==== 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 BIOSYNTHESIS, LIGASE 16-MAY-95 2GLT . COMPND 2 MOLECULE: GLUTATHIONE BIOSYNTHETIC LIGASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR K.MATSUDA,H.YAMAGUCHI,H.KATO,T.NISHIOKA,Y.KATSUBE,J.ODA . 296 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13973.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 221 74.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 15 5.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 61 20.6 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 . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 1.0 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 . 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 . 32 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 32 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 74 25.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.7 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 0 1 1 0 1 0 0 2 0 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 2 2 3 2 0 1 0 1 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 1 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 0 149 0, 0.0 2,-0.4 0, 0.0 32,-0.1 0.000 360.0 360.0 360.0-163.8 31.1 -6.0 46.8 2 2 A I - 0 0 27 30,-0.2 32,-2.6 26,-0.1 2,-0.6 -0.801 360.0-150.5 -90.5 132.5 29.2 -3.2 48.6 3 3 A K E -a 34 0A 70 -2,-0.4 79,-1.8 30,-0.2 78,-1.7 -0.938 18.4-173.0 -98.8 112.2 29.6 0.1 46.9 4 4 A L E -ab 35 82A 0 30,-2.8 32,-2.2 -2,-0.6 2,-0.3 -0.952 4.8-170.0-112.8 124.2 29.3 2.8 49.6 5 5 A G E -ab 36 83A 0 77,-2.8 79,-2.2 -2,-0.5 2,-0.4 -0.749 4.9-158.6-104.5 156.6 29.2 6.5 48.8 6 6 A I E -ab 37 84A 0 30,-2.5 32,-2.5 -2,-0.3 2,-0.6 -0.992 9.7-157.2-139.3 132.1 29.4 9.3 51.3 7 7 A V E +ab 38 85A 0 77,-2.5 79,-2.9 -2,-0.4 2,-0.3 -0.937 39.8 136.6-105.9 119.1 28.3 12.9 51.2 8 8 A M - 0 0 7 30,-1.9 32,-0.4 -2,-0.6 79,-0.2 -0.895 56.7 -78.7-151.6 172.9 30.3 15.0 53.6 9 9 A D S S- 0 0 49 77,-0.4 5,-0.1 -2,-0.3 29,-0.1 -0.524 83.1 -51.3 -76.0 159.8 32.2 18.3 54.1 10 10 A P > - 0 0 44 0, 0.0 3,-1.6 0, 0.0 4,-0.3 0.040 45.8-151.0 -42.8 118.8 35.7 18.5 52.6 11 11 A I G > S+ 0 0 3 1,-0.3 3,-0.7 2,-0.2 55,-0.1 0.690 90.9 71.1 -66.8 -16.0 37.7 15.5 53.7 12 12 A A G 3 S+ 0 0 55 1,-0.2 -1,-0.3 3,-0.0 54,-0.0 0.677 101.2 45.7 -75.1 -11.5 40.9 17.6 53.5 13 13 A N G < S+ 0 0 133 -3,-1.6 -1,-0.2 2,-0.1 -2,-0.2 0.432 87.0 105.6-112.6 -1.0 39.8 19.6 56.5 14 14 A I < - 0 0 35 -3,-0.7 2,-0.6 -4,-0.3 -3,-0.0 -0.221 69.1-122.9 -75.1 169.5 38.7 17.0 59.0 15 15 A N >> - 0 0 69 1,-0.1 4,-2.2 2,-0.0 3,-1.6 -0.957 17.7-156.4-112.6 111.9 40.6 15.9 62.0 16 16 A I T 34 S+ 0 0 3 -2,-0.6 -1,-0.1 1,-0.3 -2,-0.0 0.600 87.9 60.0 -73.9 -10.3 41.2 12.2 61.8 17 17 A K T 34 S+ 0 0 106 1,-0.1 -1,-0.3 46,-0.0 44,-0.0 0.555 122.4 24.0 -88.6 2.6 41.6 11.6 65.5 18 18 A K T <4 S+ 0 0 93 -3,-1.6 2,-0.4 255,-0.1 253,-0.4 0.539 91.1 110.2-134.2 -24.4 38.2 13.0 66.2 19 19 A D X - 0 0 35 -4,-2.2 4,-1.7 1,-0.2 5,-0.1 -0.481 44.4-164.2 -73.4 123.7 36.1 12.6 63.0 20 20 A S H > S+ 0 0 2 -2,-0.4 4,-1.7 2,-0.2 -1,-0.2 0.834 89.9 56.1 -73.9 -27.8 33.3 10.0 63.2 21 21 A S H > S+ 0 0 7 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.904 106.9 50.9 -70.0 -38.1 32.8 9.9 59.3 22 22 A F H > S+ 0 0 2 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.945 107.8 52.1 -61.5 -47.8 36.5 9.0 58.9 23 23 A A H X S+ 0 0 6 -4,-1.7 4,-1.7 1,-0.2 -1,-0.2 0.861 109.2 51.8 -57.7 -39.1 36.1 6.2 61.5 24 24 A M H X S+ 0 0 1 -4,-1.7 4,-2.4 1,-0.2 -1,-0.2 0.914 108.6 48.5 -62.4 -47.1 33.2 5.0 59.4 25 25 A L H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.883 107.9 55.7 -65.6 -33.8 35.1 4.9 56.1 26 26 A L H X S+ 0 0 40 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.951 111.6 44.4 -62.1 -45.5 38.1 3.0 57.8 27 27 A E H X S+ 0 