==== 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 TRANSFERASE 05-APR-07 2PFR . COMPND 2 MOLECULE: ARYLAMINE N-ACETYLTRANSFERASE 2; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR W.TEMPEL,H.WU,L.DOMBROVSKI,P.LOPPNAU,J.WEIGELT,M.SUNDSTROM, . 577 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24834.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 392 67.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 14 2.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 145 25.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 12 2.1 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 . 46 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 56 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 108 18.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 2.8 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 2 0 0 0 3 3 2 0 0 0 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 4 6 4 0 3 6 5 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 . 2 0 0 0 0 2 0 2 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 S > 0 0 112 0, 0.0 4,-1.9 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 151.3 -7.1 69.8 58.4 2 2 A D H > + 0 0 99 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.876 360.0 54.2 -59.8 -42.1 -5.4 66.6 59.5 3 3 A I H > S+ 0 0 29 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.868 108.8 48.5 -63.5 -37.2 -6.7 64.5 56.5 4 4 A E H > S+ 0 0 77 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.864 110.4 52.4 -70.3 -35.5 -5.3 67.1 54.0 5 5 A A H X S+ 0 0 38 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.885 109.9 48.6 -62.5 -43.1 -2.0 67.0 55.9 6 6 A Y H X S+ 0 0 0 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.921 111.2 48.9 -62.7 -45.5 -2.0 63.2 55.6 7 7 A F H <>S+ 0 0 15 -4,-2.2 5,-2.6 1,-0.2 4,-0.5 0.878 111.4 50.9 -65.8 -35.7 -2.8 63.3 51.8 8 8 A E H ><5S+ 0 0 103 -4,-2.2 3,-0.8 3,-0.2 -1,-0.2 0.916 107.3 53.4 -64.4 -42.9 0.1 65.9 51.4 9 9 A R H 3<5S+ 0 0 24 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.836 115.2 39.4 -64.1 -35.2 2.5 63.6 53.2 10 10 A I T 3<5S- 0 0 6 -4,-1.8 -1,-0.3 2,-0.1 -2,-0.2 0.449 111.2-120.1 -93.1 0.9 1.7 60.7 50.9 11 11 A G T < 5 + 0 0 25 -3,-0.8 2,-0.5 -4,-0.5 -3,-0.2 0.759 60.5 149.6 71.3 23.8 1.5 62.9 47.8 12 12 A Y < - 0 0 13 -5,-2.6 2,-0.9 -6,-0.2 -1,-0.2 -0.801 39.8-151.3 -98.3 131.1 -2.1 62.0 47.0 13 13 A K - 0 0 159 -2,-0.5 2,-2.2 -5,-0.0 3,-0.4 -0.813 8.0-155.9 -99.8 94.4 -4.4 64.5 45.3 14 14 A N + 0 0 77 -2,-0.9 -2,-0.0 1,-0.2 -7,-0.0 -0.493 48.2 131.4 -71.9 80.7 -8.0 63.6 46.5 15 15 A S + 0 0 113 -2,-2.2 2,-0.3 0, 0.0 -1,-0.2 0.789 50.9 72.1-103.3 -42.3 -9.7 65.1 43.5 16 16 A R S S- 0 0 49 -3,-0.4 0, 0.0 