==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 11-MAR-10 3M4J . COMPND 2 MOLECULE: N-ACETYLORNITHINE CARBAMOYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: XANTHOMONAS CAMPESTRIS PV. CAMPESTRIS; . AUTHOR Y.LI,X.YU,N.M.ALLEWELL,M.TUCHMAN,D.SHI . 332 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14207.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 233 70.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 51 15.4 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 . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.6 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 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 34 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 108 32.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.2 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 0 0 1 0 1 2 0 1 1 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 5 1 2 0 5 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 . 1 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 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 3 A L 0 0 135 0, 0.0 2,-0.5 0, 0.0 135,-0.1 0.000 360.0 360.0 360.0 133.5 81.2 49.4 79.2 2 4 A K + 0 0 93 329,-0.1 2,-0.2 2,-0.0 0, 0.0 -0.789 360.0 175.7 -95.3 125.0 84.4 51.2 80.2 3 5 A H - 0 0 33 -2,-0.5 2,-0.5 134,-0.2 136,-0.2 -0.667 33.1-127.9-116.5 172.2 87.6 49.2 80.5 4 6 A F B +a 139 0A 0 134,-2.7 136,-2.5 -2,-0.2 3,-0.1 -0.754 56.0 133.6-123.2 81.0 91.2 50.2 81.3 5 7 A L S S- 0 0 28 -2,-0.5 2,-0.3 1,-0.4 -1,-0.1 0.783 76.5 -3.4 -96.9 -36.0 93.1 48.7 78.4 6 8 A N > - 0 0 15 -3,-0.2 3,-1.2 140,-0.1 -1,-0.4 -0.976 57.0-129.9-157.0 145.4 95.3 51.6 77.5 7 9 A T G > S+ 0 0 0 -2,-0.3 3,-1.7 1,-0.3 8,-0.1 0.818 106.5 71.5 -67.4 -27.7 95.7 55.2 78.7 8 10 A Q G 3 S+ 0 0 35 1,-0.3 -1,-0.3 -3,-0.1 0, 0.0 0.760 93.1 56.0 -58.7 -25.4 95.5 56.2 75.0 9 11 A D G < S+ 0 0 94 -3,-1.2 -1,-0.3 2,-0.1 2,-0.3 0.666 98.9 77.3 -80.0 -19.2 91.8 55.3 75.1 10 12 A W S < S- 0 0 16 -3,-1.7 2,-0.1 -4,-0.4 -6,-0.0 -0.667 83.5-117.9 -95.4 149.5 91.2 57.7 78.0 11 13 A S > - 0 0 52 -2,-0.3 4,-2.4 1,-0.1 5,-0.2 -0.346 29.1-110.9 -77.0 164.2 90.8 61.4 77.8 12 14 A R H > S+ 0 0 79 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.883 119.0 54.0 -63.4 -39.7 93.3 63.7 79.6 13 15 A A H > S+ 0 0 72 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.871 110.4 47.2 -63.6 -36.5 90.7 64.8 82.1 14 16 A E H > S+ 0 0 74 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.930 112.9 48.2 -70.2 -45.0 89.9 61.2 83.0 15 17 A L H X S+ 0 0 2 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.911 112.3 49.3 -60.5 -43.7 93.6 60.3 83.3 16 18 A D H X S+ 0 0 61 -4,-2.9 4,-2.0 1,-0.2 -1,-0.2 0.857 108.7 52.4 -64.0 -38.6 94.2 63.3 85.5 17 19 A A H X S+ 0 0 61 -4,-1.7 4,-2.2 -5,-0.2 -1,-0.2 0.877 109.6 51.2 -65.5 -36.3 91.3 62.4 87.7 18 20 A L H X S+ 0 0 8 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.928 110.3 47.0 -65.2 -46.5 92.8 58.9 88.0 19 21 A L H X S+ 0 0 5 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.830 113.3 49.4 -66.1 -32.9 96.2 60.3 89.1 20 22 A T H X S+ 0 0 98 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.890 110.4 49.0 -73.4 -40.2 94.6 62.6 91.6 21 23 A Q H X S+ 0 0 59 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.889 110.7 53.5 -65.2 -34.6 92.5 59.8 93.0 22 24 A A H X S+ 0 0 0 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.933 107.7 48.5 -63.1 -46.6 95.7 57.8 93.2 23 25 A A H X S+ 0 0 39 -4,-2.1 4,-0.6 1,-0.2 -1,-0.2 0.851 111.9 51.1 -61.7 -35.1 97.4 60.6 95.2 24 26 A L H >X S+ 0 0 77 -4,-2.0 4,-1.8 1,-0.2 3,-1.0 0.898 107.6 50.8 -69.2 -43.7 94.4 60.7 97.5 25 27 A F H 3< S+ 0 0 5 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.832 103.0 61.5 -63.9 -30.1 94.5 57.0 98.1 26 28 A K H 3< S+ 0 0 62 -4,-1.8 3,-0.3 1,-0.2 -1,-0.3 0.756 108.9 42.6 -66.9 -24.2 98.2 57.3 99.0 27 29 A R H << S+ 0 0 213 -3,-1.0 2,-0.4 -4,-0.6 -2,-0.2 0.780 129.0 26.8 -89.9 -32.7 97.2 59.6 101.8 28 30 A N S < S+ 0 0 102 -4,-1.8 -1,-0.3 1,-0.1 -2,-0.1 -0.812 71.0 175.0-132.1 87.8 94.2 57.5 103.0 29 31 A K + 0 0 111 -2,-0.4 2,-0.4 -3,-0.3 -1,-0.1 0.805 58.1 72.2 -68.6 -33.1 94.9 53.9 102.0 30 32 A L + 0 0 131 31,-0.1 2,-0.3 2,-0.0 31,-0.2 -0.715 62.4 139.2 -89.6 133.4 91.9 52.2 103.7 31 33 A G - 0 0 28 29,-2.3 3,-0.1 -2,-0.4 -2,-0.0 -0.888 54.8-120.3-154.8-175.3 88.5 52.7 102.1 32 34 A S > + 0 0 84 -2,-0.3 3,-1.8 1,-0.1 29,-0.1 0.170 69.3 116.2-122.6 17.0 85.2 51.1 101.1 33 35 A E T 3 S+ 0 0 81 1,-0.3 29,-0.1 30,-0.0 -1,-0.1 0.739 91.3 30.9 -58.6 -24.8 85.2 51.7 97.4 34 36 A L T > S+ 0 0 5 27,-2.1 3,-2.6 -3,-0.1 -1,-0.3 0.045 82.8 157.4-121.8 26.4 85.3 47.9 96.8 35 37 A K T < S- 0 0 157 -3,-1.8 28,-0.2 1,-0.3 27,-0.1 -0.294 79.4 -2.9 -57.1 125.6 83.4 46.7 99.9 36 38 A G T 3 S+ 0 0 74 26,-1.9 -1,-0.3 1,-0.2 2,-0.2 0.549 111.8 117.8 70.0 5.6 82.0 43.3 99.2 37 39 A K < - 0 0 92 -3,-2.6 27,-1.7 25,-0.2 2,-0.3 -0.604 46.6-158.2-100.8 166.0 83.4 43.4 95.6 38 40 A S E -b 64 0A 28 25,-0.2 67,-2.2 -2,-0.2 68,-1.0 -0.966 8.9-153.3-144.5 157.8 86.0 41.2 94.0 39 41 A I E -bc 65 106A 2 25,-2.1 27,-2.7 -2,-0.3 2,-0.7 -0.993 14.0-139.9-133.1 139.1 88.5 41.1 91.2 40 42 A A E -bc 66 107A 1 66,-2.6 68,-2.5 -2,-0.4 2,-0.9 -0.898 13.9-158.8-101.0 113.7 89.8 38.1 89.3 41 43 A L E -bc 67 108A 0 25,-2.2 27,-2.8 -2,-0.7 2,-0.8 -0.821 9.8-166.5 -94.6 100.8 93.6 38.6 88.6 42 44 A V E -bc 68 109A 3 66,-2.9 68,-2.4 -2,-0.9 2,-0.6 -0.795 4.4-171.0 -94.7 110.3 94.3 36.3 85.7 43 45 A F E + c 0 110A 9 25,-3.0 68,-0.2 -2,-0.8 4,-0.1 -0.881 23.3 170.3-106.1 121.1 98.0 35.8 85.2 44 46 A F S S+ 0 0 61 66,-2.6 67,-0.2 -2,-0.6 -1,-0.1 0.463 78.7 35.2 -99.6 -4.9 99.4 34.0 82.1 45 47 A N S S- 0 0 44 65,-0.3 65,-0.1 1,-0.1 -1,-0.0 -0.938 100.4 -75.8-141.5 162.3 102.9 35.1 83.1 46 48 A P + 0 0 107 0, 0.0 2,-0.3 0, 0.0 -2,-0.1 -0.029 48.2 170.5 -56.8 161.4 104.9 35.6 86.3 47 49 A S + 0 0 38 -4,-0.1 -4,-0.0 1,-0.1 63,-0.0 -0.910 24.9 167.8-172.4 144.0 104.5 38.6 88.6 48 50 A M S > S+ 0 0 109 -2,-0.3 4,-1.9 3,-0.1 5,-0.2 0.615 88.3 34.4-123.4 -57.0 105.5 39.9 92.1 49 51 A R H > S+ 0 0 60 2,-0.2 4,-3.5 3,-0.2 5,-0.3 0.945 120.0 48.5 -68.0 -50.2 104.6 43.6 92.2 50 52 A T H > S+ 0 0 3 2,-0.2 4,-2.3 1,-0.2 5,-0.3 0.936 115.7 42.8 -57.4 -51.7 101.4 43.4 90.1 51 53 A R H > S+ 0 0 92 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.945 119.4 44.0 -61.5 -47.7 100.0 40.4 91.9 52 54 A T H X S+ 0 0 62 -4,-1.9 4,-2.6 2,-0.2 5,-0.3 0.938 115.1 46.7 -64.5 -48.5 100.9 41.8 95.3 53 55 A S H X S+ 0 0 12 -4,-3.5 4,-2.2 2,-0.2 -1,-0.2 0.902 115.9 44.5 -63.2 -43.6 99.8 45.4 94.7 54 56 A F H X S+ 0 0 0 -4,-2.3 4,-2.5 -5,-0.3 5,-0.2 0.949 114.1 50.0 -65.9 -46.9 96.4 44.5 93.2 55 57 A E H X S+ 0 0 76 -4,-2.3 4,-1.9 -5,-0.3 10,-0.3 0.936 115.9 41.6 -57.0 -49.0 95.7 41.9 95.9 56 58 A L H X S+ 0 0 73 -4,-2.6 4,-3.2 1,-0.2 -1,-0.2 0.848 112.0 55.9 -66.3 -36.6 96.5 44.4 98.7 57 59 A G H X S+ 0 0 0 -4,-2.2 4,-1.2 -5,-0.3 6,-0.2 0.896 107.7 47.9 -63.2 -41.3 94.6 47.1 96.9 58 60 A A H <>S+ 0 0 0 -4,-2.5 5,-3.1 2,-0.2 -1,-0.2 0.909 114.5 48.0 -64.7 -42.3 91.5 45.0 96.7 59 61 A F H ><5S+ 0 0 139 -4,-1.9 3,-1.8 -5,-0.2 -2,-0.2 0.926 108.1 52.4 -64.7 -46.7 91.9 44.2 100.4 60 62 A Q H 3<5S+ 0 0 17 -4,-3.2 -29,-2.3 1,-0.3 -1,-0.2 0.764 109.7 50.8 -62.9 -24.2 92.5 47.8 101.5 61 63 A L T 3<5S- 0 0 0 -4,-1.2 -27,-2.1 -31,-0.2 -1,-0.3 0.129 124.6-100.1 -99.9 19.4 89.3 48.9 99.8 62 64 A G T < 5S+ 0 0 37 -3,-1.8 -26,-1.9 1,-0.2 -3,-0.2 0.560 89.0 107.6 76.9 8.1 87.2 46.2 101.4 63 65 A G < - 0 0 12 -5,-3.1 2,-0.4 -28,-0.2 -25,-0.2 -0.331 61.4-122.5-106.2-169.1 87.2 43.9 98.4 64 66 A H E -b 38 0A 122 -27,-1.7 -25,-2.1 -30,-0.2 2,-0.4 -0.992 9.6-151.4-142.4 131.5 88.8 40.5 97.5 65 67 A A E -b 39 0A 10 -2,-0.4 2,-0.6 -10,-0.3 -25,-0.2 -0.845 6.2-155.6-102.4 136.6 91.1 39.5 94.7 66 68 A V E -b 40 0A 59 -27,-2.7 -25,-2.2 -2,-0.4 2,-0.5 -0.958 14.9-146.3-109.8 116.0 91.1 35.9 93.4 67 69 A V E -b 41 0A 28 -2,-0.6 2,-0.3 -27,-0.2 -25,-0.2 -0.748 20.4-177.8 -89.7 124.1 94.5 35.0 91.8 