 0 0 99 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.930 91.9 59.4 -56.1 -47.8 46.4 7.9 62.4 279 280 A A H > S+ 0 0 82 1,-0.2 4,-1.3 2,-0.2 3,-0.2 0.924 113.3 38.7 -48.0 -55.3 43.8 6.2 64.5 280 281 A L H > S+ 0 0 26 1,-0.2 4,-2.1 2,-0.2 5,-0.3 0.773 109.0 58.4 -66.1 -47.3 41.1 8.8 63.5 281 282 A F H X S+ 0 0 5 -4,-2.4 4,-3.0 2,-0.2 -1,-0.2 0.935 106.6 52.4 -42.4 -50.2 42.2 9.2 59.8 282 283 A Q H X S+ 0 0 70 -4,-2.4 4,-2.3 -3,-0.2 -2,-0.2 0.938 107.7 50.0 -60.0 -36.7 41.6 5.4 59.5 283 284 A A H <>S+ 0 0 17 -4,-1.3 5,-4.1 -5,-0.2 6,-0.3 0.866 115.4 41.4 -76.9 -37.1 38.0 5.6 60.9 284 285 A W H ><5S+ 0 0 0 -4,-2.1 3,-2.3 3,-0.2 -1,-0.2 0.978 115.7 52.2 -58.8 -56.8 36.9 8.4 58.6 285 286 A Y H 3<5S+ 0 0 49 -4,-3.0 -2,-0.2 1,-0.3 -3,-0.2 0.801 117.5 36.0 -50.0 -40.0 38.7 6.8 55.7 286 287 A E T 3<5S- 0 0 81 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.127 114.2-111.5-103.2 13.7 37.0 3.4 56.1 287 288 A G T < 5S+ 0 0 0 -3,-2.3 -3,-0.2 1,-0.1 -4,-0.1 0.917 79.4 125.6 45.9 54.7 33.6 4.8 57.3 288 289 A K < + 0 0 126 -5,-4.1 -4,-0.2 -6,-0.2 -1,-0.1 -0.179 25.7 115.9-122.6 43.2 33.9 3.6 60.9 289 290 A T S S- 0 0 0 -6,-0.3 110,-2.9 2,-0.2 111,-0.3 0.680 83.4-116.6 -96.3 -18.8 33.3 6.9 62.7 290 291 A G S S+ 0 0 4 108,-0.3 106,-2.0 1,-0.2 3,-0.1 0.406 80.3 119.7 100.4 0.3 30.1 5.9 64.3 291 292 A V >> - 0 0 2 104,-0.2 4,-2.1 1,-0.2 3,-1.6 -0.848 60.0-145.7 -99.4 103.5 28.1 8.5 62.5 292 293 A P H 3> S+ 0 0 0 0, 0.0 4,-2.1 0, 0.0 5,-0.2 0.818 96.4 46.9 -40.6 -41.2 25.4 6.8 60.3 293 294 A L H 3> S+ 0 0 0 100,-0.2 4,-1.8 1,-0.2 5,-0.1 0.841 113.0 45.7 -75.2 -30.9 25.8 9.4 57.5 294 295 A V H <> S+ 0 0 1 -3,-1.6 4,-2.9 2,-0.2 -1,-0.2 0.846 112.8 49.4 -84.5 -32.3 29.5 9.5 57.3 295 296 A D H X S+ 0 0 0 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.877 110.5 51.1 -77.0 -26.5 30.0 5.8 57.3 296 297 A A H X S+ 0 0 0 -4,-2.1 4,-2.7 -5,-0.4 5,-0.2 0.967 114.5 44.1 -63.6 -50.2 27.3 5.3 54.6 297 298 A A H X S+ 0 0 0 -4,-1.8 4,-2.2 2,-0.2 3,-0.4 0.992 115.0 47.2 -60.4 -54.3 29.1 7.9 52.5 298 299 A M H X S+ 0 0 1 -4,-2.9 4,-1.9 1,-0.2 -1,-0.2 0.865 114.7 48.0 -61.2 -32.9 32.5 6.5 53.1 299 300 A R H X S+ 0 0 49 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.825 