1,-0.1 0, 0.0 -0.591 71.8-152.3 -69.2 135.1 -12.1 62.2 42.6 17 17 A N + 0 0 97 -2,-0.3 -1,-0.1 2,-0.0 2,-0.1 0.610 52.7 121.1 -83.4 -8.0 -14.8 62.1 45.2 18 18 A K - 0 0 139 1,-0.1 2,-1.3 5,-0.0 5,-0.1 -0.259 55.9-150.4 -86.4 138.0 -15.5 58.4 44.9 19 19 A L + 0 0 75 -2,-0.1 2,-0.2 4,-0.1 -1,-0.1 -0.544 58.8 122.5 -97.8 69.1 -15.3 55.6 47.6 20 20 A D S > S- 0 0 41 -2,-1.3 4,-2.4 94,-0.1 5,-0.2 -0.625 79.7 -90.7-124.5-180.0 -14.4 52.9 45.1 21 21 A L H > S+ 0 0 65 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.822 121.6 56.8 -66.1 -32.0 -11.6 50.4 44.6 22 22 A E H > S+ 0 0 151 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.912 110.7 44.0 -65.6 -43.6 -9.6 52.8 42.3 23 23 A T H > S+ 0 0 6 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.934 113.8 49.1 -66.6 -47.2 -9.5 55.4 45.1 24 24 A L H X S+ 0 0 1 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.932 113.8 48.1 -54.9 -47.3 -8.7 52.8 47.8 25 25 A T H X S+ 0 0 23 -4,-2.6 4,-3.0 1,-0.2 -2,-0.2 0.890 109.2 51.9 -62.7 -47.2 -5.9 51.4 45.6 26 26 A D H X S+ 0 0 58 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.866 111.5 47.4 -56.4 -41.7 -4.4 54.9 44.8 27 27 A I H X S+ 0 0 0 -4,-2.1 4,-2.8 2,-0.2 -2,-0.2 0.919 112.9 48.0 -69.1 -44.3 -4.3 55.7 48.5 28 28 A L H X S+ 0 0 1 -4,-2.4 4,-2.5 2,-0.2 5,-0.2 0.939 113.6 48.1 -58.6 -50.0 -2.6 52.4 49.4 29 29 A E H X S+ 0 0 34 -4,-3.0 4,-1.3 1,-0.2 -2,-0.2 0.929 112.7 48.7 -57.7 -48.9 -0.1 52.8 46.6 30 30 A H H X S+ 0 0 55 -4,-2.3 4,-0.6 -5,-0.2 3,-0.3 0.927 112.1 48.2 -57.7 -46.1 0.6 56.4 47.7 31 31 A Q H >X S+ 0 0 1 -4,-2.8 4,-3.3 1,-0.2 3,-1.4 0.944 110.9 48.2 -63.3 -46.9 1.1 55.4 51.3 32 32 A I H 3< S+ 0 0 4 -4,-2.5 194,-2.1 1,-0.3 -1,-0.2 0.722 113.5 49.7 -70.1 -18.2 3.5 52.5 50.7 33 33 A R H 3< S+ 0 0 78 -4,-1.3 -1,-0.3 -3,-0.3 -2,-0.2 0.499 124.1 28.9 -92.1 -6.6 5.6 54.6 48.4 34 34 A A H << S+ 0 0 19 -3,-1.4 -2,-0.2 -4,-0.6 -3,-0.2 0.722 111.6 59.2-118.4 -45.4 5.8 57.5 50.9 35 35 A V S < S- 0 0 4 -4,-3.3 -1,-0.2 -5,-0.2 191,-0.2 -0.864 77.9-143.4-101.6 108.1 5.6 56.1 54.4 36 36 A P - 0 0 0 0, 0.0 30,-1.8 0, 0.0 2,-0.6 -0.366 16.5-118.4 -68.3 147.5 8.4 53.6 55.1 37 37 A F E +aB 66 224A 21 187,-2.2 187,-2.7 28,-0.2 2,-0.3 -0.814 58.8 153.4 -73.0 122.1 8.1 50.5 57.2 38 38 A E E - B 0 223A 2 28,-1.6 185,-0.2 -2,-0.6 183,-0.0 -0.989 46.2-173.2-156.7 153.7 10.6 51.3 60.0 39 39 A N > + 0 0 0 183,-1.3 3,-1.5 -2,-0.3 4,-0.2 -0.087 46.7 128.8-130.2 26.0 11.5 50.6 63.6 40 40 A L G > + 0 0 3 1,-0.3 3,-2.0 182,-0.2 4,-0.3 0.770 61.8 69.3 -63.4 -26.1 14.4 53.1 64.0 41 41 A N G > >S+ 0 0 10 1,-0.3 5,-2.6 2,-0.2 3,-1.3 0.872 93.6 60.1 -54.7 -35.0 12.9 54.7 67.1 42 42 A M G < 5S+ 0 0 42 -3,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.564 