68 70 A L E -b 42 0A 44 -27,-2.8 -25,-3.0 -2,-0.5 -2,-0.0 -0.909 17.0-170.2-121.8 147.0 94.3 32.6 88.8 69 71 A Q >>> - 0 0 72 -2,-0.3 3,-2.6 -27,-0.2 4,-1.9 -0.724 20.4-143.4-137.2 85.4 97.0 31.1 86.6 70 72 A P B 345S+e 74 0B 14 0, 0.0 5,-0.2 0, 0.0 -2,-0.0 -0.139 89.8 22.1 -49.0 139.4 95.7 29.3 83.5 71 73 A G T 345S+ 0 0 53 3,-1.8 4,-0.1 1,-0.1 -27,-0.0 0.280 127.8 55.4 84.2 -12.5 97.7 26.2 82.7 72 74 A K T <45S- 0 0 167 -3,-2.6 -1,-0.1 2,-0.2 3,-0.1 0.733 134.8 -16.4-112.7 -67.2 98.9 26.2 86.3 73 75 A D T <5S+ 0 0 94 -4,-1.9 2,-0.2 2,-0.1 -5,-0.0 0.693 131.1 52.8-111.9 -34.1 95.9 26.1 88.7 74 76 A A B > -f 78 0C 23 -2,-0.3 4,-2.0 -15,-0.2 3,-1.5 -0.695 23.3-122.0 -98.4 146.6 87.2 29.0 75.2 93 95 A I H 3> S+ 0 0 0 -15,-2.5 4,-2.7 -2,-0.3 5,-0.4 0.785 110.0 68.1 -53.4 -30.1 87.6 32.6 76.4 94 96 A A H 3> S+ 0 0 10 1,-0.2 4,-1.0 2,-0.2 -1,-0.3 0.900 108.7 36.4 -58.2 -40.0 83.9 33.1 75.5 95 97 A E H <> S+ 0 0 98 -3,-1.5 4,-2.9 2,-0.2 5,-0.2 0.923 116.0 53.4 -77.8 -47.3 82.9 30.8 78.4 96 98 A V H X S+ 0 0 14 -4,-2.0 4,-2.6 1,-0.2 5,-0.2 0.912 111.5 44.0 -54.7 -49.7 85.7 31.9 80.8 97 99 A A H X S+ 0 0 0 -4,-2.7 4,-1.8 1,-0.2 -1,-0.2 0.863 115.2 49.1 -66.9 -36.2 84.9 35.6 80.6 98 100 A R H < S+ 0 0 133 -4,-1.0 4,-0.3 -5,-0.4 -2,-0.2 0.898 113.4 46.3 -70.3 -40.4 81.2 35.0 80.9 99 101 A V H >X S+ 0 0 66 -4,-2.9 3,-2.6 2,-0.2 4,-0.7 0.972 113.3 47.9 -65.2 -54.0 81.6 32.7 83.9 100 102 A L H >X S+ 0 0 18 -4,-2.6 4,-2.7 1,-0.3 3,-1.5 0.870 104.5 62.7 -52.8 -38.7 84.0 35.1 85.7 101 103 A G H 3< S+ 0 0 13 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.635 100.4 52.7 -63.0 -14.7 81.6 37.9 84.9 102 104 A R H <4 S+ 0 0 214 -3,-2.6 -1,-0.3 -4,-0.3 -2,-0.2 0.601 119.0 34.9 -93.2 -15.4 79.0 36.0 87.1 103 105 A Y H << S+ 0 0 171 -3,-1.5 -2,-0.2 -4,-0.7 2,-0.2 0.858 115.1 40.0-102.0 -56.4 81.5 35.8 90.0 104 106 A V < - 0 0 9 -4,-2.7 -65,-0.2 1,-0.1 -1,-0.1 -0.510 58.3-142.2-100.6 166.8 83.6 39.0 90.1 105 107 A D S S+ 0 0 53 -67,-2.2 2,-0.3 1,-0.2 -66,-0.2 0.561 88.6 28.5 -99.5 -13.3 83.1 42.7 89.5 106 108 A L E -c 39 0A 2 -68,-1.0 -66,-2.6 30,-0.1 2,-0.5 -0.997 63.3-152.8-149.7 146.5 86.4 43.2 87.8 107 109 A I E -cd 40 138A 0 30,-2.4 32,-2.7 -2,-0.3 2,-0.4 -0.944 7.7-169.2-128.8 115.6 88.8 41.3 85.7 108 110 A G E -cd 41 139A 0 -68,-2.5 -66,-2.9 -2,-0.5 2,-0.4 -0.774 10.8-165.8 -98.0 141.5 92.5 41.9 85.5 109 111 A V E -cd 42 140A 0 30,-2.7 32,-3.4 -2,-0.4 2,-0.5 -0.990 14.8-175.4-136.7 136.3 94.6 40.2 82.8 110 112 A R E +c 43 0A 22 -68,-2.4 -66,-2.6 -2,-0.4 -65,-0.3 -0.992 19.2 152.8-125.5 120.1 98.3 39.7 82.3 111 113 A A - 0 0 10 31,-1.6 16,-0.2 -2,-0.5 15,-0.1 -0.781 25.7-154.4-154.2 104.7 99.5 38.0 79.1 112 114 A F - 0 0 52 -2,-0.3 32,-0.1 1,-0.1 31,-0.1 -0.291 37.2 -89.0 -73.4 160.0 102.9 38.6 77.5 113 115 A P - 0 0 9 0, 0.0 -1,-0.1 0, 0.0 5,-0.1 -0.296 30.3-124.9 -65.7 158.7 103.4 38.1 73.8 114 116 A K - 0 0 169 3,-0.2 4,-0.1 -3,-0.1 -2,-0.1 0.665 33.4-133.7 -77.7 -17.5 104.5 34.5 72.8 115 117 A F S S+ 0 0 49 2,-0.1 144,-1.2 1,-0.0 3,-0.1 0.691 81.7 94.9 71.4 23.6 107.6 35.9 71.0 116 118 A V S S+ 0 0 104 1,-0.2 2,-0.3 142,-0.2 3,-0.1 0.711 94.0 13.6-110.4 -33.0 107.1 33.8 67.8 117 119 A D >> - 0 0 69 1,-0.1 4,-2.7 142,-0.1 3,-1.3 -0.812 53.4-166.3-150.8 103.4 105.2 36.2 65.5 118 120 A W H 3> S+ 0 0 23 -2,-0.3 4,-3.1 1,-0.3 5,-0.2 0.811 91.0 67.8 -57.9 -30.6 104.9 39.9 66.3 119 121 A S H 34 S+ 0 0 83 1,-0.2 -1,-0.3 2,-0.2 4,-0.1 0.875 111.5 32.5 -57.8 -36.9 102.1 40.0 63.7 120 122 A K H X4 S+ 0 0 143 -3,-1.3 3,-1.4 2,-0.1 5,-0.5 0.885 118.1 52.6 -87.9 -42.2 100.0 37.9 66.0 121 123 A D H >< S+ 0 0 19 -4,-2.7 3,-1.9 1,-0.3 -2,-0.2 0.892 102.4 60.0 -60.7 -40.1 101.3 39.3 69.3 122 124 A R T 3< S+ 0 0 70 -4,-3.1 -1,-0.3 1,-0.3 -2,-0.1 0.580 88.6 74.5 -66.9 -7.0 100.7 42.9 68.3 123 125 A E T < S- 0 0 97 -3,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.641 92.6-141.3 -81.1 -12.6 97.0 42.1 67.9 124 126 A D <> + 0 0 12 -3,-1.9 4,-2.3 -4,-0.2 5,-0.2 0.905 35.9 168.2 54.8 45.3 96.6 42.0 71.7 