0 21 -4,-1.7 4,-1.5 2,-0.2 -2,-0.2 0.917 111.8 50.9 -61.1 -49.4 35.7 0.3 58.9 28 28 A A H <>S+ 0 0 1 -4,-2.4 5,-2.4 1,-0.2 3,-0.4 0.936 112.4 49.3 -55.7 -44.4 33.8 0.1 55.5 29 29 A Q H ><5S+ 0 0 62 -4,-2.6 3,-1.7 1,-0.2 -1,-0.2 0.885 105.8 55.8 -64.5 -36.3 37.3 -0.2 53.9 30 30 A R H 3<5S+ 0 0 173 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.797 106.0 51.4 -66.5 -28.3 38.3 -3.0 56.4 31 31 A R T 3<5S- 0 0 65 -4,-1.5 -1,-0.3 -3,-0.4 -2,-0.2 0.396 123.9-109.7 -87.0 3.0 35.3 -5.0 55.3 32 32 A G T < 5 + 0 0 45 -3,-1.7 -3,-0.2 1,-0.2 2,-0.2 0.754 61.6 156.4 76.6 28.4 36.4 -4.5 51.7 33 33 A Y < - 0 0 15 -5,-2.4 2,-0.5 -6,-0.1 -1,-0.2 -0.524 46.6-117.3 -81.0 153.0 33.6 -2.0 50.5 34 34 A E E -a 3 0A 67 -32,-2.6 -30,-2.8 -2,-0.2 2,-0.4 -0.798 33.2-143.4 -85.7 128.4 34.4 0.2 47.5 35 35 A L E -aC 4 57A 3 22,-0.5 22,-2.1 -2,-0.5 2,-0.5 -0.788 15.1-167.7-100.9 136.0 34.2 3.8 48.7 36 36 A H E -aC 5 56A 5 -32,-2.2 -30,-2.5 -2,-0.4 2,-0.4 -0.965 12.5-151.3-124.6 112.6 32.8 6.8 46.7 37 37 A Y E +aC 6 55A 2 18,-2.8 18,-1.3 -2,-0.5 2,-0.3 -0.719 20.2 170.8 -84.0 129.6 33.5 10.3 48.0 38 38 A M E -a 7 0A 0 -32,-2.5 -30,-1.9 -2,-0.4 2,-0.3 -0.986 19.4-159.0-139.2 142.6 31.1 13.2 47.3 39 39 A E > - 0 0 59 -2,-0.3 3,-1.9 14,-0.3 4,-0.4 -0.698 44.7 -95.1-105.2 167.4 30.6 16.8 48.4 40 40 A M G > S+ 0 0 48 -32,-0.4 3,-1.6 1,-0.3 -31,-0.1 0.908 122.5 55.0 -48.2 -49.4 27.3 18.6 48.1 41 41 A G G 3 S+ 0 0 78 1,-0.3 -1,-0.3 11,-0.0 12,-0.0 0.535 96.1 68.2 -66.7 -7.9 28.2 20.3 44.8 42 42 A D G < S+ 0 0 32 -3,-1.9 11,-1.6 10,-0.1 2,-0.3 0.625 83.9 88.3 -84.1 -14.1 28.9 16.9 43.2 43 43 A L E < +D 52 0A 15 -3,-1.6 2,-0.3 -4,-0.4 9,-0.2 -0.664 53.6 156.5 -85.6 136.2 25.2 15.9 43.4 44 44 A Y E -D 51 0A 83 7,-2.7 7,-2.7 -2,-0.3 2,-0.4 -0.966 33.2-134.2-154.1 172.0 22.9 16.8 40.5 45 45 A L E -D 50 0A 80 -2,-0.3 2,-0.5 5,-0.2 5,-0.2 -0.992 12.7-171.4-133.7 122.8 19.6 15.7 38.8 46 46 A I E > S-D 49 0A 79 3,-2.7 3,-2.1 -2,-0.4 -2,-0.0 -0.983 78.1 -27.2-123.0 118.0 19.2 15.4 35.1 47 47 A N T 3 S- 0 0 161 -2,-0.5 -1,-0.1 1,-0.3 3,-0.1 0.883 128.0 -43.7 38.0 61.2 15.6 14.8 34.1 48 48 A G T 3 S+ 0 0 28 1,-0.2 2,-0.4 -3,-0.0 -1,-0.3 0.135 112.7 119.2 82.4 -24.3 14.6 13.2 37.4 49 49 A E E < -D 46 0A 57 -3,-2.1 -3,-2.7 1,-0.0 2,-0.4 -0.680 59.5-136.7 -85.8 128.0 17.8 11.0 37.6 50 50 A A E +D 45 0A 3 -2,-0.4 27,-1.7 -5,-0.2 28,-0.5 -0.680 36.6 160.2 -79.2 122.6 20.0 11.4 40.6 51 51 A R E -DE 44 76A 50 -7,-2.7 -7,-2.7 -2,-0.4 2,-0.3 -0.915 15.4-172.6-139.0 167.4 23.7 11.5 39.6 52 52 A A E -DE 43 75A 0 23,-2.2 23,-2.0 -2,-0.3 2,-0.7 -0.995 32.0-115.7-160.3 155.9 27.0 12.6 40.9 53 53 A H E - E 0 74A 42 -11,-1.6 2,-0.3 -2,-0.3 -14,-0.3 -0.863 46.2-176.6 -86.6 114.0 30.6 13.0 40.2 54 54 A T E - E 0 73A 0 19,-2.9 19,-2.3 -2,-0.7 2,-0.4 -0.751 22.1-147.5-112.5 160.9 32.3 10.6 42.7 55 55 A R E -CE 37 72A 52 -18,-1.3 -18,-2.8 -2,-0.3 2,-0.4 -0.989 26.9-120.5-119.4 135.1 36.0 10.0 43.4 56 56 A T E -CE 36 71A 21 15,-1.6 14,-2.9 -2,-0.4 15,-0.6 -0.681 41.3-145.2 -74.8 126.1 36.9 6.4 44.4 57 57 A L E -CE 35 69A 9 -22,-2.1 -22,-0.5 -2,-0.4 2,-0.4 -0.752 26.6-173.2-110.2 146.3 38.4 6.8 47.8 58 58 A N E - E 0 68A 57 10,-1.8 10,-2.2 -2,-0.3 2,-0.3 -0.995 17.3-170.9-127.5 128.2 41.2 5.2 49.8 59 59 A V E + E 0 67A 0 -2,-0.4 2,-0.3 8,-0.2 8,-0.3 -0.919 8.2 175.7-122.5 146.6 41.6 6.3 53.5 60 60 A K - 0 0 77 6,-2.2 2,-1.8 -2,-0.3 5,-0.0 -0.991 41.6-110.1-149.7 147.1 44.4 5.6 56.1 61 61 A Q S S+ 0 0 77 -2,-0.3 2,-0.3 2,-0.0 5,-0.1 -0.554 72.6 126.6 -73.0 84.1 45.1 6.7 59.7 62 62 A N - 0 0 57 -2,-1.8 3,-0.2 1,-0.0 -2,-0.2 -0.911 54.6-148.3-147.7 118.1 48.1 8.8 58.7 63 63 A Y S S+ 0 0 120 -2,-0.3 3,-0.2 1,-0.2 -47,-0.1 0.514 98.4 47.4 -73.2 -5.3 48.3 12.5 59.8 64 64 A E S S+ 0 0 174 1,-0.2 2,-0.3 2,-0.0 -1,-0.2 0.749 133.2 8.9 -97.6 -35.2 50.2 