107.9 45.0 -68.8 -12.7 13.8 51.4 68.9 43 43 A H G < 5S+ 0 0 7 -3,-2.0 237,-2.4 -4,-0.2 -1,-0.2 0.230 112.2 48.3-118.5 10.2 17.4 52.0 67.9 44 44 A C T < 5S- 0 0 3 -3,-1.3 -2,-0.2 -4,-0.3 -3,-0.1 0.027 117.1 -97.9-135.8 29.4 17.8 55.7 68.9 45 45 A G T 5S+ 0 0 27 1,-0.2 2,-0.2 -4,-0.1 -3,-0.2 0.789 82.4 128.0 63.6 33.1 16.2 55.6 72.4 46 46 A Q < - 0 0 61 -5,-2.6 -1,-0.2 -6,-0.2 -2,-0.2 -0.756 59.3 -87.6-122.2 166.5 12.8 56.9 71.2 47 47 A A - 0 0 49 -2,-0.2 2,-0.4 1,-0.1 -6,-0.1 -0.301 12.2-154.1 -77.4 148.1 9.2 55.6 71.7 48 48 A M - 0 0 5 -7,-0.1 2,-0.1 -6,-0.1 -1,-0.1 -0.736 35.7-172.2-109.2 75.2 7.1 53.1 69.6 49 49 A E - 0 0 106 -2,-0.4 -2,-0.0 1,-0.1 0, 0.0 -0.389 28.9-159.2 -76.0 145.9 3.8 54.6 70.6 50 50 A L + 0 0 12 -2,-0.1 2,-0.2 4,-0.0 -1,-0.1 0.555 58.8 111.5 -96.1 -12.4 0.4 53.0 69.7 51 51 A G > - 0 0 37 1,-0.1 4,-2.3 4,-0.0 5,-0.2 -0.445 66.6-138.4 -67.9 130.0 -1.6 56.3 70.1 52 52 A L H > S+ 0 0 57 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.871 101.6 52.8 -54.5 -44.5 -3.0 57.6 66.9 53 53 A E H > S+ 0 0 173 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.943 111.4 45.5 -61.8 -45.9 -2.1 61.2 67.7 54 54 A A H > S+ 0 0 30 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.898 114.9 48.9 -60.8 -38.9 1.5 60.4 68.5 55 55 A I H X S+ 0 0 2 -4,-2.3 4,-3.0 2,-0.2 5,-0.4 0.929 109.8 51.8 -67.9 -44.1 1.6 58.3 65.3 56 56 A F H X>S+ 0 0 19 -4,-3.0 4,-2.5 2,-0.2 5,-1.1 0.935 111.1 46.8 -57.9 -48.3 0.1 61.1 63.2 57 57 A D H <>S+ 0 0 65 -4,-2.3 5,-1.9 3,-0.2 4,-0.2 0.921 116.0 45.8 -59.8 -44.6 2.7 63.6 64.5 58 58 A H H <5S+ 0 0 10 -4,-2.1 6,-2.0 3,-0.2 -2,-0.2 0.932 124.9 29.5 -63.9 -51.0 5.6 61.2 63.8 59 59 A I H <5S+ 0 0 0 -4,-3.0 4,-0.4 4,-0.2 -3,-0.2 0.936 131.9 29.3 -79.6 -49.6 4.5 60.0 60.4 60 60 A V T <5S+ 0 0 14 -4,-2.5 -3,-0.2 -5,-0.4 -2,-0.1 0.962 130.9 30.1 -84.2 -52.1 2.7 63.1 59.0 61 61 A R T > - 0 0 1 -2,-0.3 4,-2.4 -30,-0.2 3,-2.2 -0.375 62.7 -79.3 -96.4-179.8 5.7 49.2 61.8 68 68 A C H 3>>S+ 0 0 9 56,-0.4 4,-2.2 1,-0.3 5,-0.6 0.841 126.8 58.6 -53.8 -42.2 2.3 47.6 61.1 69 69 A L H 345S+ 0 0 0 37,-0.2 -1,-0.3 1,-0.2 133,-0.1 0.661 118.7 32.5 -62.8 -20.5 0.6 48.7 64.4 70 70 A Q H <>5S+ 0 0 6 -3,-2.2 4,-2.5 3,-0.1 -2,-0.2 0.837 119.3 44.4 -99.4 -54.7 1.3 52.3 63.4 71 71 A V H X5S+ 0 0 1 -4,-2.4 4,-2.0 1,-0.2 -3,-0.2 0.857 118.2 44.6 -65.3 -36.5 1.2 52.6 59.6 72 72 A N H X5S+ 0 0 0 -4,-2.2 4,-2.4 -5,-0.3 -1,-0.2 0.780 111.2 54.0 -75.9 -27.1 -2.0 50.5 59.3 73 73 A Q H >S+ 0 0 0 -4,-2.9 5,-2.6 2,-0.2 4,-0.9 0.903 116.0 46.9 -64.1 -42.2 -9.8 55.6 55.1 80 80 A T H ><5S+ 0 0 60 -4,-2.6 3,-0.7 -5,-0.3 -2,-0.2 0.913 109.5 55.4 -61.8 -46.7 -12.5 55.8 57.9 81 81 A T H 3<5S+ 0 0 71 