125 127 A Q H > + 0 0 74 -5,-0.5 4,-2.6 2,-0.2 5,-0.2 0.881 65.5 50.3 -58.5 -46.5 94.2 39.0 71.3 126 128 A V H > S+ 0 0 32 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.977 114.6 42.7 -58.6 -57.4 94.0 37.9 75.0 127 129 A L H > S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.922 116.8 47.3 -54.9 -50.2 93.2 41.4 76.3 128 130 A K H X S+ 0 0 95 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.881 110.2 53.3 -60.6 -40.6 90.7 42.2 73.5 129 131 A S H X S+ 0 0 12 -4,-2.6 4,-2.6 -5,-0.2 5,-0.3 0.949 110.1 47.0 -61.3 -48.3 89.0 38.8 73.9 130 132 A F H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.929 113.9 48.1 -58.2 -45.8 88.5 39.4 77.7 131 133 A A H < S+ 0 0 18 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.832 112.7 50.5 -65.0 -31.1 87.2 42.9 77.0 132 134 A K H < S+ 0 0 130 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.961 121.7 27.4 -71.6 -52.8 84.9 41.6 74.3 133 135 A Y H < S+ 0 0 35 -4,-2.6 -2,-0.2 -5,-0.1 -3,-0.2 0.676 96.3 99.9 -86.7 -20.2 83.2 38.8 76.2 134 136 A S < - 0 0 7 -4,-2.4 -36,-0.2 -5,-0.3 4,-0.1 -0.506 55.6-157.4 -73.8 130.1 83.4 40.0 79.8 135 137 A P S S+ 0 0 76 0, 0.0 -1,-0.1 0, 0.0 -37,-0.1 0.552 79.6 59.4 -81.3 -5.2 80.2 41.6 81.2 136 138 A V S S- 0 0 21 -39,-0.2 -30,-0.1 1,-0.1 -2,-0.1 -0.874 104.1 -73.8-121.8 155.8 82.4 43.5 83.8 137 139 A P - 0 0 12 0, 0.0 -30,-2.4 0, 0.0 2,-0.4 -0.091 44.3-143.8 -49.3 137.4 85.3 46.0 83.3 138 140 A V E - d 0 107A 0 -32,-0.2 -134,-2.7 -4,-0.1 2,-0.4 -0.853 8.4-157.3-108.1 140.9 88.6 44.6 82.2 139 141 A I E -ad 4 108A 0 -32,-2.7 -30,-2.7 -2,-0.4 2,-0.6 -0.979 17.1-129.6-123.7 128.3 92.0 45.9 83.4 140 142 A N E + d 0 109A 0 -136,-2.5 8,-0.5 -2,-0.4 -30,-0.2 -0.634 22.2 179.8 -75.7 113.2 95.3 45.5 81.5 141 143 A M S S- 0 0 0 -32,-3.4 -31,-0.2 -2,-0.6 -1,-0.1 0.102 72.9 -56.1-100.9 21.0 97.9 44.1 83.9 142 144 A E S S+ 0 0 17 -33,-0.3 -31,-1.6 -137,-0.1 4,-0.2 0.570 73.2 147.2 103.4 113.0 100.4 44.2 81.0 143 145 A T S S- 0 0 2 2,-2.1 42,-0.3 -33,-0.2 3,-0.1 0.372 89.7 -27.3-126.8 -89.3 100.1 42.6 77.6 144 146 A I S S+ 0 0 4 -32,-0.1 2,-0.3 41,-0.1 44,-0.2 0.409 141.4 35.5-111.8 -3.8 101.8 44.6 74.8 145 147 A T - 0 0 0 -140,-0.1 -2,-2.1 43,-0.1 41,-0.2 -0.879 69.9-149.5-136.2 166.3 101.3 47.8 76.7 146 148 A H >> + 0 0 3 39,-0.6 4,-1.7 -2,-0.3 3,-0.7 -0.576 22.7 167.5-141.5 70.6 101.4 48.4 80.5 147 149 A P H 3> S+ 0 0 0 0, 0.0 4,-1.7 0, 0.0 5,-0.1 0.753 77.1 59.0 -58.3 -30.1 99.0 51.3 81.3 148 150 A C H 3> S+ 0 0 0 -8,-0.5 4,-1.5 1,-0.2 5,-0.1 0.867 107.1 48.2 -67.5 -35.6 99.1 50.6 85.0 149 151 A Q H <> S+ 0 0 4 -3,-0.7 4,-2.9 2,-0.2 5,-0.2 0.881 105.2 59.1 -70.8 -39.2 102.9 51.2 84.9 150 152 A E H X S+ 0 0 3 -4,-1.7 4,-3.2 1,-0.2 -2,-0.2 0.936 109.2 43.4 -54.0 -49.8 102.4 54.4 82.9 151 153 A L H X S+ 0 0 1 -4,-1.7 4,-2.4 2,-0.2 -1,-0.2 0.835 113.5 49.6 -67.7 -34.6 100.3 56.0 85.7 152 154 A A H X S+ 0 0 0 -4,-1.5 4,-2.0 2,-0.2 -1,-0.2 0.907 115.6 45.8 -69.2 -39.9 102.6 54.8 88.5 153 155 A H H X S+ 0 0 1 -4,-2.9 4,-1.7 2,-0.2 -2,-0.2 0.934 113.5 48.6 -65.6 -49.4 105.5 56.2 86.5 154 156 A A H X S+ 0 0 1 -4,-3.2 4,-2.5 -5,-0.2 -2,-0.2 0.917 111.5 48.7 -58.5 -48.7 103.7 59.5 85.8 155 157 A L H X S+ 0 0 6 -4,-2.4 4,-2.6 1,-0.2 5,-0.2 0.920 109.6 52.6 -59.5 -44.9 102.6 60.0 89.4 156 158 A A H X S+ 0 0 4 -4,-2.0 4,-1.8 1,-0.2 -1,-0.2 0.830 110.2 49.1 -60.8 -33.3 106.1 59.3 90.6 157 159 A L H X S+ 0 0 2 -4,-1.7 4,-2.4 2,-0.2 -1,-0.2 0.917 110.6 49.0 -72.4 -43.6 107.4 62.0 88.1 158 160 A Q H X>S+ 0 0 25 -4,-2.5 5,-2.1 1,-0.2 4,-0.6 0.894 112.5 48.7 -62.2 -40.2 104.8 64.5 89.2 159 161 A E H <5S+ 0 0 80 -4,-2.6 3,-0.5 3,-0.2 -1,-0.2 0.899 110.3 52.1 -66.4 -40.2 105.7 63.9 92.9 160 162 A H H <5S+ 0 0 81 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.939 116.6 37.4 -62.3 -47.1 109.4 64.2 92.1 161 163 A F H <5S- 0 0 53 -4,-2.4 -1,-0.2 2,-0.2 -2,-0.2 0.450 108.4-124.0 -85.6 1.5 109.1 67.6 90.4 162 164 A G T <5S+ 0 0 68 -4,-0.6 -3,-0.2 -3,-0.5 -4,-0.1 0.846 78.5 80.9 61.1 36.2 106.4 68.8 92.8 163 165 