==== 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 17-NOV-09 3KR2 . COMPND 2 MOLECULE: PHENYLETHANOLAMINE N-METHYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR N.DRINKWATER,J.L.MARTIN . 527 4 2 0 2 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20574.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 372 70.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 49 9.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 56 10.6 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 32 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 63 12.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 145 27.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 1 0 0 0 0 2 2 7 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 0 3 2 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 PARALLEL BRIDGES PER LADDER . 3 0 0 2 0 0 0 2 2 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 2 0 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 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 24 A A > 0 0 95 0, 0.0 3,-2.9 0, 0.0 4,-0.2 0.000 360.0 360.0 360.0 -61.9 34.7 51.8 32.1 2 25 A S G > + 0 0 103 1,-0.3 3,-1.2 2,-0.2 4,-0.1 0.667 360.0 74.1 -57.3 -15.3 38.4 52.8 32.2 3 26 A A G >> S+ 0 0 33 1,-0.2 3,-2.1 2,-0.2 4,-0.5 0.820 82.3 68.1 -62.7 -30.9 38.8 50.0 29.7 4 27 A Y G <4 S+ 0 0 9 -3,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.604 82.2 75.3 -67.5 -9.5 37.2 52.4 27.2 5 28 A Q G <4 S+ 0 0 133 -3,-1.2 -1,-0.3 -4,-0.2 -2,-0.2 0.620 98.0 44.3 -79.1 -11.4 40.4 54.4 27.5 6 29 A R T <4 S+ 0 0 178 -3,-2.1 198,-0.6 -4,-0.1 197,-0.5 0.560 83.8 130.9-101.1 -12.8 42.2 51.8 25.4 7 30 A F B < -A 202 0A 8 -4,-0.5 195,-0.2 196,-0.2 75,-0.1 -0.160 46.1-153.4 -47.3 113.3 39.4 51.5 22.8 8 31 A E > - 0 0 78 193,-2.5 4,-2.5 1,-0.2 3,-0.4 -0.827 5.1-159.1 -96.3 107.9 40.7 51.8 19.2 9 32 A P H > S+ 0 0 16 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.882 92.7 51.2 -48.4 -46.5 38.0 53.1 16.8 10 33 A R H > S+ 0 0 118 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.867 111.6 47.0 -64.5 -35.5 39.8 51.7 13.7 11 34 A A H > S+ 0 0 17 -3,-0.4 4,-1.8 2,-0.2 191,-0.2 0.874 112.7 50.3 -74.0 -33.6 40.1 48.3 15.3 12 35 A Y H X S+ 0 0 8 -4,-2.5 4,-1.6 189,-0.2 5,-0.3 0.976 112.6 45.4 -64.2 -55.4 36.4 48.4 16.3 13 36 A L H >X S+ 0 0 0 -4,-2.9 4,-3.2 1,-0.2 3,-0.5 0.932 113.9 49.8 -50.2 -53.1 35.3 49.4 12.8 14 37 A R H 3X S+ 0 0 179 -4,-2.2 4,-0.7 -5,-0.2 -1,-0.2 0.880 111.1 50.4 -52.7 -40.8 37.5 46.7 11.3 15 38 A N H 3< S+ 0 0 26 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.772 