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.880 109.1 45.5 -56.4 -41.7 -12.3 59.6 57.8 82 82 A I H 3<5S- 0 0 39 -4,-1.9 -1,-0.2 -5,-0.1 -2,-0.2 0.613 127.2 -96.8 -85.5 -10.2 -13.0 59.8 54.1 83 83 A G T <<5S+ 0 0 45 -4,-0.9 2,-0.3 -3,-0.7 -3,-0.2 0.520 70.2 143.8 117.4 8.7 -15.9 57.3 54.5 84 84 A F < - 0 0 10 -5,-2.6 2,-0.9 -6,-0.2 -1,-0.3 -0.596 58.1-115.3 -73.5 138.0 -14.7 53.8 53.6 85 85 A Q E +G 113 0B 126 28,-0.7 28,-2.3 -2,-0.3 2,-0.4 -0.678 52.7 175.3 -69.8 105.3 -16.1 50.9 55.6 86 86 A T E -G 112 0B 14 -2,-0.9 2,-0.4 26,-0.2 26,-0.2 -0.946 18.0-172.3-126.2 139.6 -12.9 49.8 57.3 87 87 A T E -G 111 0B 32 24,-2.3 24,-2.2 -2,-0.4 2,-0.4 -0.986 21.6-129.3-131.6 140.0 -12.1 47.2 60.0 88 88 A M E -GH 110 197B 10 109,-0.6 109,-2.4 -2,-0.4 2,-0.3 -0.786 28.9-171.9 -83.6 133.3 -9.0 46.4 61.9 89 89 A L E -G 109 0B 0 20,-3.0 20,-2.4 -2,-0.4 2,-0.4 -0.909 16.2-129.7-123.3 153.1 -8.0 42.7 61.9 90 90 A G E -G 108 0B 0 105,-0.4 103,-0.9 -2,-0.3 2,-0.3 -0.870 24.8-174.3-109.9 134.6 -5.4 40.8 63.8 91 91 A G E -GI 107 192B 0 16,-2.9 16,-2.4 -2,-0.4 2,-0.5 -0.785 23.2-134.0-123.4 168.0 -2.8 38.5 62.3 92 92 A Y E - I 0 191B 63 99,-2.9 99,-2.1 -2,-0.3 2,-0.2 -0.990 30.6-130.2-124.8 119.7 -0.1 36.1 63.3 93 93 A F E - I 0 190B 63 -2,-0.5 9,-2.5 11,-0.3 97,-0.3 -0.438 17.1-116.8 -81.6 138.0 3.1 36.4 61.4 94 94 A Y E -O 101 0C 28 95,-2.8 7,-0.3 7,-0.2 -1,-0.1 -0.525 21.4-151.6 -67.4 138.4 4.9 33.5 59.9 95 95 A I E >>> -O 100 0C 65 5,-3.1 3,-1.7 -2,-0.2 5,-1.1 -0.838 8.5-170.0-115.4 91.2 8.4 32.9 61.4 96 96 A P G >45S+ 0 0 42 0, 0.0 3,-1.1 0, 0.0 -1,-0.2 0.880 80.3 64.5 -54.9 -43.5 10.6 31.2 58.7 97 97 A P G 345S+ 0 0 81 0, 0.0 190,-0.0 0, 0.0 -2,-0.0 0.756 119.9 24.3 -50.3 -28.4 13.5 30.4 61.1 98 98 A V G <45S- 0 0 77 -3,-1.7 3,-0.1 2,-0.2 -4,-0.0 0.363 102.1-124.1-118.1 5.5 11.2 28.0 63.0 99 99 A N T <<5S+ 0 0 101 -3,-1.1 2,-0.3 -4,-1.0 -5,-0.0 0.891 75.4 103.1 52.9 45.4 8.6 27.1 60.3 100 100 A K E S- J 0 117B 18 3,-2.6 3,-1.9 -2,-0.5 -94,-0.1 -0.960 75.0 -28.2-128.6 113.1 -17.1 48.3 49.1 115 115 A D T 3 S- 0 0 159 -2,-0.5 -1,-0.1 1,-0.3 3,-0.1 0.906 127.1 -47.0 43.0 53.7 -20.7 47.5 48.1 116 116 A G T 3 S+ 0 0 63 1,-0.2 -1,-0.3 0, 0.0 2,-0.3 0.096 112.4 119.7 84.3 -22.0 -20.4 44.1 49.9 117 117 A R E < -J 114 0B 147 -3,-1.9 -3,-2.6 1,-0.0 2,-0.4 -0.582 56.1-139.3 -81.6 139.9 -17.1 43.1 48.3 118 118 A N E -J 113 0B 47 -2,-0.3 19,-2.3 -5,-0.2 2,-0.4 -0.840 19.2-176.8-107.3 133.3 -14.2 42.5 50.8 119 119 A Y E -JK 112 136B 21 -7,-2.3 -7,-3.0 -2,-0.4 2,-0.5 -0.987 21.3-138.7-130.3 135.9 -10.6 43.7 50.3 120 120 A I E -JK 111 135B 0 15,-3.2 15,-2.4 -2,-0.4 2,-0.4 -0.837 24.2-172.5 -92.8 128.0 -7.6 43.0 52.5 121 121 A V E +J 110 0B 0 -11,-2.6 -11,-2.5 -2,-0.5 2,-0.4 -0.991 11.8 165.6-131.4 119.7 -5.5 46.2 52.8 122 122 A D + 0 0 0 -2,-0.4 9,-0.4 -13,-0.2 3,-0.3 -0.936 14.8 173.2-145.2 112.0 -2.1 46.1 54.5 123 123 A A S S+ 0 0 7 -2,-0.4 -1,-0.1 1,-0.2 7,-0.1 0.186 78.9 57.6 -99.6 12.5 0.4 49.0 54.1 124 124 A G + 0 0 1 -16,-0.2 -56,-0.4 1,-0.1 -1,-0.2 -0.019 58.9 112.9-140.7 35.4 2.8 47.5 56.7 125 125 A S S S- 0 0 8 -3,-0.3 3,-0.1 6,-0.1 -1,-0.1 0.751 75.9-122.2 -79.5 -29.2 3.8 43.9 55.7 126 126 A G > - 0 0 4 1,-0.2 3,-2.1 -3,-0.1 4,-0.3 0.289 50.0 -18.3 96.9 137.6 7.5 44.9 55.2 127 127 A S G > S- 0 0 7 1,-0.3 3,-1.0 2,-0.2 -1,-0.2 0.060 126.2 -6.7 40.2-129.2 10.0 44.8 52.3 128 128 A S G 3 S+ 0 0 1 162,-1.3 -1,-0.3 1,-0.2 162,-0.1 0.288 123.5 72.5 -87.8 14.7 9.1 42.4 49.4 129 129 A S G < S+ 0 0 15 -3,-2.1 2,-0.4 2,-0.1 -1,-0.2 0.406 75.6 117.2 -94.7 0.6 6.1 40.8 51.2 130 130 A Q < - 0 0 5 -3,-1.0 2,-0.1 -4,-0.3 -7,-0.1 -0.565 61.7-136.6 -82.4 120.6 4.2 44.1 50.6 131 131 A M - 0 0 1 -2,-0.4 -6,-0.1 -9,-0.4 -2,-0.1 -0.409 7.8-161.6 -64.4 146.2 1.0 44.2 48.4 132 132 A W S S+ 0 0 3 1,-0.2 -1,-0.1 -2,-0.1 -100,-0.1 0.679 78.5 30.3-100.5 -28.2 0.7 47.0 45.9 133 133 A Q S S- 0 0 55 -105,-0.1 -1,-0.2 -104,-0.1 -108,-0.0 -0.929 98.7 -89.5-125.7 155.0 -3.0 46.7 45.4 134 134 A P - 0 0 11 0, 0.0 2,-0.5 0, 0.0 -13,-0.2 -0.246 40.8-128.4 -58.6 149.2 -5.8 45.5 47.8 135 135 A L E -K 120 0B 0 -15,-2.4 -15,-3.2 -4,-0.0 2,-0.2 -0.908 15.3-127.1-104.6 126.7 -6.4 41.8 47.7 136 136 A E E -K 119 0B 32 -2,-0.5 2,-2.3 -17,-0.2 -17,-0.2 -0.526 27.2-115.2 -71.2 137.9 -10.0 40.5 47.3 137 137 A L + 0 0 26 -19,-2.3 2,-0.5 -2,-0.2 -19,-0.1 -0.490 67.9 134.4 -76.3 75.0 -11.0 38.1 50.0 138 138 A I > - 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D 0 232A 14 7,-2.4 7,-2.8 -2,-0.3 2,-0.2 -0.992 18.8-134.5-146.3 136.2 10.0 51.6 51.1 226 226 A Q E - D 0 231A 6 -194,-2.1 5,-0.2 -2,-0.3 -98,-0.0 -0.578 19.1-172.5 -85.4 153.5 8.2 50.7 47.9 227 227 A T - 0 0 27 3,-2.8 3,-0.1 -2,-0.2 -193,-0.1 -0.808 45.2 -94.3-131.0 172.2 8.7 52.4 44.6 228 228 A P S S+ 0 0 89 0, 0.0 3,-0.1 0, 0.0 -2,-0.0 0.638 125.4 26.0 -65.6 -10.7 6.8 52.1 41.3 229 229 A E S S- 0 0 106 1,-0.1 15,-2.4 13,-0.1 2,-0.2 0.490 127.8 -26.2-123.7 -7.3 9.4 49.4 40.2 230 230 A G E - E 0 243A 0 13,-0.2 -3,-2.8 -3,-0.1 2,-0.4 -0.837 64.6 -74.0-176.4-157.3 10.8 47.9 43.3 231 231 A V E -DE 226 242A 3 11,-1.9 11,-2.4 -2,-0.2 2,-0.4 -0.994 18.9-153.8-144.4 126.1 11.7 48.0 47.0 232 232 A Y E +DE 225 241A 66 -7,-2.8 -7,-2.4 -2,-0.4 2,-0.3 -0.841 22.1 176.5 -93.0 136.6 14.4 49.7 49.0 233 233 A C E -DE 224 240A 0 7,-2.6 7,-2.5 -2,-0.4 2,-0.5 -0.952 15.5-167.7-145.4 126.6 15.3 47.9 52.3 234 234 A L E -DE 223 239A 6 -11,-2.8 -11,-2.1 -2,-0.3 2,-0.5 -0.956 6.7-179.1-110.8 