A T S + 0 0 1 -2,-0.9 3,-1.5 31,-0.3 -1,-0.1 0.279 29.3 135.1-100.2 9.3 105.7 67.9 83.3 167 169 A R T 3 + 0 0 150 1,-0.2 32,-0.2 32,-0.1 31,-0.1 -0.290 68.4 24.6 -59.1 140.2 105.6 69.9 80.0 168 170 A G T 3 S+ 0 0 44 30,-1.2 -1,-0.2 1,-0.3 31,-0.1 -0.009 88.6 128.9 95.4 -31.7 109.0 71.1 78.9 169 171 A K < - 0 0 60 -3,-1.5 31,-2.8 1,-0.1 2,-0.7 -0.266 62.9-121.8 -59.2 143.2 110.9 68.3 80.7 170 172 A K E -g 200 0D 96 73,-0.3 75,-2.4 29,-0.2 76,-1.9 -0.812 31.6-166.8 -91.1 119.1 113.4 66.4 78.7 171 173 A Y E -gh 201 246D 1 29,-3.0 31,-2.6 -2,-0.7 2,-0.6 -0.929 7.5-165.6-113.8 123.6 112.5 62.7 78.8 172 174 A V E -gh 202 247D 3 74,-3.0 76,-2.9 -2,-0.5 2,-0.8 -0.917 4.7-169.8-113.2 113.4 114.8 59.9 77.7 173 175 A L E -gh 203 248D 0 29,-2.0 31,-2.1 -2,-0.6 2,-0.4 -0.891 22.8-172.8 -98.3 107.1 113.4 56.5 77.1 174 176 A T E -gh 204 249D 0 74,-2.0 76,-2.0 -2,-0.8 31,-0.2 -0.864 23.4-131.3-112.0 140.0 116.5 54.3 76.6 175 177 A W E - h 0 250D 0 29,-2.4 2,-0.3 -2,-0.4 76,-0.3 -0.443 30.1-168.6 -74.5 153.5 117.0 50.7 75.6 176 178 A T - 0 0 0 74,-0.7 76,-0.3 -2,-0.1 124,-0.1 -0.944 24.5 -84.7-141.6 164.1 119.4 48.7 77.9 177 179 A Y + 0 0 24 122,-0.5 74,-0.1 -2,-0.3 122,-0.1 -0.264 41.9 162.0 -73.8 157.0 121.0 45.3 77.7 178 180 A H - 0 0 15 74,-0.1 4,-0.1 122,-0.1 74,-0.1 -0.849 44.5-121.3-169.7 134.0 119.6 42.0 78.8 179 181 A P S S+ 0 0 49 0, 0.0 90,-0.1 0, 0.0 89,-0.1 0.766 97.7 42.4 -52.7 -28.2 120.8 38.4 77.8 180 182 A K S S- 0 0 122 88,-0.1 2,-0.4 -3,-0.0 0, 0.0 -0.826 93.9 -99.7-121.9 159.7 117.4 37.6 76.3 181 183 A P - 0 0 22 0, 0.0 2,-0.2 0, 0.0 71,-0.1 -0.638 46.6-161.1 -78.4 130.1 114.9 39.5 74.1 182 184 A L - 0 0 36 -2,-0.4 71,-2.1 1,-0.1 2,-0.0 -0.595 24.6 -79.9-112.0 171.4 112.0 41.1 76.1 183 185 A N - 0 0 10 -2,-0.2 3,-0.3 69,-0.2 4,-0.2 -0.347 27.3-146.1 -64.6 143.9 108.5 42.4 75.7 184 186 A T S > S+ 0 0 1 1,-0.2 4,-3.2 2,-0.1 3,-0.5 0.513 71.2 108.0 -88.9 -7.9 108.3 46.0 74.4 185 187 A A H > S+ 0 0 0 -42,-0.3 4,-2.5 1,-0.3 -39,-0.6 0.828 79.0 42.7 -35.5 -59.1 105.2 46.7 76.5 186 188 A V H > S+ 0 0 3 -3,-0.3 4,-2.6 2,-0.2 -1,-0.3 0.894 115.7 49.9 -62.3 -39.7 106.8 49.0 79.1 187 189 A A H > S+ 0 0 0 -3,-0.5 4,-2.3 -4,-0.2 -2,-0.2 0.930 111.2 49.1 -63.9 -44.9 108.8 50.8 76.4 188 190 A N H X S+ 0 0 0 -4,-3.2 4,-1.9 1,-0.2 -2,-0.2 0.899 113.9 46.6 -61.2 -40.7 105.6 51.3 74.3 189 191 A S H X S+ 0 0 2 -4,-2.5 4,-3.0 -5,-0.3 5,-0.3 0.874 109.7 52.8 -69.7 -38.4 103.8 52.6 77.4 190 192 A A H X S+ 0 0 3 -4,-2.6 4,-2.9 2,-0.2 5,-0.3 0.946 110.5 47.6 -62.4 -47.1 106.6 54.9 78.5 191 193 A L H X S+ 0 0 0 -4,-2.3 4,-1.6 1,-0.2 5,-0.2 0.908 114.0 49.2 -59.3 -44.0 106.6 56.5 75.0 192 194 A T H X S+ 0 0 0 -4,-1.9 4,-1.8 -5,-0.2 -2,-0.2 0.944 116.8 37.8 -62.2 -51.9 102.8 56.8 75.1 193 195 A I H X S+ 0 0 4 -4,-3.0 4,-1.5 2,-0.2 -2,-0.2 0.868 112.6 56.2 -72.0 -36.7 102.6 58.4 78.6 194 196 A A H <>S+ 0 0 0 -4,-2.9 5,-2.1 -5,-0.3 -1,-0.2 0.885 114.0 40.6 -63.3 -38.4 105.6 60.6 78.3 195 197 A T H ><5S+ 0 0 0 -4,-1.6 3,-1.6 -5,-0.3 34,-0.3 0.858 110.9 56.3 -77.9 -34.1 104.3 62.3 75.2 196 198 A R H 3<5S+ 0 0 23 -4,-1.8 -2,-0.2 1,-0.3 -1,-0.2 0.787 105.6 53.9 -65.6 -26.2 100.7 62.4 76.5 197 199 A M T 3<5S- 0 0 6 -4,-1.5 -31,-0.3 -5,-0.1 -1,-0.3 0.482 119.1-118.6 -84.8 -4.1 102.3 64.3 79.4 198 200 A G T < 5 + 0 0 2 -3,-1.6 -30,-1.2 1,-0.2 -3,-0.2 0.848 59.7 149.6 71.8 36.3 103.8 66.7 76.8 199 201 A M < - 0 0 1 -5,-2.1 31,-1.9 -32,-0.2 2,-1.0 -0.494 59.1-101.5 -94.3 168.2 107.5 66.2 77.5 200 202 A D E -gi 170 230D 40 -31,-2.8 -29,-3.0 29,-0.3 2,-0.4 -0.824 51.7-160.1 -90.1 103.1 110.3 66.4 75.0 201 203 A V E -gi 171 231D 1 29,-3.7 31,-0.8 -2,-1.0 2,-0.5 -0.730 19.6-172.6 -97.3 133.8 110.9 62.7 74.4 202 204 A T E -gi 172 232D 18 -31,-2.6 -29,-2.0 -2,-0.4 2,-1.1 -0.969 13.5-152.7-124.5 116.3 113.9 61.0 72.9 203 205 A L E -gi 173 233D 0 29,-3.3 31,-2.5 -2,-0.5 2,-0.6 -0.773 19.3-166.6 -87.7 100.3 113.8 57.3 72.1 204 206 A L E +gi 174 234D 0 -31,-2.1 -29,-2.4 -2,-1.1 31,-0.2 -0.807 22.3 145.2 -94.4 116.1 117.4 