13.6 56.7 65 65 A E + 0 0 89 -3,-0.2 -1,-0.2 1,-0.1 -2,-0.1 -0.803 61.2 162.0-152.2 99.4 48.0 11.8 54.3 66 66 A W + 0 0 44 -2,-0.3 -6,-2.2 -3,-0.2 2,-0.3 0.477 68.4 31.3-100.0 -1.6 44.8 10.2 55.4 67 67 A F E -E 59 0A 45 -8,-0.3 2,-0.3 -5,-0.1 -8,-0.2 -0.996 53.9-171.7-152.6 159.4 43.1 9.9 51.9 68 68 A S E -E 58 0A 31 -10,-2.2 -10,-1.8 -2,-0.3 2,-0.5 -0.994 22.9-131.6-148.8 142.1 43.9 9.3 48.2 69 69 A F E +E 57 0A 79 -2,-0.3 -12,-0.2 -12,-0.2 3,-0.1 -0.850 24.4 175.5-100.6 131.4 41.7 9.5 45.2 70 70 A V E + 0 0 97 -14,-2.9 2,-0.3 -2,-0.5 -13,-0.1 0.351 63.2 6.2-119.9 6.8 42.2 6.5 43.0 71 71 A G E -E 56 0A 27 -15,-0.6 -15,-1.6 2,-0.0 2,-0.3 -0.938 57.1-147.6-178.3 162.0 39.5 7.1 40.4 72 72 A E E +E 55 0A 129 -17,-0.3 2,-0.3 -2,-0.3 -17,-0.2 -0.993 26.5 157.5-142.9 137.5 37.0 9.7 39.2 73 73 A Q E -E 54 0A 62 -19,-2.3 -19,-2.9 -2,-0.3 2,-0.7 -0.992 39.9-131.0-161.7 155.0 33.7 9.0 37.5 74 74 A D E +E 53 0A 80 -2,-0.3 -21,-0.2 -21,-0.2 -2,-0.0 -0.922 46.0 161.5-105.1 106.9 30.2 10.4 36.8 75 75 A L E -E 52 0A 21 -23,-2.0 -23,-2.2 -2,-0.7 2,-0.4 -0.791 46.0 -99.4-123.3 165.3 27.7 7.7 37.8 76 76 A P E > -E 51 0A 21 0, 0.0 3,-2.3 0, 0.0 -25,-0.3 -0.728 32.0-132.8 -76.1 133.8 24.0 7.4 38.6 77 77 A L G > S+ 0 0 0 -27,-1.7 3,-2.0 -2,-0.4 -26,-0.1 0.752 103.6 73.3 -58.4 -24.4 23.6 7.2 42.4 78 78 A A G 3 S+ 0 0 33 -28,-0.5 -1,-0.3 1,-0.3 -27,-0.1 0.479 84.2 69.1 -66.1 -10.2 21.3 4.2 42.0 79 79 A D G < S+ 0 0 91 -3,-2.3 2,-0.3 31,-0.0 -1,-0.3 0.481 86.3 84.3 -84.1 -7.9 24.5 2.3 41.1 80 80 A L < - 0 0 3 -3,-2.0 -76,-0.1 1,-0.1 3,-0.1 -0.696 69.5-151.3 -93.3 145.3 25.5 2.7 44.8 81 81 A D S S+ 0 0 53 -78,-1.7 30,-2.5 1,-0.3 2,-0.3 0.908 79.7 6.1 -78.8 -41.8 24.2 0.2 47.3 82 82 A V E -bf 4 111A 0 -79,-1.8 -77,-2.8 28,-0.2 2,-0.4 -0.979 58.7-159.7-148.8 146.3 24.3 2.7 50.2 83 83 A I E -bf 5 112A 0 28,-2.2 30,-2.7 -2,-0.3 2,-0.8 -0.991 10.9-149.5-130.5 124.8 25.0 6.4 50.8 84 84 A L E -bf 6 113A 2 -79,-2.2 -77,-2.5 -2,-0.4 2,-1.1 -0.838 9.4-153.8 -88.7 106.3 25.9 8.0 54.1 85 85 A M E +b 7 0A 6 28,-2.6 -77,-0.1 -2,-0.8 -79,-0.1 -0.773 32.0 157.0 -80.9 103.6 24.6 11.5 54.2 86 86 A R + 0 0 16 -79,-2.9 -77,-0.4 -2,-1.1 2,-0.2 0.013 14.8 142.3-122.6 23.2 27.1 12.9 56.7 87 87 A K - 0 0 34 -79,-0.2 -79,-0.1 -80,-0.1 -2,-0.0 -0.418 49.7-119.1 -63.9 135.2 26.9 16.6 55.7 88 88 A D - 0 0 79 -2,-0.2 -1,-0.1 1,-0.1 -2,-0.0 -0.414 41.7 -66.5 -77.2 152.7 27.1 18.9 58.7 89 89 A P S S+ 0 0 72 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.241 75.9 98.3 -55.6 155.7 24.5 21.4 59.9 90 90 A P - 0 0 78 0, 0.0 2,-1.0 0, 0.0 5,-0.1 0.210 58.6-143.2 -75.6 162.5 22.9 23.9 59.4 91 91 A F + 0 0 56 72,-0.2 2,-0.2 -2,-0.2 -3,-0.0 -0.890 46.2 148.2 -98.2 100.1 19.7 22.3 58.2 92 92 A D > - 0 0 69 -2,-1.0 4,-1.9 1,-0.0 3,-0.2 -0.559 66.1 -80.4-124.3-171.1 18.8 24.8 55.6 93 93 A T H > S+ 0 0 88 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.888 126.9 57.4 -68.9 -32.1 17.1 24.9 52.2 94 94 A E H > S+ 0 0 116 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.868 108.2 46.2 -62.1 -33.4 20.3 23.7 50.5 95 95 A F H > S+ 0 0 1 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.865 110.1 54.1 -75.3 -39.8 20.3 20.6 52.7 96 96 A I H X S+ 0 0 42 -4,-1.9 4,-0.8 1,-0.2 -2,-0.2 0.902 107.2 51.4 -62.4 -36.9 16.6 20.2 52.0 97 97 A Y H >X S+ 0 0 120 -4,-2.4 4,-1.2 1,-0.2 3,-0.7 0.885 108.1 51.5 -65.9 -39.2 17.3 20.3 48.2 98 98 A A H 3X S+ 0 0 6 -4,-1.7 4,-2.3 1,-0.3 -1,-0.2 0.821 101.9 60.8 -65.2 -31.9 20.0 17.6 48.5 99 99 A T H 3X S+ 0 0 0 -4,-1.5 4,-1.6 2,-0.2 -1,-0.3 0.821 101.6 53.2 -62.8 -32.9 17.6 15.4 50.4 100 100 A Y H X S+ 0 0 28 -4,-1.2 4,-1.5 2,-0.2 3,-0.8 0.944 112.0 47.7 -67.6 -46.7 18.3 14.2 45.0 102 102 A L H 3X S+ 0 0 0 -4,-2.3 4,-2.0 1,-0.3 -2,-0.2 0.882 107.2 57.8 -61.5 -36.1 19.1 11.4 47.5 103 103 A E H 3X S+ 0 0 46 -4,-1.6 4,-1.5 1,-0.2 -1,-0.3 0.769 101.2 55.4 -66.9 -26.1 15.5 10.4 47.5 104 104 A R H S+ 0 0 2 -4,-1.5 5,-1.7 1,-0.2 -2,-0.2 0.851 109.8 56.6 -65.7 -36.4 18.4 7.5 44.1 106 106 A E H ><5S+ 0 0 37 -4,-2.0 3,-1.3 1,-0.2 -2,-0.2 0.866 103.2 52.7 -65.3 -37.7 16.5 5.9 47.0 107 107 A E H 3<5S+ 0 0 122 -4,-1.5 -1,-0.2 1,-0.3 -2,-0.2 0.770 107.4 53.2 -67.4 -29.7 13.4 5.2 44.8 108 108 A K T 3<5S- 0 0 108 -4,-1.0 -1,-0.3 -3,-0.2 -2,-0.2 0.223 134.5 -84.3 -89.1 8.8 15.7 3.5 42.4 109 109 A G T < 5S+ 0 0 65 -3,-1.3 -3,-0.2 1,-0.3 -2,-0.1 0.130 81.0 131.1 121.8 -24.5 17.1 1.2 45.1 110 110 A T < - 0 0 3 -5,-1.7 2,-0.4 -8,-0.1 -1,-0.3 -0.363 53.4-127.7 -66.5 136.8 20.0 2.8 47.1 111 111 A L E -f 82 0A 38 -30,-2.5 -28,-2.2 -2,-0.1 2,-0.5 -0.716 23.6-157.9 -80.2 132.8 19.8 2.7 51.0 112 112 A I E -f 83 0A 3 -2,-0.4 2,-0.6 -30,-0.2 -28,-0.2 -0.968 13.8-130.3-117.9 119.2 20.3 6.3 52.4 113 113 A V E S+f 84 0A 9 -30,-2.7 -28,-2.6 -2,-0.5 136,-0.1 -0.938 98.4 23.2-103.5 111.7 21.5 6.5 56.0 114 114 A N S S- 0 0 5 -2,-0.6 -1,-0.2 134,-0.5 135,-0.2 0.673 104.8-112.0 -98.4 167.2 19.5 8.5 57.2 115 115 A K > - 0 0 70 133,-1.8 4,-1.4 132,-0.2 5,-0.2 -0.339 19.8-136.0 -63.4 128.8 16.3 8.4 55.2 116 116 A P H > S+ 0 0 0 0, 0.0 4,-1.6 0, 0.0 3,-0.2 0.840 101.8 51.4 -57.9 -37.1 15.8 11.7 53.3 117 117 A Q H > S+ 0 0 90 1,-0.2 4,-1.9 2,-0.2 3,-0.2 0.936 111.0 48.4 -66.0 -45.2 12.1 12.0 54.2 118 118 A S H > S+ 0 0 2 129,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.710 104.7 58.8 -67.2 -23.2 12.8 11.5 57.8 119 119 A L H < S+ 0 0 4 -4,-1.4 -1,-0.2 2,-0.2 -2,-0.2 0.892 112.7 41.3 -70.5 -36.9 15.7 14.2 57.7 120 120 A R H < S+ 0 0 64 -4,-1.6 -2,-0.2 -3,-0.2 3,-0.2 0.793 118.1 47.5 -74.5 -34.8 13.0 16.7 56.6 121 121 A D H < S+ 0 0 75 -4,-1.9 2,-0.7 1,-0.2 -2,-0.2 0.818 108.3 57.0 -74.0 -33.7 10.4 15.3 59.0 122 122 A C < - 0 0 1 -4,-2.1 -1,-0.2 -5,-0.1 144,-0.2 -0.721 65.2-170.7-112.5 82.1 12.7 15.2 62.1 123 123 A N > - 0 0 55 -2,-0.7 4,-2.0 -3,-0.2 5,-0.2 -0.518 32.3-122.3 -66.4 139.1 14.3 18.6 63.1 124 124 A E T 4 S+ 0 0 34 1,-0.2 140,-2.2 -2,-0.2 4,-0.1 0.865 108.0 26.8 -53.6 -43.0 16.9 18.1 65.8 125 125 A K T >4 S+ 0 0 29 37,-0.3 3,-0.8 138,-0.2 -1,-0.2 0.897 124.3 45.0 -89.7 -45.2 15.1 20.5 68.2 126 126 A L G >4 S+ 0 0 64 1,-0.2 3,-1.2 2,-0.2 -2,-0.2 0.646 96.8 72.9 -77.5 -15.3 11.4 20.4 67.2 127 127 A F G >< S+ 0 0 8 -4,-2.0 3,-1.8 1,-0.2 -1,-0.2 0.723 81.4 72.6 -67.1 -21.4 11.2 16.6 66.9 128 128 A T G X S+ 0 0 4 -3,-0.8 3,-1.8 1,-0.3 -1,-0.2 0.714 78.2 79.0 -70.6 -15.2 11.3 16.4 70.7 129 129 A A G < S+ 0 0 64 -3,-1.2 3,-0.5 1,-0.3 -1,-0.3 0.667 86.4 58.5 -58.0 -20.5 7.7 17.7 70.5 130 130 A W G < S+ 0 0 172 -3,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.459 108.9 44.3 -88.4 -2.0 6.7 14.1 69.7 131 131 A F X> + 0 0 15 -3,-1.8 3,-1.9 -4,-0.1 4,-0.6 -0.409 69.5 152.0-137.7 55.2 8.2 12.8 73.0 132 132 A S T 34 + 0 0 86 -3,-0.5 3,-0.2 1,-0.3 -1,-0.1 0.695 67.4 60.2 -65.8 -23.4 6.9 15.4 75.4 133 133 A D T 34 S+ 0 0 102 1,-0.2 -1,-0.3 -3,-0.1 -2,-0.0 0.638 108.3 48.0 -76.8 -14.5 6.9 13.2 78.4 134 134 A L T <4 S+ 0 0 4 -3,-1.9 127,-2.6 -6,-0.2 -2,-0.2 0.595 104.6 69.8-101.7 -8.1 10.7 12.8 77.9 135 135 A T S < S- 0 0 13 -4,-0.6 127,-0.2 125,-0.2 3,-0.1 -0.513 82.1-101.4-109.2 166.8 11.6 16.4 77.5 136 136 A P - 0 0 10 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.221 63.8 -66.2 -66.4 174.1 11.8 19.6 79.7 137 137 A E - 0 0 89 17,-0.0 59,-1.2 2,-0.0 2,-0.4 -0.551 66.0-171.0 -65.6 126.3 9.1 22.3 79.5 138 138 A T E -G 195 0B 52 -2,-0.3 2,-0.4 57,-0.2 57,-0.2 -0.993 19.4-174.1-132.3 126.8 9.4 23.7 76.0 139 139 A L E -G 194 0B 33 55,-2.5 55,-2.2 -2,-0.4 2,-0.5 -0.982 5.4-166.7-117.0 125.6 7.8 26.7 74.4 140 140 A V E +G 193 0B 59 -2,-0.4 2,-0.3 53,-0.2 53,-0.2 -0.978 35.8 135.9-105.9 119.1 8.4 27.4 70.6 141 