118.0 18.0 48.8 54.8 235 235 A V E > -DE 222 238A 3 3,-2.4 3,-2.0 -2,-0.5 2,-0.4 -0.953 66.9 -51.2-121.9 109.0 18.7 46.1 57.4 236 236 A G T 3 S- 0 0 1 -15,-2.4 -16,-0.0 -2,-0.5 46,-0.0 -0.529 124.1 -19.9 60.4-115.8 21.4 47.4 59.8 237 237 A F T 3 S+ 0 0 45 -2,-0.4 21,-3.7 44,-0.1 2,-0.8 0.398 116.2 100.7 -97.5 -3.1 24.3 48.5 57.6 238 238 A I E < -EF 235 257A 32 -3,-2.0 -3,-2.4 19,-0.2 2,-0.5 -0.802 54.4-164.4 -97.6 105.7 23.2 46.6 54.5 239 239 A L E -EF 234 256A 25 17,-2.7 17,-2.5 -2,-0.8 2,-0.4 -0.773 10.7-175.0 -86.4 128.5 21.3 48.6 51.9 240 240 A T E -EF 233 255A 4 -7,-2.5 -7,-2.6 -2,-0.5 2,-0.4 -0.961 14.6-168.5-125.3 142.2 19.3 46.6 49.2 241 241 A Y E -EF 232 254A 43 13,-1.7 13,-3.0 -2,-0.4 2,-0.5 -0.997 9.1-164.6-124.7 130.6 17.4 47.6 46.1 242 242 A R E -EF 231 253A 2 -11,-2.4 -11,-1.9 -2,-0.4 2,-0.6 -0.964 6.0-159.9-116.8 124.4 15.2 45.1 44.4 243 243 A K E > -EF 230 252A 62 9,-2.6 9,-2.4 -2,-0.5 3,-0.7 -0.911 23.8-132.5 -98.1 117.4 13.9 45.7 40.9 244 244 A F E 3 S- 0 0 6 -15,-2.4 7,-0.2 -2,-0.6 -96,-0.1 -0.491 79.3 -0.4 -71.5 140.2 10.9 43.5 40.3 245 245 A N E 3 S+ 0 0 69 -2,-0.2 6,-0.3 -98,-0.1 -1,-0.2 0.926 72.9 169.8 54.8 50.0 10.7 41.5 37.1 246 246 A Y E < - 0 0 96 4,-1.8 2,-0.3 -3,-0.7 5,-0.2 0.935 64.3 -34.1 -60.8 -50.6 14.0 42.7 35.7 247 247 A K E > S+ F 0 250A 136 3,-1.2 3,-0.6 1,-0.0 -1,-0.3 -0.902 123.7 19.5-168.1 149.9 14.0 40.2 32.9 248 248 A D T 3 S- 0 0 82 -2,-0.3 3,-0.1 1,-0.2 -2,-0.1 0.897 126.5 -62.3 58.3 43.4 12.9 36.6 32.3 249 249 A N T 3 S+ 0 0 119 1,-0.2 -82,-0.9 -4,-0.1 2,-0.4 0.889 108.8 127.0 45.4 48.6 10.5 36.6 35.2 250 250 A T E < -cF 167 247A 30 -3,-0.6 -4,-1.8 -84,-0.2 -3,-1.2 -0.985 56.2-131.9-131.4 139.6 13.5 37.2 37.6 251 251 A D E -c 168 0A 0 -84,-3.2 -82,-3.4 -2,-0.4 2,-0.4 -0.632 17.4-139.1 -85.8 151.1 13.9 39.9 40.2 252 252 A L E -cF 169 243A 22 -9,-2.4 -9,-2.6 -2,-0.2 2,-0.4 -0.949 17.6-166.6-110.9 133.2 17.3 41.8 40.4 253 253 A V E -cF 170 242A 0 -84,-2.7 -82,-2.3 -2,-0.4 -81,-0.4 -0.983 4.6-165.3-128.4 123.0 18.7 42.6 43.8 254 254 A E E - F 0 241A 94 -13,-3.0 -13,-1.7 -2,-0.4 2,-0.4 -0.849 7.6-167.1-102.1 142.8 21.6 45.0 44.6 255 255 A F E + F 0 240A 11 -2,-0.4 2,-0.3 -15,-0.2 -15,-0.2 -0.973 9.7 174.3-129.6 142.8 23.4 45.1 47.9 256 256 A K E - F 0 239A 111 -17,-2.5 -17,-2.7 -2,-0.4 2,-0.6 -0.977 26.0-135.6-145.8 132.1 25.8 47.6 49.5 257 257 A T E - F 0 238A 82 -2,-0.3 2,-0.3 -19,-0.2 -19,-0.2 -0.782 29.2-149.8 -82.9 123.1 27.4 47.7 52.9 258 258 A L - 0 0 5 -21,-3.7 2,-0.1 -2,-0.6 3,-0.0 -0.650 7.5-126.7 -93.1 148.9 27.2 51.2 54.4 259 259 A T > - 0 0 72 -2,-0.3 4,-1.1 1,-0.1 -1,-0.1 -0.409 34.9-105.0 -76.4 164.4 29.5 52.9 56.7 260 260 A E H >> S+ 0 0 125 1,-0.2 3,-1.0 2,-0.2 4,-0.8 0.956 