56.2 72.5 205 207 A C - 0 0 0 29,-2.4 6,-0.1 -2,-0.6 -2,-0.0 -0.956 54.4-106.8-145.1 162.3 118.2 52.8 71.1 206 208 A P S S- 0 0 8 0, 0.0 -1,-0.1 0, 0.0 31,-0.0 0.969 91.0 -5.8 -53.5 -67.7 121.1 51.0 69.3 207 209 A T S > S- 0 0 30 1,-0.0 3,-2.6 27,-0.0 4,-0.1 -0.818 76.5 -96.0-129.2 168.6 119.9 50.7 65.7 208 210 A P G > S+ 0 0 84 0, 0.0 3,-1.4 0, 0.0 -1,-0.0 0.708 117.0 73.7 -56.8 -18.8 116.7 51.4 63.7 209 211 A D G 3 S+ 0 0 65 1,-0.3 46,-0.4 45,-0.1 48,-0.2 0.712 93.0 54.4 -67.2 -20.5 115.9 47.8 64.2 210 212 A Y G < S+ 0 0 2 -3,-2.6 -1,-0.3 44,-0.2 2,-0.1 0.301 78.6 120.2 -97.1 9.0 115.1 48.6 67.9 211 213 A I S < S- 0 0 51 -3,-1.4 44,-0.3 -4,-0.1 3,-0.1 -0.485 70.8-103.6 -72.0 144.2 112.6 51.3 67.1 212 214 A L - 0 0 6 1,-0.2 5,-0.1 -2,-0.1 -1,-0.1 -0.244 47.8 -72.7 -70.3 157.4 109.1 50.6 68.5 213 215 A D >> - 0 0 17 1,-0.1 4,-1.5 3,-0.1 3,-1.1 -0.100 45.4-115.4 -46.7 140.8 106.1 49.4 66.5 214 216 A E H 3> S+ 0 0 150 1,-0.3 4,-3.1 2,-0.2 5,-0.3 0.818 111.2 69.0 -50.1 -37.0 104.6 52.1 64.3 215 217 A R H 3> S+ 0 0 55 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.907 107.3 36.6 -49.7 -47.8 101.4 52.0 66.3 216 218 A Y H <> S+ 0 0 2 -3,-1.1 4,-1.9 2,-0.2 -1,-0.2 0.754 113.3 56.0 -80.0 -26.5 103.1 53.5 69.4 217 219 A M H X S+ 0 0 30 -4,-1.5 4,-1.7 2,-0.2 -2,-0.2 0.892 112.4 45.4 -70.3 -36.9 105.3 55.8 67.4 218 220 A D H X S+ 0 0 79 -4,-3.1 4,-2.3 2,-0.2 -2,-0.2 0.860 109.0 53.5 -72.8 -37.7 102.1 57.2 65.8 219 221 A W H X S+ 0 0 45 -4,-1.7 4,-2.1 -5,-0.3 -1,-0.2 0.926 110.9 49.0 -60.6 -43.4 100.3 57.4 69.2 220 222 A A H X S+ 0 0 0 -4,-1.9 4,-2.8 2,-0.2 -2,-0.2 0.861 109.1 50.9 -64.1 -40.4 103.3 59.5 70.4 221 223 A A H X S+ 0 0 48 -4,-1.7 4,-2.3 2,-0.2 -1,-0.2 0.913 112.1 46.9 -64.8 -43.5 103.3 61.8 67.4 222 224 A Q H X S+ 0 0 105 -4,-2.3 4,-1.6 1,-0.2 -2,-0.2 0.869 113.8 49.5 -66.3 -35.8 99.5 62.4 67.8 223 225 A N H X S+ 0 0 1 -4,-2.1 4,-2.7 2,-0.2 5,-0.3 0.897 108.5 51.9 -69.2 -41.9 100.2 63.0 71.5 224 226 A V H X>S+ 0 0 24 -4,-2.8 4,-2.6 1,-0.2 5,-0.6 0.937 109.6 50.2 -59.1 -47.2 103.0 65.4 70.9 225 227 A A H <5S+ 0 0 85 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.865 116.2 42.1 -59.2 -38.7 100.8 67.4 68.6 226 228 A E H <5S+ 0 0 140 -4,-1.6 -1,-0.2 -5,-0.1 -2,-0.2 0.782 123.1 35.5 -80.6 -30.2 98.1 67.6 71.2 227 229 A S H <5S- 0 0 18 -4,-2.7 -2,-0.2 -32,-0.2 -3,-0.2 0.648 102.7-117.9-100.6 -18.2 100.2 68.2 74.3 228 230 A G T <5S+ 0 0 66 -4,-2.6 -3,-0.2 -5,-0.3 -4,-0.1 0.652 73.8 115.1 91.3 15.1 103.0 70.5 72.9 229 231 A G < - 0 0 14 -5,-0.6 2,-0.3 -34,-0.3 -29,-0.3 0.201 57.8-117.4 -91.9-143.2 105.9 68.2 73.6 230 232 A S E -i 200 0D 43 -31,-1.9 -29,-3.7 2,-0.0 2,-0.3 -0.970 9.9-146.9-163.7 147.7 108.2 66.5 71.0 231 233 A L E +i 201 0D 49 -2,-0.3 2,-0.3 -31,-0.2 -29,-0.2 -0.896 21.6 167.0-118.4 149.1 109.3 63.1 69.8 232 234 A Q E -i 202 0D 103 -31,-0.8 -29,-3.3 -2,-0.3 2,-0.5 -0.945 25.9-142.3-163.6 136.1 112.7 62.1 68.5 233 235 A V E +i 203 0D 54 -2,-0.3 2,-0.3 -31,-0.2 -29,-0.2 -0.895 28.0 175.7-104.6 130.8 114.6 58.9 67.8 234 236 A S E -i 204 0D 12 -31,-2.5 -29,-2.4 -2,-0.5 -2,-0.0 -0.951 30.7-174.9-134.6 153.6 118.3 58.8 68.5 235 237 A H + 0 0 74 -2,-0.3 2,-0.7 -31,-0.2 -31,-0.1 0.253 66.2 94.4-125.6 3.9 121.1 56.2 68.4 236 238 A D > - 0 0 84 1,-0.2 4,-1.4 2,-0.0 5,-0.1 -0.893 58.2-161.9-104.6 110.9 123.8 58.5 70.0 237 239 A I H > S+ 0 0 15 -2,-0.7 4,-2.3 1,-0.2 3,-0.4 0.939 83.7 48.9 -54.3 -60.0 124.0 57.9 73.8 238 240 A D H > S+ 0 0 70 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.864 111.9 46.8 -53.2 -45.8 125.9 61.1 74.8 239 241 A S H 4 S+ 0 0 67 2,-0.2 -1,-0.2 1,-0.2 -2,-0.2 0.819 112.6 52.8 -68.7 -29.9 123.6 63.6 72.9 240 242 A A H < S+ 0 0 8 -4,-1.4 -2,-0.2 -3,-0.4 -1,-0.2 0.974 110.2 43.8 -68.5 -56.9 120.5 61.9 74.2 241 243 A Y H >< S+ 0 0 0 -4,-2.3 3,-2.3 -5,-0.1 44,-0.2 0.765 87.2 117.6 -59.9 -27.3 121.4 62.0 77.9 242 244 A A T 3< S- 0 0 58 -4,-1.3 42,-0.2 -5,-0.3 43,-0.1 -0.209 93.6 -12.1 -50.2 115.0 122.6 65.6 77.6 243 245 A G T 3 S+ 0 0 34 