108.5 51.1 -77.6 -31.9 31.3 3.0 52.4 300 301 A E H X S+ 0 0 8 -4,-2.7 4,-3.0 -3,-0.4 6,-0.4 0.960 110.5 51.0 -61.4 -52.0 29.5 3.8 49.2 301 302 A L H X S+ 0 0 0 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.901 110.8 49.3 -48.7 -46.4 32.7 5.5 47.9 302 303 A H H < S+ 0 0 46 -4,-1.9 -2,-0.2 -5,-0.3 -1,-0.2 0.984 120.1 35.0 -59.6 -50.2 34.8 2.5 48.8 303 304 A A H < S+ 0 0 51 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.729 132.7 24.9 -74.2 -30.6 32.5 0.0 47.0 304 305 A T H < S- 0 0 41 -4,-3.0 -3,-0.2 2,-0.2 -2,-0.2 0.727 81.6-128.6-118.1 -24.8 31.4 2.3 44.1 305 306 A G S < S+ 0 0 1 -4,-1.9 34,-1.9 -5,-0.4 35,-0.6 0.539 82.1 93.6 81.4 2.7 33.8 5.0 43.1 306 307 A F + 0 0 21 -6,-0.4 2,-0.3 32,-0.2 -1,-0.2 -0.983 43.8 169.0-137.4 151.9 30.8 7.4 43.3 307 308 A L - 0 0 1 -2,-0.3 -103,-0.1 -3,-0.1 -102,-0.0 -0.979 34.5-110.8-156.6 142.7 29.2 9.7 45.8 308 309 A S > - 0 0 3 -105,-0.5 4,-2.8 -2,-0.3 3,-0.4 -0.333 33.1-110.5 -72.6 158.0 26.4 12.4 45.6 309 310 A N H > S+ 0 0 81 1,-0.2 4,-2.5 -109,-0.2 5,-0.2 0.886 119.6 50.1 -49.0 -47.3 27.3 16.1 46.0 310 311 A R H > S+ 0 0 23 -108,-0.5 4,-1.5 -110,-0.3 -1,-0.2 0.807 111.9 45.7 -69.8 -27.5 25.4 16.2 49.3 311 312 A A H > S+ 0 0 0 -3,-0.4 4,-4.3 -109,-0.2 5,-0.3 0.934 113.3 51.3 -77.7 -41.1 27.2 13.1 50.7 312 313 A R H X S+ 0 0 45 -4,-2.8 4,-3.1 2,-0.2 5,-0.3 0.940 108.7 48.6 -58.7 -46.3 30.6 14.4 49.6 313 314 A M H X S+ 0 0 11 -4,-2.5 4,-2.4 1,-0.2 5,-0.2 0.950 118.4 42.5 -68.1 -41.1 30.1 17.8 51.2 314 315 A N H X S+ 0 0 7 -4,-1.5 4,-1.7 2,-0.2 -2,-0.2 0.918 115.9 46.4 -56.8 -57.8 29.1 16.1 54.4 315 316 A A H X S+ 0 0 0 -4,-4.3 4,-1.5 2,-0.2 -2,-0.2 0.971 118.3 43.9 -57.7 -42.4 31.7 13.3 54.3 316 317 A A H X S+ 0 0 4 -4,-3.1 4,-1.6 -5,-0.3 -2,-0.2 0.921 113.1 48.0 -71.2 -42.9 34.4 15.9 53.5 317 318 A Q H X>S+ 0 0 6 -4,-2.4 4,-3.9 -5,-0.3 5,-0.6 0.810 104.5 62.5 -64.6 -33.1 33.4 18.6 56.0 318 319 A F H X>S+ 0 0 9 -4,-1.7 4,-2.7 -5,-0.2 5,-2.4 0.983 102.5 48.7 -60.9 -50.0 33.2 16.1 58.7 319 320 A A H <5S+ 0 0 0 -4,-1.5 6,-2.7 1,-0.2 -1,-0.2 0.889 120.8 36.6 -50.9 -50.4 36.9 15.2 58.5 320 321 A V H <5S+ 0 0 0 -4,-1.6 4,-0.3 4,-0.3 -1,-0.2 0.924 128.0 30.1 -69.8 -50.2 