124.9 52.1 -56.1 -46.5 28.1 54.4 59.9 261 261 A E H 3> S+ 0 0 100 1,-0.2 4,-0.7 2,-0.2 3,-0.2 0.829 107.0 52.7 -58.7 -35.9 28.5 57.9 58.2 262 262 A E H 3> S+ 0 0 70 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.685 93.5 72.2 -74.4 -21.8 26.6 56.7 55.1 263 263 A V H S+ 0 0 20 -4,-2.2 4,-2.4 2,-0.2 5,-1.2 0.908 109.3 52.6 -62.3 -46.2 20.8 57.0 52.9 267 267 A L H <5S+ 0 0 4 -4,-3.0 6,-2.6 -5,-0.2 5,-0.5 0.926 114.7 43.2 -55.5 -45.1 18.1 57.5 55.4 268 268 A K H X5S+ 0 0 126 -4,-1.9 4,-0.6 4,-0.3 -2,-0.2 0.942 122.5 34.0 -62.2 -53.1 17.6 61.1 54.2 269 269 A N H <5S+ 0 0 106 -4,-2.5 -3,-0.2 2,-0.2 -2,-0.2 0.818 129.6 28.7 -84.3 -37.1 17.8 60.6 50.4 270 270 A I T <5S+ 0 0 39 -4,-2.4 -3,-0.2 -5,-0.2 -2,-0.1 0.886 135.9 23.4 -85.6 -53.6 16.2 57.1 49.9 271 271 A F T 4 0 0 119 0, 0.0 4,-3.1 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0-103.0 42.5 65.1 92.3 293 2 B D H > + 0 0 94 2,-0.2 4,-3.2 1,-0.2 5,-0.1 0.939 360.0 50.1 -50.2 -48.7 40.7 62.9 89.7 294 3 B I H > S+ 0 0 33 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.880 109.2 49.5 -60.1 -40.3 42.1 60.0 91.8 295 4 B E H > S+ 0 0 73 2,-0.2 4,-3.5 1,-0.2 -2,-0.2 0.929 110.1 51.6 -64.2 -44.3 40.8 61.7 95.0 296 5 B A H X S+ 0 0 23 -4,-3.1 4,-3.8 2,-0.2 -2,-0.2 0.945 110.4 49.5 -53.3 -51.2 37.4 62.0 93.2 297 6 B Y H X S+ 0 0 0 -4,-3.2 4,-2.7 2,-0.2 5,-0.3 0.968 112.7 45.6 -50.5 -56.4 37.6 58.3 92.4 298 7 B F H X>S+ 0 0 13 -4,-2.9 5,-2.8 1,-0.2 4,-0.9 0.870 113.5 49.9 -62.0 -38.4 38.4 57.5 96.0 299 8 B E H ><5S+ 0 0 161 -4,-3.5 3,-0.6 3,-0.2 -1,-0.2 0.936 110.1 52.4 -56.3 -50.9 35.6 59.8 97.1 300 9 B R H 3<5S+ 0 0 27 -4,-3.8 -2,-0.2 1,-0.2 -1,-0.2 0.894 114.7 40.0 -52.7 -45.6 33.3 58.0 94.6 301 10 B I H 3<5S- 0 0 8 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.560 113.4-118.4 -89.9 -3.7 34.2 54.5 96.0 302 11 B G T <<5 + 0 0 37 -4,-0.9 2,-0.4 -3,-0.6 -3,-0.2 0.890 66.9 134.1 74.9 45.2 34.1 55.8 99.7 303 12 B Y < - 0 0 16 -5,-2.8 2,-0.5 -6,-0.1 -1,-0.2 -0.985 45.8-150.4-135.9 131.9 37.8 55.0 100.5 304 13 B K 0 0 180 -2,-0.4 -9,-0.0 -5,-0.0 -5,-0.0 -0.908 360.0 360.0-107.6 123.2 40.6 57.1 102.2 305 14 B N 0 0 135 -2,-0.5 7,-0.0 -10,-0.0 -10,-0.0 -0.369 360.0 360.0 -69.1 360.0 44.1 56.3 101.0 306 ! 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 0.0 307 18 B K 0 0 103 0, 0.0 2,-1.4 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 108.8 51.4 50.8 100.8 308 19 B L + 0 0 89 4,-0.1 2,-0.2 64,-0.1 64,-0.0 -0.559 360.0 120.4 -85.1 67.8 51.2 49.1 97.4 309 20 B D S > S- 0 0 64 -2,-1.4 4,-2.3 94,-0.0 5,-0.2 -0.646 80.7 -92.3-125.8 178.7 50.4 45.7 98.9 310 21 B L H > S+ 0 0 63 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.853 120.1 58.2 -65.7 -36.1 47.7 