141 A T E -G 192 0B 9 51,-2.0 51,-1.8 -2,-0.5 47,-0.1 -0.992 57.3-137.4-159.1 164.9 7.2 31.0 69.8 142 142 A R S S+ 0 0 96 -2,-0.3 2,-0.5 49,-0.2 48,-0.2 0.498 75.7 89.8-105.4 -10.1 7.8 34.3 68.0 143 143 A N >> - 0 0 75 1,-0.1 4,-1.6 49,-0.1 3,-0.6 -0.830 61.0-149.4-119.0 143.0 6.7 36.6 70.9 144 144 A K H 3> S+ 0 0 73 -2,-0.5 4,-2.8 1,-0.2 5,-0.3 0.861 96.6 57.8 -50.7 -53.7 8.3 38.3 73.8 145 145 A A H 3> S+ 0 0 74 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.815 108.1 48.0 -56.8 -32.1 5.2 38.3 76.1 146 146 A Q H <> S+ 0 0 95 -3,-0.6 4,-1.7 2,-0.2 -1,-0.2 0.906 112.8 48.2 -76.8 -36.1 4.9 34.5 75.9 147 147 A L H X S+ 0 0 0 -4,-1.6 4,-2.0 2,-0.2 -2,-0.2 0.909 111.5 50.0 -66.8 -41.9 8.7 34.1 76.6 148 148 A K H X S+ 0 0 104 -4,-2.8 4,-1.2 1,-0.2 -1,-0.2 0.893 112.1 49.4 -61.1 -43.1 8.5 36.5 79.6 149 149 A A H X S+ 0 0 48 -4,-1.7 4,-1.6 -5,-0.3 -1,-0.2 0.792 107.7 51.6 -67.2 -34.4 5.5 34.6 80.8 150 150 A F H X S+ 0 0 24 -4,-1.7 4,-1.5 1,-0.2 -1,-0.2 0.865 108.9 53.9 -69.8 -35.5 7.3 31.3 80.5 151 151 A W H X S+ 0 0 40 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.808 104.6 53.8 -68.5 -29.7 10.1 32.9 82.5 152 152 A E H < S+ 0 0 133 -4,-1.2 -1,-0.2 1,-0.2 -2,-0.2 0.906 111.2 45.8 -73.0 -36.0 7.6 33.9 85.3 153 153 A K H < S+ 0 0 151 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.776 127.5 26.2 -74.1 -29.6 6.4 30.3 85.7 154 154 A H H < S- 0 0 43 -4,-1.5 2,-1.9 -5,-0.1 -2,-0.2 0.632 81.4-157.1-113.7 -16.5 9.8 28.7 85.7 155 155 A S S < S+ 0 0 53 -4,-2.1 2,-0.4 -5,-0.2 17,-0.4 -0.091 78.2 50.0 66.7 -32.2 12.2 31.5 86.9 156 156 A D S S+ 0 0 41 -2,-1.9 41,-2.3 15,-0.2 2,-0.3 -0.953 75.5 161.4-139.6 112.1 15.3 30.1 85.4 157 157 A I E -HI 170 196B 0 13,-2.7 13,-2.8 -2,-0.4 2,-0.4 -0.811 35.7-126.3-131.2 169.7 15.1 29.1 81.7 158 158 A I E -HI 169 195B 19 37,-2.9 37,-2.1 -2,-0.3 2,-0.5 -0.962 20.2-165.1-114.4 124.2 17.2 28.4 78.6 159 159 A L E +HI 168 194B 1 9,-2.4 9,-2.7 -2,-0.4 35,-0.2 -0.973 16.8 167.6-116.5 124.5 16.5 30.3 75.3 160 160 A K E - I 0 193B 23 33,-2.5 33,-2.1 -2,-0.5 2,-0.1 -0.892 34.6-111.1-127.1 156.9 18.0 29.0 72.1 161 161 A P E - I 0 192B 32 0, 0.0 31,-0.2 0, 0.0 5,-0.1 -0.512 17.2-142.5 -76.1 157.9 17.6 29.6 68.4 162 162 A L 0 0 22 29,-0.6 -37,-0.3 -2,-0.1 -36,-0.1 0.869 360.0 360.0 -83.1 -37.9 16.0 26.9 66.2 163 163 A D 0 0 124 -73,-0.1 -72,-0.2 0, 0.0 29,-0.0 0.934 360.0 360.0 -62.6 360.0 18.2 27.4 63.2 164 ! 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 0.0 165 168 A A 0 0 145 0, 0.0 2,-0.4 0, 0.0 -5,-0.0 0.000 360.0 360.0 360.0 121.5 25.4 26.5 70.2 166 169 A S + 0 0 69 -5,-0.1 2,-0.3 2,-0.0 -7,-0.0 -0.415 360.0 157.6-106.3 59.8 24.0 30.0 71.0 167 170 A I - 0 0 81 -2,-0.4 2,-0.4 -7,-0.1 -7,-0.2 -0.617 24.5-158.8 -93.5 136.9 22.0 29.3 74.3 168 171 A F E -H 159 0B 78 -9,-2.7 -9,-2.4 -2,-0.3 2,-0.6 -0.866 8.7-143.4-108.3 141.8 21.2 32.1 76.7 169 172 A R E -H 158 0B 84 -2,-0.4 2,-0.7 -11,-0.2 -11,-0.2 -0.928 12.3-169.6-111.2 122.5 20.4 31.5 80.3 170 173 A V E +H 157 0B 0 -13,-2.8 -13,-2.7 -2,-0.6 2,-0.3 -0.882 18.5 162.9-113.8 101.1 17.7 33.7 81.8 171 174 A K > - 0 0 103 -2,-0.7 3,-1.7 -15,-0.3 -15,-0.2 -0.741 50.1 -52.8-111.5 165.7 17.6 33.3 85.6 172 175 A E T 3 S+ 0 0 156 -17,-0.4 -1,-0.2 -2,-0.3 -16,-0.0 -0.012 123.6 18.0 -39.3 126.1 16.0 35.5 88.3 173 176 A G T 3 S+ 0 0 67 1,-0.3 -1,-0.2 -3,-0.1 -3,-0.0 0.428 82.4 150.9 89.0 2.2 17.1 39.2 88.2 174 177 A D X - 0 0 41 -3,-1.7 3,-0.6 1,-0.1 -1,-0.3 -0.478 34.9-158.2 -66.7 126.2 18.4 39.1 84.6 175 178 A P T 3 S+ 0 0 117 0, 0.0 3,-0.3 0, 0.0 4,-0.2 0.591 79.1 68.3 -81.1 -5.4 18.1 42.5 82.9 176 179 A N T 3> + 0 0 79 1,-0.2 4,-2.4 2,-0.1 5,-0.3 0.339 52.8 110.9-104.7 5.7 18.2 41.1 79.4 177 180 A L H <> S+ 0 0 13 -3,-0.6 4,-1.9 1,-0.2 5,-0.2 0.872 85.3 47.9 -46.5 -44.4 15.0 39.1 78.7 178 181 A G H > S+ 