40,-2.0 -1,-0.3 1,-0.2 -73,-0.3 0.608 92.8 162.5 69.3 14.0 120.4 67.8 79.7 244 246 A A < - 0 0 0 -3,-2.3 41,-2.6 1,-0.1 43,-0.3 -0.359 31.2-166.6 -68.4 142.8 117.8 65.1 80.4 245 247 A D S S+ 0 0 20 -75,-2.4 43,-2.4 1,-0.3 2,-0.4 0.677 78.7 28.7 -97.8 -26.2 115.4 65.6 83.3 246 248 A V E -hj 171 288D 0 -76,-1.9 -74,-3.0 41,-0.2 2,-0.4 -1.000 59.4-170.4-140.1 137.8 114.2 62.0 83.2 247 249 A V E -hj 172 289D 0 41,-2.2 43,-2.0 -2,-0.4 2,-0.6 -0.959 7.4-177.5-130.4 111.6 115.9 58.7 82.1 248 250 A Y E -hj 173 290D 3 -76,-2.9 -74,-2.0 -2,-0.4 2,-0.3 -0.939 11.8-160.1-112.8 112.4 113.7 55.6 81.9 249 251 A A E +h 174 0D 0 41,-1.7 43,-0.5 -2,-0.6 2,-0.3 -0.648 19.7 155.3 -95.6 150.8 115.5 52.4 80.9 250 252 A K E -h 175 0D 10 -76,-2.0 -74,-0.7 -2,-0.3 2,-0.3 -0.912 28.3-138.7-168.7 141.8 114.0 49.3 79.5 251 253 A S + 0 0 0 -76,-0.3 2,-0.3 -2,-0.3 -64,-0.1 -0.836 27.4 163.3-107.8 146.6 115.3 46.4 77.4 252 254 A W - 0 0 0 -2,-0.3 2,-0.3 -76,-0.3 -69,-0.2 -0.988 37.5-104.4-158.5 154.3 113.4 44.8 74.5 253 255 A G - 0 0 0 -71,-2.1 2,-0.1 -2,-0.3 5,-0.1 -0.619 48.4 -95.2 -83.9 143.0 114.0 42.5 71.6 254 256 A A > - 0 0 0 -2,-0.3 3,-2.0 1,-0.1 -44,-0.2 -0.348 29.1-137.9 -57.9 124.1 114.1 44.0 68.1 255 257 A L G > S+ 0 0 19 -46,-0.4 3,-1.9 -44,-0.3 -137,-0.3 0.876 100.2 61.5 -53.0 -42.6 110.6 43.7 66.6 256 258 A P G 3 S+ 0 0 84 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.656 101.2 56.0 -62.1 -12.0 112.0 42.7 63.1 257 259 A F G X S+ 0 0 28 -3,-2.0 3,-2.0 -48,-0.2 -2,-0.2 0.160 73.0 140.0-105.7 17.7 113.6 39.6 64.8 258 260 A F T < S+ 0 0 24 -3,-1.9 -142,-0.2 1,-0.3 -139,-0.1 -0.411 78.8 9.9 -63.6 132.3 110.5 38.1 66.3 259 261 A G T 3 S+ 0 0 46 -144,-1.2 -1,-0.3 -2,-0.1 -143,-0.1 0.520 124.9 71.4 76.3 4.0 110.4 34.3 65.9 260 262 A N < + 0 0 81 -3,-2.0 4,-0.3 1,-0.1 -2,-0.1 -0.449 51.8 144.8-148.5 62.8 114.0 34.6 64.8 261 263 A W > + 0 0 34 1,-0.2 4,-1.2 2,-0.1 3,-0.4 0.641 51.5 83.1 -80.8 -17.6 116.1 35.5 67.9 262 264 A E T 4 S+ 0 0 152 1,-0.2 3,-0.4 2,-0.2 -1,-0.2 0.907 95.9 41.6 -54.7 -47.9 119.2 33.6 67.1 263 265 A P T 4 S+ 0 0 52 0, 0.0 4,-0.3 0, 0.0 -1,-0.2 0.685 111.9 55.4 -75.7 -17.8 120.7 36.3 64.8 264 266 A E T > S+ 0 0 0 -3,-0.4 4,-2.1 -4,-0.3 5,-0.2 0.635 91.4 74.7 -88.6 -14.1 119.7 39.2 67.1 265 267 A K H X S+ 0 0 81 -4,-1.2 4,-2.0 -3,-0.4 -1,-0.2 0.944 97.7 44.9 -62.4 -48.6 121.5 37.6 70.1 266 268 A P H 4 S+ 0 0 73 0, 0.0 4,-0.3 0, 0.0 -1,-0.2 0.711 110.7 58.9 -69.4 -15.8 124.9 38.6 68.7 267 269 A I H >4 S+ 0 0 42 -4,-0.3 3,-0.7 2,-0.2 -2,-0.2 0.907 108.8 39.3 -78.5 -44.8 123.5 42.0 67.9 268 270 A R H >< S+ 0 0 0 -4,-2.1 3,-2.8 1,-0.2 4,-0.1 0.894 104.9 69.3 -71.7 -38.4 122.4 43.0 71.4 269 271 A D T 3< S+ 0 0 74 -4,-2.0 3,-0.4 1,-0.3 -1,-0.2 0.662 96.2 55.1 -53.7 -18.6 125.6 41.5 72.9 270 272 A Q T < S+ 0 0 125 -3,-0.7 -1,-0.3 -4,-0.3 -2,-0.1 0.190 105.2 52.6-101.8 16.1 127.6 44.2 71.3 271 273 A Y X + 0 0 46 -3,-2.8 3,-2.0 1,-0.1 -1,-0.2 0.134 61.3 118.5-133.6 19.1 125.5 47.0 72.9 272 274 A Q G > + 0 0 108 -3,-0.4 3,-0.8 1,-0.3 -95,-0.2 0.462 63.0 81.7 -67.2 3.7 125.6 46.1 76.6 273 275 A H G 3 + 0 0 100 1,-0.2 -1,-0.3 -97,-0.1 -2,-0.0 0.425 68.0 82.1 -86.0 0.1 127.4 49.5 77.0 274 276 A F G < + 0 0 6 -3,-2.0 -1,-0.2 2,-0.1 -2,-0.1 0.467 64.2 129.6 -80.1 -1.5 123.9 51.1 76.9 275 277 A I S < S- 0 0 25 -3,-0.8 2,-0.9 1,-0.1 26,-0.2 -0.319 70.4-114.6 -56.6 128.5 123.8 50.2 80.6 276 278 A V B +l 301 0E 0 24,-2.0 26,-1.6 -102,-0.1 29,-0.2 -0.567 53.1 160.9 -72.5 103.9 122.8 53.2 82.6 277 279 A D > - 0 0 39 -2,-0.9 4,-1.9 24,-0.2 5,-0.2 -0.490 56.0 -87.2-113.9-175.6 125.8 54.1 84.7 278 280 A E H > S+ 0 0 133 1,-0.2 4,-1.4 2,-0.2 5,-0.1 0.880 121.7 58.3 -61.5 -39.4 127.1 57.1 86.6 279 281 A R H >> S+ 0 0 124 1,-0.2 4,-0.7 2,-0.2 3,-0.5 0.950 109.6 40.9 -56.2 -55.6 128.9 58.5 83.5 280 282 A K H >> S+ 0 0 6 1,-0.2 3,-0.9 -5,-0.2 4,-0.5 0.876 115.2 51.2 -63.0 -39.2 125.7 58.7 81.4 281 283 A M H 3< S+ 0 0 27 -4,-1.9 3,-0.4 1,-0.2 6,-0.3 0.714 100.5 65.9 -70.7 -19.4 123.6 60.0 84.3 282 284 A