37.9 18.9 58.5 321 322 A K H <5S+ 0 0 3 -4,-3.9 88,-0.3 -5,-0.2 -3,-0.2 0.805 131.7 26.7 -90.4 -31.1 35.4 20.3 61.0 322 323 A H T < - 0 0 27 0, 0.0 4,-1.6 0, 0.0 5,-0.2 -0.509 33.9-138.6 -70.8 127.8 44.7 17.8 57.8 327 328 A W H > S+ 0 0 8 -2,-0.3 4,-2.8 1,-0.2 5,-0.4 0.882 94.1 57.7 -44.5 -51.0 42.9 18.6 54.5 328 329 A K H > S+ 0 0 97 1,-0.2 4,-2.1 2,-0.2 5,-0.3 0.963 107.4 46.7 -57.9 -50.8 45.8 17.6 52.1 329 330 A R H > S+ 0 0 77 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.964 118.9 42.4 -50.2 -52.1 46.0 14.0 53.4 330 331 A C H X S+ 0 0 0 -4,-1.6 4,-2.7 2,-0.2 -1,-0.2 0.840 112.0 49.9 -61.3 -42.0 42.2 13.6 53.2 331 332 A E H X S+ 0 0 12 -4,-2.8 4,-2.0 1,-0.2 -1,-0.2 0.958 110.0 51.1 -84.2 -33.4 41.5 15.3 50.0 332 333 A E H X S+ 0 0 91 -4,-2.1 4,-1.8 -5,-0.4 -1,-0.2 0.908 111.6 47.5 -47.7 -55.4 44.1 13.3 48.2 333 334 A A H X S+ 0 0 17 -4,-2.0 4,-0.7 -5,-0.3 -2,-0.2 0.915 110.7 54.1 -66.5 -35.2 42.8 10.0 49.6 334 335 A F H >X S+ 0 0 4 -4,-2.7 3,-1.0 -5,-0.2 4,-0.5 0.896 106.4 49.7 -57.1 -46.9 39.3 11.1 48.6 335 336 A R H >< S+ 0 0 38 -4,-2.0 3,-1.2 1,-0.3 6,-0.3 0.896 105.0 58.6 -72.4 -36.8 40.2 11.8 45.0 336 337 A H H 3< S+ 0 0 44 -4,-1.8 -1,-0.3 1,-0.2 -291,-0.2 0.626 104.1 52.7 -57.7 -24.5 41.9 8.4 44.6 337 338 A L H << S+ 0 0 8 -3,-1.0 2,-0.5 -4,-0.7 -1,-0.2 0.613 96.3 84.2 -85.0 -13.8 38.6 6.7 45.5 338 339 A L X< - 0 0 2 -3,-1.2 3,-1.5 -4,-0.5 -32,-0.2 -0.746 62.5-154.4 -99.1 131.1 36.6 8.5 42.9 339 340 A L T 3 S+ 0 0 10 -34,-1.9 -1,-0.1 -2,-0.5 -33,-0.1 0.782 107.0 43.2 -59.7 -30.8 36.2 7.5 39.2 340 341 A D T 3 S+ 0 0 11 -35,-0.6 -1,-0.3 -124,-0.1 -34,-0.1 0.180 84.0 148.5 -99.8 8.0 35.5 11.2 38.5 341 342 A G < + 0 0 8 -3,-1.5 2,-0.4 -6,-0.3 -6,-0.1 -0.208 20.6 178.2 -55.1 129.0 38.3 12.4 40.8 342 343 A D > - 0 0 25 1,-0.2 4,-3.0 2,-0.0 5,-0.4 -0.947 29.5-136.1-147.7 111.7 39.6 15.6 39.4 343 344 A R H > S+ 0 0 123 -2,-0.4 4,-2.3 1,-0.2 5,-0.2 0.903 100.8 38.5 -41.5 -62.8 42.3 17.5 41.1 344 345 A A H > S+ 0 0 9 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.928 119.4 47.2 -57.3 -37.7 41.0 21.1 40.7 345 346 A V H > S+ 0 0 33 1,-0.3 4,-2.9 2,-0.2 -1,-0.2 0.905 112.4 47.6 -80.5 -42.6 37.3 20.1 41.3 346 347 A N H X