0 0 26 -3,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.939 113.4 42.2 -69.5 -51.4 13.7 41.6 76.2 179 182 A V H > S+ 0 0 89 1,-0.2 4,-2.3 -4,-0.2 -1,-0.2 0.864 114.1 53.7 -66.0 -34.3 16.8 42.1 74.1 180 183 A I H X S+ 0 0 8 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.884 112.5 43.8 -64.1 -41.0 17.6 38.3 74.0 181 184 A A H X S+ 0 0 0 -4,-1.9 4,-2.1 -5,-0.3 7,-0.4 0.854 114.6 49.6 -76.1 -32.0 14.1 37.6 72.8 182 185 A E H <>S+ 0 0 59 -4,-2.2 5,-2.2 2,-0.2 -2,-0.2 0.825 114.8 44.3 -72.9 -31.7 14.3 40.4 70.2 183 186 A T H ><5S+ 0 0 90 -4,-2.3 3,-0.8 3,-0.2 -2,-0.2 0.935 117.9 43.2 -75.2 -48.3 17.7 39.2 69.0 184 187 A L H 3<5S+ 0 0 17 -4,-2.5 -2,-0.2 1,-0.3 -3,-0.2 0.813 120.8 40.1 -74.1 -31.2 16.7 35.5 68.8 185 188 A T T 3X>S- 0 0 0 -4,-2.1 4,-2.0 -5,-0.2 5,-1.8 0.410 107.7-126.7 -90.2 0.2 13.2 36.1 67.3 186 189 A E T <45S- 0 0 109 -3,-0.8 -3,-0.2 1,-0.2 -4,-0.1 0.925 79.0 -40.3 45.4 50.6 14.7 38.8 65.0 187 190 A H T 4 - 0 0 26 -2,-0.2 3,-1.5 1,-0.1 4,-0.2 -0.908 3.6-161.6-110.2 104.8 18.1 21.8 84.1 199 202 A P G > S+ 0 0 93 0, 0.0 3,-1.7 0, 0.0 -1,-0.1 0.738 81.8 77.0 -62.9 -24.9 20.7 22.1 86.8 200 203 A A G > + 0 0 38 1,-0.3 3,-1.7 2,-0.2 58,-0.4 0.426 65.6 92.1 -66.7 2.6 21.9 18.5 86.3 201 204 A I G X S+ 0 0 58 -3,-1.5 3,-1.8 1,-0.3 -1,-0.3 0.856 74.2 70.2 -63.1 -26.6 23.8 19.7 83.2 202 205 A K G < S+ 0 0 148 -3,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.670 92.9 55.4 -64.8 -14.8 26.6 20.1 85.7 203 206 A D G < S- 0 0 120 -3,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.577 130.8 -69.2 -88.6 -13.2 26.8 16.2 85.8 204 207 A G < - 0 0 8 -3,-1.8 2,-0.9 -4,-0.4 54,-0.7 -0.131 29.7-116.0 129.4 133.7 27.2 16.1 82.1 205 208 A D E -J 257 0C 45 52,-0.1 17,-2.7 -4,-0.1 2,-0.3 -0.869 49.7-144.2 -89.7 105.0 25.3 16.7 78.9 206 209 A K E -JK 256 221C 15 50,-2.5 50,-2.3 -2,-0.9 2,-0.7 -0.560 15.6-152.7 -87.6 137.5 25.3 13.2 77.6 207 210 A R E -JK 255 220C 68 13,-2.7 13,-1.8 -2,-0.3 2,-0.4 -0.905 18.4-173.6-102.4 105.5 25.6 12.1 74.0 208 211 A V E -J 254 0C 0 46,-2.7 46,-2.7 -2,-0.7 2,-0.3 -0.847 11.4-146.7-103.3 138.8 23.9 8.7 73.5 209 212 A L E -J 253 0C 3 -2,-0.4 7,-2.6 9,-0.3 2,-0.4 -0.815 8.5-166.0-106.5 144.9 24.1 6.8 70.2 210 213 A V E -JL 252 215C 0 42,-2.0 42,-2.2 -2,-0.3 2,-0.9 -0.971 5.0-160.2-135.2 110.5 21.3 4.6 68.8 211 214 A V E > S-JL 251 214C 7 3,-2.8 3,-1.4 -2,-0.4 40,-0.2 -0.830 77.2 -30.5 -98.8 98.9 22.2 2.3 65.9 212 215 A D T 3 S- 0 0 20 38,-2.4 -1,-0.2 -2,-0.9 38,-0.2 0.936 128.4 -40.6 54.4 53.7 19.0 1.3 64.2 213 216 A G T 3 S+ 0 0 3 36,-0.4 -1,-0.3 -3,-0.2 28,-0.1 0.229 118.7 109.1 87.1 -12.3 16.8 1.5 67.2 214 217 A E E < -L 211 0C 83 -3,-1.4 -3,-2.8 27,-0.1 -1,-0.2 -0.865 66.4-130.1-103.4 115.1 19.5 -0.1 69.5 215 218 A P E -L 210 0C 7 0, 0.0 -5,-0.2 0, 0.0 19,-0.0 -0.306 18.5-123.3 -58.7 132.5 21.3 2.0 72.1 216 219 A V - 0 0 0 -7,-2.6 -7,-0.3 1,-0.1 65,-0.0 -0.743 26.4-127.8 -71.0 129.1 25.0 1.8 72.1 217 220 A P S S+ 0 0 46 0, 0.0 12,-2.2 0, 0.0 2,-0.4 0.537 88.6 51.9 -65.9 -8.2 25.8 0.7 75.8 218 221 A Y E - M 0 228C 61 10,-0.3 -9,-0.3 -9,-0.1 2,-0.2 -0.989 65.7-177.1-134.9 136.9 28.3 3.5 76.5 219 222 A C E - M 0 227C 0 8,-2.4 8,-2.0 -2,-0.4 2,-0.5 -0.667 26.8-114.0-122.9 176.7 27.8 7.2 75.9 220 223 A L E -KM 207 226C 3 -13,-1.8 -13,-2.7 6,-0.2 2,-0.6 -0.970 19.4-151.8-119.7 121.7 30.0 10.3 76.3 221 224 A A E KM 206 225C 3 4,-2.7 4,-2.6 -2,-0.5 -15,-0.3 -0.812 360.0 360.0 -91.6 117.5 29.1 12.9 78.9 222 225 A R 0 0 124 -17,-2.7 -1,-0.2 -2,-0.6 -16,-0.1 0.881 360.0 360.0 -90.0 360.0 30.3 16.3 77.8 223 ! 