128.2 17.1 -74.1 -28.0 36.1 44.1 13.7 16 39 A N H << S+ 0 0 22 -4,-1.6 -2,-0.2 -3,-0.5 -3,-0.2 0.590 128.3 40.2-123.2 -16.8 32.4 44.8 13.1 17 40 A Y H < S+ 0 0 8 -4,-3.2 -3,-0.2 -5,-0.3 -2,-0.1 0.204 99.8 71.0-129.3 14.1 31.9 46.8 9.8 18 41 A A S >X S- 0 0 28 -4,-0.7 4,-1.7 -5,-0.3 3,-0.6 -0.835 93.7 -26.0-120.5 163.3 34.4 45.2 7.4 19 42 A P T 34 S+ 0 0 103 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.152 122.2 23.5 -50.2 148.4 34.1 41.8 5.9 20 43 A P T >4 S+ 0 0 65 0, 0.0 3,-1.6 0, 0.0 219,-0.1 -0.936 139.5 27.6 -78.8 -29.2 32.7 39.4 6.8 21 44 A R T <4 S+ 0 0 14 -3,-0.6 10,-0.5 1,-0.3 -5,-0.1 0.769 125.8 50.5 -67.1 -25.4 30.2 41.2 9.0 22 45 A G T 3< S+ 0 0 9 -4,-1.7 2,-0.9 -8,-0.2 -1,-0.3 0.419 80.6 108.1 -91.8 0.6 30.5 44.3 6.8 23 46 A D < - 0 0 85 -3,-1.6 3,-0.3 -5,-0.3 8,-0.2 -0.705 45.1-178.8 -79.6 109.3 29.9 42.4 3.6 24 47 A L + 0 0 6 -2,-0.9 -1,-0.2 1,-0.2 5,-0.1 0.456 56.9 91.5 -89.7 -0.5 26.4 43.6 2.7 25 48 A a S S+ 0 0 16 3,-0.1 359,-0.2 2,-0.0 -1,-0.2 0.927 74.5 69.4 -64.7 -45.0 25.9 41.5 -0.5 26 49 A N S > S- 0 0 77 -3,-0.3 3,-1.4 1,-0.1 357,-0.0 -0.628 73.8-152.5 -76.2 120.8 24.3 38.5 1.2 27 50 A P T 3 S+ 0 0 80 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.697 90.0 66.8 -69.7 -19.7 20.8 39.6 2.5 28 51 A N T 3 S+ 0 0 129 4,-0.1 2,-0.1 5,-0.0 -2,-0.1 0.303 82.8 105.4 -81.7 5.7 20.9 37.0 5.3 29 52 A G S <> S- 0 0 9 -3,-1.4 4,-1.7 -5,-0.1 5,-0.1 -0.343 82.6-111.9 -86.3 170.5 23.8 38.9 7.0 30 53 A V H > S+ 0 0 10 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.848 111.6 56.7 -71.3 -36.7 23.6 41.1 10.1 31 54 A G H > S+ 0 0 1 -10,-0.5 4,-2.6 2,-0.2 5,-0.2 0.961 110.5 42.5 -61.0 -54.0 24.3 44.4 8.3 32 55 A P H > S+ 0 0 3 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.902 112.9 54.7 -59.5 -40.4 21.4 44.1 5.9 33 56 A W H X S+ 0 0 32 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.947 110.4 45.9 -58.0 -48.6 19.1 42.9 8.7 34 57 A K H X S+ 0 0 8 -4,-2.6 4,-2.5 1,-0.2 3,-0.2 0.964 112.6 48.9 -58.0 -54.8 20.0 46.0 10.8 35 58 A L H X S+ 0 0 2 -4,-2.6 4,-3.1 1,-0.2 -1,-0.2 0.862 110.2 54.3 -54.7 -35.8 19.5 48.4 7.9 36 59 A R H X S+ 0 0 73 -4,-2.4 4,-3.2 -5,-0.2 5,-0.3 0.909 106.8 48.2 -66.3 -43.7 16.2 46.7 7.2 37 60 A C H X S+ 0 0 2 -4,-2.1 4,-2.1 -3,-0.2 -2,-0.2 0.945 115.5 46.6 -61.5 -48.1 14.8 47.2 10.7 38 61 A L H X S+ 0 0 3 -4,-2.5 4,-2.1 -5,-0.2 5,-0.2 0.979 116.9 42.9 -55.8 -55.9 15.9 50.8 10.6 39 62 A A H X S+ 0 0 7 -4,-3.1 4,-2.3 1,-0.2 -2,-0.2 0.885 113.1 50.5 -60.7 -45.3 14.4 51.3 7.1 40 63 A Q H X S+ 0 0 81 -4,-3.2 4,-0.8 -5,-0.2 -1,-0.2 0.907 110.0 52.0 -62.3 -40.2 11.2 49.5 7.7 41 64 A T H >< S+ 0 0 7 -4,-2.1 3,-1.2 -5,-0.3 5,-0.5 0.961 112.9 41.3 -63.3 -54.7 10.5 51.4 10.9 42 65 A F H >< S+ 0 0 3 -4,-2.1 3,-1.9 1,-0.2 5,-0.2 0.854 106.0 66.0 -60.6 -34.3 10.9 54.9 9.4 43 66 A A H 3< S+ 0 0 81 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.735 87.5 69.9 -62.5 -21.4 9.0 53.8 6.3 44 67 A T T << S- 0 0 64 -3,-1.2 -1,-0.3 -4,-0.8 -2,-0.2 0.749 99.8-137.0 -65.9 -24.4 5.9 53.4 8.4 45 68 A G S < S+ 0 0 45 -3,-1.9 -3,-0.1 -4,-0.3 -2,-0.1 0.477 76.5 106.2 83.1 3.7 5.9 57.2 8.8 46 69 A E + 0 0 98 -5,-0.5 2,-0.8 1,-0.2 -4,-0.1 0.620 62.9 70.1 -93.3 -11.8 5.1 57.1 12.5 47 70 A V S S+ 0 0 2 -6,-0.3 2,-0.3 -5,-0.2 -1,-0.2 -0.777 73.9 131.8-108.6 88.5 8.5 58.1 13.7 48 71 A S + 0 0 64 -2,-0.8 2,-0.3 105,-0.1 23,-0.1 -0.895 10.5 109.9-140.9 163.4 8.9 61.7 12.8 49 72 A G - 0 0 36 21,-1.1 23,-0.4 -2,-0.3 3,-0.1 -0.977 64.3 -81.5 160.4-164.7 9.8 65.2 14.1 50 73 A R S S+ 0 0 119 -2,-0.3 23,-2.7 21,-0.2 2,-0.3 0.810 99.4 39.6-101.1 -40.1 12.4 67.9 13.9 51 74 A T E +b 73 0B 6 21,-0.2 102,-1.0 20,-0.1 103,-0.5 -0.850 55.5 176.3-122.6 154.9 15.2 66.7 16.1 52 75 A L E -b 74 0B 0 21,-2.1 23,-2.9 -2,-0.3 2,-0.4 -0.997 14.4-149.8-153.8 144.9 16.9 63.4 17.0 53 76 A I E -bc 75 155B 1 101,-1.7 103,-2.4 -2,-0.3 2,-0.6 -0.977 6.6-150.4-126.2 129.6 19.8 62.2 19.1 54 77 A D E > -bc 76 156B 0 21,-3.1 23,-1.1 -2,-0.4 2,-0.6 -0.876 20.6-145.1 -98.5 118.7 22.1 59.3 18.5 55 78 A I T 3 S- 0 0 0 101,-3.7 103,-0.5 -2,-0.6 105,-0.1 -0.746 75.0 -6.8 -92.0 118.5 23.3 57.9 21.8 56 79 A G T 3 S+ 0 0 2 -2,-0.6 -1,-0.3 101,-0.1 22,-0.2 0.972 73.7 177.3 66.2 54.3 26.8 56.5 21.9 57 80 A S X - 0 0 0 20,-2.8 3,-1.4 -3,-0.6 21,-0.2 0.775 12.3-171.8 -59.6 -30.8 27.3 56.8 18.2 58 81 A G T 3 - 0 0 0 19,-0.6 -1,-0.2 1,-0.2 29,-0.2 -0.418 61.1 -42.5 62.6-146.3 30.9 55.6 18.4 59 82 A P T 3 S+ 0 0 3 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 0.009 114.8 102.4 -95.9 24.8 32.7 56.0 15.1 60 83 A T < + 0 0 0 -3,-1.4 27,-0.1 1,-0.1 40,-0.0 -0.846 39.4 174.5-119.2 152.9 29.7 54.7 13.1 61 84 A V > + 0 0 0 -2,-0.3 3,-2.5 467,-0.1 4,-0.5 0.498 58.4 96.6-124.9 -9.9 27.0 56.4 11.0 62 85 A Y G > S+ 0 0 1 1,-0.3 3,-0.9 2,-0.2 4,-0.4 0.774 77.0 68.3 -56.9 -27.2 25.0 53.5 9.5 63 86 A Q G 3 S+ 0 0 2 1,-0.2 -1,-0.3 -6,-0.1 4,-0.1 0.573 103.3 43.4 -72.8 -6.9 22.5 53.8 12.3 64 87 A L G <> S+ 0 0 0 -3,-2.5 4,-3.0 2,-0.1 -1,-0.2 0.455 82.8 98.5-113.7 -3.8 21.3 57.2 10.9 65 88 A L T <4 S+ 0 0 0 -3,-0.9 4,-0.3 -4,-0.5 -2,-0.1 0.910 96.5 30.2 -55.8 -51.0 21.1 56.5 7.1 66 89 A S T 4 S+ 0 0 4 -4,-0.4 3,-0.4 1,-0.2 -1,-0.3 