S+ 0 0 16 -4,-3.0 4,-2.4 2,-0.2 -1,-0.3 0.887 113.1 50.8 -64.4 -33.1 38.0 18.0 44.3 347 348 A L H X S+ 0 0 4 -4,-2.3 4,-3.3 -5,-0.4 5,-0.3 0.955 109.5 50.0 -70.5 -44.0 40.2 20.8 45.7 348 349 A Q H X S+ 0 0 20 -4,-2.9 4,-2.0 1,-0.2 -2,-0.2 0.979 112.2 48.5 -58.3 -47.2 37.4 23.3 45.2 349 350 A G H X S+ 0 0 27 -4,-2.9 4,-2.5 1,-0.2 5,-0.3 0.852 111.4 48.3 -54.3 -47.9 35.1 20.9 47.0 350 351 A W H X S+ 0 0 3 -4,-2.4 4,-3.0 1,-0.2 -1,-0.2 0.959 113.8 47.9 -63.6 -43.5 37.4 20.4 50.0 351 352 A Q H <>S+ 0 0 0 -4,-3.3 5,-2.5 -5,-0.2 6,-0.9 0.813 116.5 43.2 -68.5 -25.0 38.0 24.2 50.3 352 353 A W H ><5S+ 0 0 74 -4,-2.0 3,-1.6 -5,-0.3 5,-0.2 0.984 119.8 39.0 -78.2 -63.0 34.2 24.9 50.1 353 354 A A H 3<5S+ 0 0 2 -4,-2.5 -2,-0.2 1,-0.3 -3,-0.2 0.839 117.5 52.8 -51.3 -44.6 33.0 22.1 52.4 354 355 A G T 3<5S- 0 0 0 -4,-3.0 -1,-0.3 -5,-0.3 -2,-0.2 0.530 109.1-121.0 -81.6 -5.4 36.0 22.7 54.7 355 356 A G T < 5 + 0 0 4 -3,-1.6 -3,-0.2 -4,-0.4 -2,-0.1 0.919 69.5 131.7 75.9 42.3 35.4 26.4 55.1 356 357 A L S S+ 0 0 14 -6,-0.9 3,-1.2 1,-0.4 2,-0.2 0.412 74.1 142.9 127.2 10.0 37.7 30.0 51.4 358 359 A V G > S- 0 0 0 -7,-0.7 3,-2.5 1,-0.3 -1,-0.4 -0.504 91.7 -12.3 -60.2 126.5 36.1 28.9 48.3 359 360 A D G 3 S- 0 0 38 -226,-1.7 -1,-0.3 1,-0.3 -225,-0.2 0.747 115.5 -75.9 54.7 27.4 33.2 31.3 47.4 360 361 A A G < S+ 0 0 77 -3,-1.2 -1,-0.3 1,-0.2 -2,-0.1 0.802 70.8 179.4 62.3 23.5 33.4 32.9 50.9 361 362 A A < - 0 0 20 -3,-2.5 -4,-0.2 1,-0.1 -1,-0.2 -0.457 34.0-116.3 -60.3 126.4 31.6 29.9 52.3 362 363 A P > - 0 0 54 0, 0.0 3,-0.9 0, 0.0 -1,-0.1 -0.426 5.4-132.5 -79.9 144.1 31.5 30.9 55.9 363 364 A Y T 3 S+ 0 0 48 1,-0.2 51,-0.1 -8,-0.1 50,-0.1 0.872 100.0 70.6 -50.2 -36.9 33.3 29.0 58.6 364 365 A F T 3 + 0 0 119 1,-0.1 2,-1.2 49,-0.1 -1,-0.2 0.736 68.6 102.2 -66.2 -19.3 30.2 29.0 60.8 365 366 A R < + 0 0 107 -3,-0.9 2,-0.6 1,-0.1 -1,-0.1 -0.443 49.9 174.0 -68.6 96.4 28.2 26.6 58.6 366 367 A V - 0 0 23 -2,-1.2 -1,-0.1 -45,-0.0 -2,-0.0 -0.902 29.0-129.7-109.1 113.2 28.4 23.3 60.5 367 368 A F - 0 0 10 -2,-0.6 3,-0.0 1,-0.1 -2,-0.0 -0.329 10.2-145.2 -50.6 114.1 26.5 20.2 59.3 368 369 A N > - 0 0 72 1,-0.1 4,-2.9 38,-0.0 5,-0.2 -0.940 18.6-146.3 -73.4 118.8 24.5 18.7 62.0 369 