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 0.0 224 242 A G 0 0 87 0, 0.0 -2,-0.2 0, 0.0 -20,-0.0 0.000 360.0 360.0 360.0 116.2 34.4 14.6 78.0 225 243 A E E -M 221 0C 114 -4,-2.6 -4,-2.7 2,-0.0 2,-0.2 -0.964 360.0-138.0-134.9 116.9 34.0 11.4 79.9 226 244 A P E +M 220 0C 25 0, 0.0 -6,-0.2 0, 0.0 49,-0.0 -0.543 34.1 166.9 -66.8 136.7 32.8 8.0 78.5 227 245 A R E -M 219 0C 72 -8,-2.0 -8,-2.4 -2,-0.2 3,-0.1 -0.974 39.4-100.8-142.2 154.1 30.4 6.2 80.9 228 246 A P E -M 218 0C 77 0, 0.0 2,-0.3 0, 0.0 -10,-0.3 -0.361 55.9 -87.9 -62.3 157.6 28.0 3.2 80.6 229 247 A L - 0 0 12 -12,-2.2 2,-0.0 4,-0.1 -21,-0.0 -0.565 45.3-133.5 -67.0 133.9 24.3 4.2 80.1 230 248 A T > - 0 0 65 -2,-0.3 4,-2.1 1,-0.1 5,-0.1 -0.204 33.1 -92.3 -71.1 178.0 22.6 4.7 83.4 231 249 A E H > S+ 0 0 174 1,-0.2 4,-1.7 2,-0.2 -1,-0.1 0.883 128.1 49.7 -62.0 -38.8 19.2 3.2 84.1 232 250 A S H > S+ 0 0 47 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.795 106.4 54.9 -73.7 -29.1 17.5 6.4 82.9 233 251 A D H > S+ 0 0 0 2,-0.2 4,-2.6 1,-0.2 5,-0.3 0.960 108.2 49.7 -67.4 -49.7 19.5 6.5 79.7 234 252 A W H X S+ 0 0 99 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.881 111.8 49.9 -49.8 -43.6 18.4 3.0 78.9 235 253 A K H X S+ 0 0 132 -4,-1.7 4,-1.0 2,-0.2 -2,-0.2 0.934 114.3 41.7 -62.3 -55.5 14.8 4.0 79.6 236 254 A I H >X S+ 0 0 4 -4,-2.4 4,-1.7 2,-0.2 3,-0.9 0.952 116.4 48.4 -55.0 -57.0 14.8 7.1 77.3 237 255 A A H 3X S+ 0 0 0 -4,-2.6 4,-1.6 1,-0.3 -2,-0.2 0.830 111.0 49.7 -58.7 -38.8 16.8 5.5 74.4 238 256 A R H 3< S+ 0 0 115 -4,-2.1 -1,-0.3 -5,-0.3 -2,-0.2 0.713 107.4 55.6 -77.1 -16.7 14.6 2.4 74.3 239 257 A Q H << S+ 0 0 68 -4,-1.0 4,-0.3 -3,-0.9 -2,-0.2 0.932 117.3 34.1 -77.8 -39.9 11.4 4.6 74.3 240 258 A I H >X S+ 0 0 0 -4,-1.7 4,-2.0 1,-0.2 3,-1.1 0.753 100.4 83.2 -79.5 -28.2 12.5 6.5 71.1 241 259 A G H 3X S+ 0 0 0 -4,-1.6 4,-2.2 1,-0.3 -1,-0.2 0.819 86.8 49.0 -56.8 -48.5 14.4 3.6 69.4 242 260 A P H 3> S+ 0 0 74 0, 0.0 4,-1.7 0, 0.0 -1,-0.3 0.772 112.1 52.3 -57.7 -26.8 11.5 1.8 67.6 243 261 A T H <> S+ 0 0 38 -3,-1.1 4,-1.1 -4,-0.3 -2,-0.2 0.885 110.5 46.9 -75.4 -41.1 10.4 5.2 66.3 244 262 A L H <>S+ 0 0 0 -4,-2.0 5,-2.4 1,-0.2 3,-0.2 0.888 111.4 51.6 -71.6 -34.1 13.8 5.9 64.9 245 263 A K H ><5S+ 0 0 90 -4,-2.2 3,-1.4 1,-0.2 -2,-0.2 0.939 110.9 46.6 -67.9 -44.6 14.1 2.4 63.4 246 264 A E H 3<5S+ 0 0 159 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.686 109.9 54.0 -73.7 -17.6 10.7 2.7 61.5 247 265 A K T 3<5S- 0 0 62 -4,-1.1 -129,-0.3 -3,-0.2 -1,-0.3 0.359 117.2-111.5 -92.9 2.4 11.5 6.2 60.2 248 266 A G T < 5 + 0 0 6 -3,-1.4 -133,-1.8 1,-0.2 2,-1.3 0.755 69.4 145.7 72.2 23.9 14.8 5.0 58.8 249 267 A L < + 0 0 0 -5,-2.4 -36,-0.4 -6,-0.2 -1,-0.2 -0.773 18.0 168.2 -91.1 85.1 16.8 6.9 61.2 250 268 A I + 0 0 2 -2,-1.3 -38,-2.4 1,-0.2 2,-0.4 0.749 64.2 32.5 -77.4 -29.3 19.6 4.2 61.4 251 269 A F E S+J 211 0C 6 -40,-0.2 2,-0.3 -3,-0.2 -1,-0.2 -0.931 78.8 169.1-135.0 111.5 22.4 6.2 63.2 252 270 A V E -J 210 0C 0 -42,-2.2 -42,-2.0 -2,-0.4 2,-0.5 -0.936 26.2-150.6-127.8 145.6 21.1 8.7 65.8 253 271 A G E -JN 209 265C 4 12,-2.4 12,-2.2 -2,-0.3 2,-0.4 -0.934 13.6-162.6-112.4 133.5 22.6 10.8 68.6 254 272 A L E -JN 208 264C 0 -46,-2.7 -46,-2.7 -2,-0.5 2,-0.5 -0.943 10.1-145.3-113.1 135.7 20.4 11.8 71.5 255 273 A D E -JN 207 263C 13 8,-2.2 7,-2.6 -2,-0.4 8,-1.1 -0.945 22.8-179.2-100.0 122.2 21.3 14.6 73.9 256 274 A I E -JN 206 261C 0 -50,-2.3 -50,-2.5 -2,-0.5 2,-0.6 -0.988 15.1-171.0-126.0 120.7 20.3 13.8 77.5 257 275 A I E > S-JN 205 260C 20 3,-2.4 3,-1.9 -2,-0.4 2,-0.4 -0.977 74.5 -41.3-113.0 115.7 20.8 16.2 80.5 258 276 A G T 3 S- 0 0 22 -54,-0.7 -52,-0.1 -2,-0.6 -2,-0.0 -0.500 124.2 -28.2 67.0-120.0 20.0 14.3 83.6 259 277 A D T 3 S+ 0 0 93 -2,-0.4 2,-0.4 2,-0.1 -1,-0.3 0.136 117.0 98.6-110.4 18.8 16.9 12.3 82.8 260 278 A R E < -N 257 0C 62 -3,-1.9 -3,-2.4 -62,-0.0 2,-0.5 -0.929 68.3-133.4-113.4 136.7 15.5 14.6 80.2 261 279 A L E +N 256 0C 0 -127,-2.6 -5,-0.2 -2,-0.4 3,-0.1 -0.730 29.7 168.9 -80.4 121.5 15.8 14.4 76.4 262 280 A T E + 0 0 7 -7,-2.6 2,-0.3 -2,-0.5 -6,-0.2 0.715 57.1 6.2-108.3 -24.6 16.8 17.8 75.0 263 281 A E E -N 255 0C 45 -8,-1.1 -8,-2.2 -136,-0.1 2,-0.5 -0.999 49.7-146.0-162.5 149.5 17.8 17.1 71.3 264 282 A I E -N 254 0C 1 -140,-2.2 2,-0.6 -2,-0.3 -10,-0.2 -0.880 14.5-155.3-129.5 104.7 17.9 14.5 68.5 265 283 A N E +N 253 0C 32 -12,-2.2 -12,-2.4 -2,-0.5 -142,-0.1 -0.701 26.2 159.6 -83.2 119.6 20.8 14.7 66.1 266 284 A V + 0 0 0 -2,-0.6 -1,-0.2 -14,-0.2 -15,-0.2 0.437 63.8 53.7-115.4 -11.5 19.6 13.0 62.9 267 285 A T S S- 0 0 6 1,-0.1 -180,-0.1 -14,-0.1 -179,-0.1 0.926 123.5 -5.6 -97.3 -65.1 22.1 14.5 60.4 268 286 A S - 0 0 8 -182,-0.1 2,-0.2 -15,-0.0 -1,-0.1 -0.475 69.0-175.1-134.4 69.1 25.7 14.0 61.5 269 287 A P + 0 0 4 0, 0.0 3,-0.1 0, 0.0 2,-0.1 -0.419 13.1 175.8 -65.2 132.3 26.0 12.4 65.0 270 288 A T + 0 0 43 -2,-0.2 -251,-0.1 1,-0.1 -252,-0.0 -0.231 39.8 99.6-115.8-157.0 29.5 12.1 66.3 271 289 A C > + 0 0 0 -253,-0.4 4,-1.3 -2,-0.1 5,-0.2 0.458 50.9 124.9 81.1 14.8 31.4 11.0 69.4 272 290 A I H > S+ 0 0 0 2,-0.2 4,-2.0 1,-0.2 3,-0.3 0.942 70.3 51.4 -62.4 -48.9 32.3 7.5 68.0 273 291 A R H > S+ 0 0 61 -255,-0.3 4,-1.2 1,-0.2 3,-0.2 0.926 107.8 50.7 -59.9 -45.2 36.1 7.9 68.5 274 292 A E H 4 S+ 0 0 47 1,-0.2 4,-0.2 2,-0.2 -1,-0.2 0.802 113.3 44.4 -67.1 -30.9 35.8 8.9 72.2 275 293 A I H >X S+ 0 0 0 -4,-1.3 4,-1.9 -3,-0.3 3,-0.7 0.826 111.9 52.7 -81.9 -29.7 33.6 6.0 73.2 276 294 A E H 3< S+ 0 0 54 -4,-2.0 5,-0.2 1,-0.2 -2,-0.2 0.692 101.5 61.5 -77.4 -21.4 35.7 3.3 71.2 277 295 A A T 3< S+ 0 0 77 -4,-1.2 -1,-0.2 -5,-0.2 -2,-0.2 0.570 116.2 28.6 -73.8 -19.0 38.9 4.4 72.8 278 296 A E T <4 S+ 0 0 125 -3,-0.7 -2,-0.2 -4,-0.2 -3,-0.1 0.654 117.4 48.4-114.3 -38.9 37.6 3.5 76.3 279 297 A F S < S- 0 0 51 -4,-1.9 2,-1.6 2,-0.1 -1,-0.1 -0.745 81.5-112.8-112.5 159.2 35.2 0.7 75.9 280 298 A P S S+ 0 0 114 0, 0.0 2,-0.3 0, 0.0 -4,-0.1 -0.626 76.1 114.2 -88.1 74.3 35.2 -2.6 74.0 281 299 A V - 0 0 26 -2,-1.6 2,-0.6 -5,-0.2 3,-0.1 -0.983 54.9-151.7-139.9 140.8 32.5 -1.6 71.5 282 300 A S > + 0 0 58 -2,-0.3 4,-2.0 1,-0.2 5,-0.1 -0.927 16.8 177.5-112.7 96.9 32.8 -1.1 67.8 283 301 A I H > S+ 0 0 0 -2,-0.6 4,-2.2 2,-0.2 -1,-0.2 0.925 82.8 50.7 -65.5 -42.2 30.1 1.4 67.1 284 302 A T H > S+ 0 0 5 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.825 109.0 52.6 -66.1 -28.4 31.1 1.6 63.4 285 303 A G H > S+ 0 0 5 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.912 107.5 50.8 -70.5 -40.8 30.9 -2.2 63.3 286 304 A M H X S+ 0 0 53 -4,-2.0 4,-1.8 1,-0.2 -2,-0.2 0.919 112.4 48.5 -59.7 -40.2 27.5 -2.0 64.8 287 305 A L H X S+ 0 0 1 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.933 111.5 45.5 -66.1 -52.3 26.6 0.5 62.0 288 306 A M H X S+ 0 0 0 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.830 111.9 54.9 -65.0 -29.5 27.9 -1.5 59.1 289 307 A D H X S+ 0 0 88 -4,-2.1 4,-1.8 2,-0.2 -1,-0.2 0.886 108.6 47.7 -67.5 -39.0 26.3 -4.5 60.5 290 308 A A H X S+ 0 0 13 -4,-1.8 4,-2.6 2,-0.2 -2,-0.2 0.929 111.9 49.7 -68.2 -41.7 23.0 -2.7 60.5 291 309 A I H X S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.927 110.2 51.1 -62.1 -44.7 23.5 -1.5 56.9 292 310 A E H X S+ 0 0 56 -4,-2.5 4,-1.4 2,-0.2 -1,-0.2 0.854 110.7 48.3 -60.6 -39.6 24.3 -5.1 55.8 293 311 A A H >< S+ 0 0 53 -4,-1.8 3,-0.9 2,-0.2 -2,-0.2 0.991 111.7 49.3 -64.1 -55.4 21.1 -6.3 57.5 294 312 A R H 3X S+ 0 0 50 -4,-2.6 4,-1.4 1,-0.3 3,-0.4 0.818 111.8 50.5 -50.6 -36.0 19.0 -3.6 55.8 295 313 A L H 3< S+ 0 0 43 -4,-2.2 2,-1.1 1,-0.3 -1,-0.3 0.831 107.3 50.6 -74.5 -35.9 20.6 -4.4 52.4 296 314 A Q T << S+ 0 0 152 -4,-1.4 -1,-0.3 -3,-0.9 -2,-0.1 -0.592 113.0 51.3-101.2 65.7 20.0 -8.2 52.5 297 315 A Q T 4 0 0 115 -2,-1.1 -2,-0.2 1,-0.6 -3,-0.1 0.087 360.0 360.0-158.3 -70.3 16.4 -7.5 53.4 298 316 A Q < 0 0 189 -4,-1.4 -1,-0.6 -189,-0.0 0, 0.0 -0.712 360.0 360.0 -99.2 360.0 14.7 -5.1 51.0