43.0 98.7 311 22 B E H > S+ 0 0 68 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.920 110.9 42.8 -57.1 -45.5 45.7 44.5 101.7 312 23 B T H > S+ 0 0 18 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.912 114.0 49.5 -69.8 -47.4 45.4 47.8 99.9 313 24 B L H X S+ 0 0 1 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.922 112.7 48.6 -53.2 -48.2 44.6 46.2 96.5 314 25 B T H X S+ 0 0 24 -4,-2.9 4,-2.5 1,-0.2 -2,-0.2 0.894 110.0 53.3 -61.0 -43.8 42.0 44.1 98.3 315 26 B D H X S+ 0 0 62 -4,-2.2 4,-2.1 -5,-0.2 -2,-0.2 0.940 110.6 45.0 -50.0 -58.9 40.6 47.3 100.0 316 27 B I H X S+ 0 0 0 -4,-2.5 4,-2.9 1,-0.2 -2,-0.2 0.875 113.3 49.8 -61.1 -43.0 40.2 49.3 96.8 317 28 B L H X S+ 0 0 1 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.922 110.6 50.3 -62.3 -46.0 38.5 46.3 94.9 318 29 B E H X S+ 0 0 39 -4,-2.5 4,-0.7 1,-0.2 -2,-0.2 0.885 113.7 46.3 -60.7 -39.3 36.1 45.8 97.8 319 30 B H H >X S+ 0 0 54 -4,-2.1 4,-1.3 2,-0.2 3,-0.5 0.924 111.2 49.5 -71.2 -47.9 35.2 49.5 97.8 320 31 B Q H 3X S+ 0 0 2 -4,-2.9 4,-3.3 1,-0.2 3,-0.5 0.930 112.1 48.0 -58.4 -44.8 34.7 49.8 94.0 321 32 B I H 3< S+ 0 0 5 -4,-2.4 194,-1.9 1,-0.2 -1,-0.2 0.675 114.2 47.4 -72.9 -16.4 32.4 46.7 93.8 322 33 B R H << S+ 0 0 78 -4,-0.7 -1,-0.2 -3,-0.5 -2,-0.2 0.612 124.4 31.9 -92.2 -18.8 30.3 48.0 96.8 323 34 B A H < S+ 0 0 18 -4,-1.3 -2,-0.2 -3,-0.5 -3,-0.2 0.834 112.5 58.0 -99.3 -56.0 30.1 51.5 95.3 324 35 B V S < S- 0 0 8 -4,-3.3 -1,-0.2 -5,-0.3 191,-0.2 -0.720 76.0-142.8 -95.2 114.1 30.1 51.1 91.5 325 36 B P - 0 0 0 0, 0.0 30,-1.5 0, 0.0 2,-0.7 -0.320 16.2-120.5 -71.2 149.0 27.3 48.9 90.1 326 37 B F E +qR 355 513E 22 187,-2.0 187,-2.8 28,-0.2 2,-0.3 -0.877 57.0 154.2 -78.8 122.4 27.8 46.6 87.2 327 38 B E E - R 0 512E 2 28,-1.7 185,-0.2 -2,-0.7 3,-0.1 -0.996 47.7-173.1-152.1 155.4 25.2 48.0 84.7 328 39 B N > + 0 0 0 183,-1.6 3,-1.9 -2,-0.3 4,-0.3 0.043 47.7 129.1-124.6 24.1 24.3 48.4 81.0 329 40 B L G > + 0 0 4 182,-0.3 3,-1.7 1,-0.3 4,-0.2 0.738 61.8 67.9 -61.8 -25.5 21.3 50.8 81.5 330 41 B N G > >S+ 0 0 14 1,-0.3 5,-2.9 2,-0.2 3,-1.1 0.835 93.3 59.9 -57.7 -33.9 22.5 53.3 79.0 331 42 B M G < 5S+ 0 0 43 -3,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.565 107.5 47.3 -70.7 -10.8 21.8 50.8 76.2 332 43 B H G < 5S+ 0 0 8 -3,-1.7 237,-2.9 -4,-0.3 -1,-0.2 0.263 112.2 45.9-118.0 8.9 18.2 50.8 77.3 333 44 B C T < 5S- 0 0 3 -3,-1.1 -2,-0.2 235,-0.2 -1,-0.1 -0.054 118.6 -96.7-139.3 33.4 17.6 54.6 77.6 334 45 B G T 5S+ 0 0 25 1,-0.2 2,-0.2 -3,-0.1 -56,-0.2 0.710 81.2 129.9 67.0 26.1 19.2 55.6 74.3 335 46 B Q < - 0 0 61 -5,-2.9 -1,-0.2 -6,-0.2 -2,-0.2 -0.722 57.8 -88.5-117.9 166.1 22.6 56.6 75.7 336 47 B A - 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