370 A P H > S+ 0 0 11 0, 0.0 4,-0.9 0, 0.0 -1,-0.1 0.686 90.1 42.2 -74.7 -31.0 24.9 15.1 60.8 370 371 A V H > S+ 0 0 35 2,-0.2 4,-2.5 3,-0.1 3,-0.5 0.944 114.6 51.2 -78.0 -54.2 21.5 13.6 61.9 371 372 A L H > S+ 0 0 79 1,-0.2 4,-2.4 2,-0.2 3,-0.4 0.933 109.0 53.1 -31.2 -58.0 19.6 16.7 60.8 372 373 A Q H X S+ 0 0 3 -4,-2.9 4,-1.1 1,-0.3 -1,-0.2 0.878 110.4 48.8 -57.0 -35.6 21.5 16.3 57.4 373 374 A G H X S+ 0 0 0 -4,-0.9 4,-0.6 -3,-0.5 -1,-0.3 0.818 110.1 48.6 -73.0 -37.2 20.2 12.8 57.3 374 375 A E H < S+ 0 0 123 -4,-2.5 3,-0.2 -3,-0.4 -2,-0.2 0.862 113.5 46.3 -75.1 -36.8 16.6 13.6 58.1 375 376 A R H < S+ 0 0 150 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.711 120.2 38.2 -72.2 -20.5 16.3 16.4 55.5 376 377 A H H < S+ 0 0 21 -4,-1.1 -173,-2.3 -5,-0.3 -172,-0.4 0.348 118.5 36.4-125.7 16.9 18.0 14.4 52.6 377 378 A D S >< S- 0 0 8 -4,-0.6 3,-2.8 -3,-0.2 6,-0.2 -0.261 73.7-167.6-156.5 61.3 17.0 10.7 52.7 378 379 A P T 3 S+ 0 0 102 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.487 77.2 19.8 -56.2 -40.2 13.3 11.0 53.8 379 380 A E T 3 S- 0 0 147 0, 0.0 -5,-0.1 0, 0.0 0, 0.0 -0.105 109.2 -99.9-116.5 42.2 12.4 7.4 54.8 380 381 A G S <> S+ 0 0 27 -3,-2.8 4,-1.9 -7,-0.2 5,-0.2 0.452 78.0 131.4 83.4 -10.6 15.8 5.7 55.3 381 382 A R H > S+ 0 0 160 1,-0.2 4,-1.2 2,-0.2 3,-0.2 0.905 75.6 44.7 -57.8 -34.7 16.3 3.9 52.0 382 383 A W H >> S+ 0 0 11 1,-0.3 4,-1.3 2,-0.2 3,-0.7 0.928 111.7 50.6 -76.1 -51.3 19.8 5.2 51.5 383 384 A L H 3> S+ 0 0 9 1,-0.3 4,-1.8 2,-0.2 7,-0.3 0.744 110.0 51.5 -56.3 -31.3 21.1 4.6 55.0 384 385 A K H 3< S+ 0 0 160 -4,-1.9 -1,-0.3 2,-0.2 -2,-0.2 0.749 106.6 54.0 -80.6 -25.5 19.8 1.1 54.9 385 386 A R H << S+ 0 0 165 -4,-1.2 -2,-0.2 -3,-0.7 -1,-0.2 0.802 122.0 26.8 -74.8 -28.5 21.6 0.3 51.6 386 387 A W H < S+ 0 0 36 -4,-1.3 -2,-0.2 1,-0.1 -3,-0.1 0.646 137.1 8.5-118.2 -16.8 25.0 1.4 52.9 387 388 A A >< + 0 0 0 -4,-1.8 3,-2.3 -5,-0.2 -2,-0.1 -0.157 54.0 166.0-157.9 65.9 25.2 0.9 56.6 388 389 A P T 3 + 0 0 93 0, 0.0 -4,-0.1 0, 0.0 -3,-0.1 0.488 65.2 91.2 -67.6 3.5 22.2 -0.9 58.1 389 390 A E T 3 S+ 0 0 99 -97,-0.1 -5,-0.1 2,-0.0 -2,-0.0 0.766 81.5 71.0 -49.4 -37.0 24.4 -1.3 61.3 390 391 A Y < - 0 0 15 -3,-2.3 -3,-0.1 -7,-0.3 