A H << S+ 0 0 77 -4,-1.4 -1,-0.2 -3,-0.5 -2,-0.2 0.760 94.8 57.6 -72.6 -24.9 126.3 62.6 84.9 283 285 A L H << S+ 0 0 62 -3,-0.9 -40,-2.0 -4,-0.7 -1,-0.2 0.726 92.0 91.1 -77.4 -22.2 125.4 64.2 81.5 284 286 A T S < S- 0 0 15 -4,-0.5 2,-1.4 -3,-0.4 -39,-0.2 -0.077 94.7-100.3 -68.5 171.3 121.8 64.7 82.6 285 287 A N S S- 0 0 100 -41,-2.6 -1,-0.1 -44,-0.2 3,-0.1 -0.539 83.8 -63.8 -92.6 67.6 120.4 67.8 84.2 286 288 A N S S- 0 0 129 -2,-1.4 -1,-0.2 -5,-0.2 -4,-0.1 0.927 92.3-175.0 51.0 42.9 120.4 66.3 87.7 287 289 A G - 0 0 2 -6,-0.3 -41,-0.2 -43,-0.3 2,-0.2 -0.300 24.2-117.4 -74.3 154.5 117.9 64.0 86.1 288 290 A V E -j 246 0D 0 -43,-2.4 -41,-2.2 -3,-0.1 2,-0.4 -0.585 24.4-149.2 -88.5 151.4 115.9 61.3 87.8 289 291 A F E +jk 247 311D 0 21,-2.7 23,-2.7 -2,-0.2 24,-0.4 -0.963 20.7 163.7-124.2 141.9 116.3 57.6 86.9 290 292 A S E -j 248 0D 1 -43,-2.0 -41,-1.7 -2,-0.4 2,-0.3 -0.981 16.7-171.4-151.9 162.9 113.7 54.8 87.0 291 293 A H - 0 0 1 -2,-0.3 26,-0.1 -43,-0.2 -41,-0.1 -0.966 31.0-125.3-150.9 150.1 113.0 51.4 85.7 292 294 A C - 0 0 10 -43,-0.5 3,-0.1 -2,-0.3 -42,-0.1 0.695 64.3-115.3 -72.8 -21.7 109.8 49.3 86.0 293 295 A L S S+ 0 0 30 1,-0.2 2,-0.1 -244,-0.0 -1,-0.0 0.329 91.7 102.6 69.5 151.6 111.5 46.3 87.6 294 296 A P + 0 0 91 0, 0.0 2,-0.4 0, 0.0 -1,-0.2 0.397 65.9 177.9 -70.7 134.7 112.4 43.5 87.8 295 297 A L - 0 0 30 -2,-0.1 2,-0.7 -4,-0.1 -4,-0.0 -0.919 28.3-136.4-115.4 136.5 115.9 44.9 87.0 296 298 A R >>> - 0 0 133 -2,-0.4 4,-2.4 -3,-0.0 3,-1.4 -0.803 27.9-130.8 -90.8 113.9 119.2 43.0 86.8 297 299 A R B 345S+m 301 0E 104 -2,-0.7 5,-0.2 1,-0.2 6,-0.1 -0.344 87.9 16.4 -66.3 144.4 121.9 45.0 88.6 298 300 A N T 345S+ 0 0 94 3,-3.1 -1,-0.2 -22,-0.1 4,-0.2 0.591 124.8 62.2 69.2 12.8 125.2 45.6 86.7 299 301 A V T <45S+ 0 0 40 -3,-1.4 -122,-0.5 2,-0.6 -2,-0.2 0.574 119.1 13.9-128.1 -51.9 123.4 44.6 83.5 300 302 A X T <5S+ 0 0 12 -4,-2.4 -24,-2.0 1,-0.4 2,-0.3 0.773 142.9 2.8 -96.5 -35.7 120.6 47.2 82.9 301 303 A A B - 0 0 30 -26,-1.6 4,-2.0 -2,-0.3 5,-0.2 -0.273 31.8-109.9 -73.2 164.8 125.0 49.7 87.7 303 305 A D H > S+ 0 0 63 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.909 117.5 57.1 -60.4 -43.0 124.8 49.4 91.5 304 306 A A H > S+ 0 0 37 1,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.910 107.7 46.2 -55.6 -47.4 125.8 53.1 91.9 305 307 A V H >4 S+ 0 0 3 1,-0.2 3,-1.0 -29,-0.2 -1,-0.2 0.931 111.0 52.1 -62.4 -47.0 122.9 54.3 89.7 306 308 A M H 3< S+ 0 0 25 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.819 114.9 42.3 -59.7 -33.2 120.3 52.1 91.5 307 309 A D H 3< S+ 0 0 112 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.450 88.7 111.8 -95.5 -1.0 121.4 53.4 94.9 308 310 A S S X< S- 0 0 36 -3,-1.0 3,-2.0 -4,-0.6 -19,-0.1 -0.371 80.2-117.6 -70.0 151.2 121.7 57.1 93.9 309 311 A P T 3 S+ 0 0 126 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.651 112.2 66.6 -64.8 -9.5 119.2 59.4 95.5 310 312 A N T 3 S+ 0 0 40 -5,-0.1 -21,-2.7 -22,-0.1 2,-0.7 0.504 74.6 98.5 -89.3 -5.4 118.0 60.2 91.9 311 313 A C B < +k 289 0D 19 -3,-2.0 3,-0.2 -23,-0.2 -21,-0.2 -0.756 44.9 176.8 -84.4 118.5 116.7 56.7 91.3 312 314 A I > + 0 0 10 -23,-2.7 4,-2.5 -2,-0.7 5,-0.2 0.106 42.5 116.7-107.5 21.4 112.9 56.8 91.9 313 315 A A H > S+ 0 0 1 -24,-0.4 4,-2.4 1,-0.2 -1,-0.2 0.859 75.3 49.4 -57.2 -40.6 112.3 53.1 91.0 314 316 A I H > S+ 0 0 121 -3,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.903 111.4 49.2 -68.2 -40.2 111.0 52.1 94.4 315 317 A D H > S+ 0 0 76 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.917 111.6 49.3 -63.4 -44.5 108.6 55.1 94.6 316 318 A E H X S+ 0 0 0 -4,-2.5 4,-0.6 1,-0.2 -2,-0.2 0.922 110.8 50.4 -61.3 -43.7 107.3 54.2 91.2 317 319 A A H >X S+ 0 0 20 -4,-2.4 3,-1.1 1,-0.2 4,-0.6 0.902 109.1 51.5 -62.3 -40.9 106.9 50.6 92.2 318 320 A E H >X S+ 0 0 90 -4,-2.4 3,-1.4 1,-0.2 4,-0.8 0.919 102.8 60.9 -61.2 -41.2 105.0 51.7 95.3 319 321 A N H 3X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.3 5,-0.3 0.645 84.1 76.7 -62.1 -15.5 102.7 53.8 93.1 320 322 A R H