3,-0.1 -0.820 68.5-160.7-100.4 128.7 22.6 1.9 62.1 391 392 A P S S- 0 0 114 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.669 80.0 -16.6 -82.4 -17.5 18.9 2.0 63.0 392 393 A S S S- 0 0 56 2,-0.4 -22,-0.0 -9,-0.1 -19,-0.0 -0.940 85.7 -76.3-163.2-178.8 18.8 5.8 62.2 393 394 A Y S S+ 0 0 16 -2,-0.3 -100,-0.2 -23,-0.1 -20,-0.1 0.372 89.9 119.5 -67.9 2.1 21.1 8.8 61.7 394 395 A A S S- 0 0 49 -24,-0.1 -2,-0.4 -103,-0.1 2,-0.1 -0.607 73.6-114.1 -65.2 124.0 21.5 8.9 65.6 395 396 A P - 0 0 50 0, 0.0 2,-0.4 0, 0.0 -104,-0.2 -0.362 25.1-155.5 -67.8 158.0 25.2 8.4 66.3 396 397 A K S S- 0 0 79 -106,-2.0 -2,-0.0 1,-0.1 0, 0.0 -0.923 72.6 -26.9-149.9 97.3 26.4 5.2 68.0 397 398 A D S S- 0 0 152 -2,-0.4 -106,-0.1 1,-0.1 -1,-0.1 0.942 83.0-157.7 36.5 64.1 29.7 5.3 69.9 398 399 A P - 0 0 42 0, 0.0 -108,-0.3 0, 0.0 -1,-0.1 -0.326 24.0-119.1 -55.1 136.7 31.0 8.2 67.7 399 400 A V S S+ 0 0 60 -110,-2.9 2,-0.3 -119,-0.1 -109,-0.1 0.647 99.7 21.8 -62.6 -22.9 34.9 8.5 67.6 400 401 A V S S- 0 0 33 -111,-0.3 2,-0.5 0, 0.0 3,-0.1 -0.898 93.6 -99.9-123.7 162.6 34.4 12.0 69.0 401 402 A D > - 0 0 61 -2,-0.3 4,-1.2 1,-0.1 5,-0.2 -0.802 36.0-143.4 -65.7 124.2 31.6 13.8 71.0 402 403 A L H >> S+ 0 0 31 -2,-0.5 4,-3.9 1,-0.2 3,-0.6 0.955 94.2 39.7 -66.0 -47.1 29.9 15.8 68.2 403 404 A E H 3> S+ 0 0 83 1,-0.3 4,-3.4 2,-0.2 5,-0.4 0.885 110.9 57.5 -70.5 -38.0 29.1 18.9 70.2 404 405 A E H 3> S+ 0 0 120 1,-0.2 4,-1.4 2,-0.2 -1,-0.3 0.874 117.3 37.7 -52.9 -32.4 32.3 18.9 72.1 405 406 A A H X S+ 0 0 61 -4,-1.4 4,-2.1 -5,-0.4 3,-0.7 0.965 110.6 42.4 -60.7 -57.9 35.7 23.0 69.5 409 410 A Y H 3X S+ 0 0 1 -4,-2.9 4,-3.3 -88,-0.3 5,-0.2 0.889 110.3 53.8 -55.2 -62.1 35.9 24.0 65.8 410 411 A L H 3X S+ 0 0 24 -4,-1.7 4,-1.5 -5,-0.2 -1,-0.3 0.830 113.3 49.6 -35.4 -37.3 33.7 27.2 66.0 411 412 A R H < S+ 0 0 53 -4,-1.1 3,-0.7 1,-0.2 -2,-0.2 0.894 120.7 50.4 -11.7 -68.6 41.6 33.0 63.3 417 418 A A H 3< S- 0 0 28 -4,-2.2 -3,-0.2 1,-0.3 -1,-0.2 0.773 132.1 -0.4 -73.4 -52.6 38.6 34.0 61.1 418 419 A R H 3< 0 0 86 -4,-1.3 -1,-0.3 -5,-0.2 -2,-0.2 -0.289 360.0 360.0-134.3 49.2 37.3 37.4 62.4 419 420 A G << 0 0 98 -4,-0.8 -4,-0.1 -3,-0.7 0, 0.0 -0.909 360.0 360.0-134.0 360.0 39.7 38.1 65.3