0.727 120.1 58.4 -78.5 -21.0 17.4 55.8 7.0 67 90 A A T >4 S+ 0 0 0 1,-0.2 3,-2.5 2,-0.1 4,-0.4 0.885 87.5 72.0 -74.6 -38.5 16.8 58.3 9.9 68 91 A C G >< S+ 0 0 0 -4,-3.0 3,-0.5 1,-0.3 -1,-0.2 0.696 89.4 61.1 -58.7 -21.2 18.4 61.4 8.4 69 92 A S G 3 S+ 0 0 34 -3,-0.4 -1,-0.3 -4,-0.3 -2,-0.1 0.396 106.3 46.7 -87.4 7.0 15.5 61.9 5.9 70 93 A H G < S+ 0 0 47 -3,-2.5 -21,-1.1 1,-0.2 2,-0.3 0.350 109.5 51.5-123.4 0.5 12.9 62.3 8.7 71 94 A F < - 0 0 0 -3,-0.5 -1,-0.2 -4,-0.4 -21,-0.2 -0.939 54.0-166.0-147.8 118.2 14.8 64.7 11.1 72 95 A E S S+ 0 0 99 -23,-0.4 2,-0.5 -2,-0.3 -21,-0.2 0.709 83.9 51.5 -79.4 -20.9 16.3 68.1 10.1 73 96 A D E +b 51 0B 13 -23,-2.7 -21,-2.1 55,-0.1 2,-0.5 -0.925 69.4 175.3-122.1 107.9 18.3 68.4 13.3 74 97 A I E -bd 52 128B 0 53,-2.9 55,-2.5 -2,-0.5 56,-0.9 -0.945 12.2-164.9-118.9 131.1 20.4 65.5 14.3 75 98 A T E -bd 53 130B 1 -23,-2.9 -21,-3.1 -2,-0.5 2,-0.3 -0.957 6.3-161.8-113.0 126.9 22.8 65.3 17.2 76 99 A M E -bd 54 131B 0 54,-2.7 56,-2.8 -2,-0.5 2,-0.3 -0.832 13.2-170.8-105.5 151.0 25.4 62.6 17.4 77 100 A T E + d 0 132B 0 -23,-1.1 -20,-2.8 -2,-0.3 -19,-0.6 -0.921 15.4 167.9-135.7 157.8 27.2 61.6 20.6 78 101 A D E - d 0 133B 0 54,-1.8 56,-0.6 -2,-0.3 6,-0.1 -0.888 34.1-135.1-165.5 156.2 29.9 59.6 22.2 79 102 A F S S+ 0 0 78 -2,-0.3 2,-0.3 54,-0.2 -1,-0.1 0.858 87.8 71.7 -71.7 -35.6 31.8 59.2 25.5 80 103 A L > - 0 0 6 1,-0.1 4,-1.5 53,-0.1 3,-0.3 -0.651 67.2-149.6 -91.9 136.3 35.2 59.0 23.8 81 104 A E H > S+ 0 0 98 -2,-0.3 4,-2.5 1,-0.2 5,-0.2 0.890 98.6 61.8 -61.1 -40.6 37.0 62.0 22.2 82 105 A V H > S+ 0 0 65 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.817 105.6 45.9 -60.4 -33.4 38.7 59.6 19.7 83 106 A N H > S+ 0 0 0 -3,-0.3 4,-2.8 2,-0.2 -1,-0.2 0.871 109.7 52.6 -75.4 -40.1 35.3 58.5 18.3 84 107 A R H X S+ 0 0 45 -4,-1.5 4,-1.7 1,-0.2 -2,-0.2 0.875 111.1 49.3 -63.9 -34.1 34.0 62.0 18.0 85 108 A Q H X S+ 0 0 94 -4,-2.5 4,-1.7 2,-0.2 -1,-0.2 0.895 110.2 50.5 -67.5 -40.4 37.2 62.8 16.1 86 109 A E H X S+ 0 0 11 -4,-1.4 4,-1.0 1,-0.2 12,-0.3 0.896 108.7 50.7 -69.5 -40.4 36.6 59.8 13.9 87 110 A L H >X S+ 0 0 2 -4,-2.8 4,-3.1 1,-0.2 3,-0.7 0.900 107.7 54.5 -55.7 -44.0 33.0 60.8 13.1 88 111 A G H 3X S+ 0 0 15 -4,-1.7 4,-3.3 1,-0.3 6,-0.4 0.885 98.9 61.7 -62.2 -39.0 34.2 64.3 12.2 89 112 A R H 3<>S+ 0 0 64 -4,-1.7 5,-1.8 1,-0.2 8,-0.3 0.847 113.0 37.1 -54.0 -35.9 36.6 62.8 9.7 90 113 A W H X<5S+ 0 0 9 -4,-1.0 3,-1.1 -3,-0.7 -2,-0.2 0.891 115.3 53.3 -83.2 -42.5 33.6 61.3 7.9 91 114 A L H 3<5S+ 0 0 15 -4,-3.1 -2,-0.2 1,-0.3 -3,-0.2 0.897 118.2 35.7 -57.6 -42.8 31.3 64.3 8.5 92 115 A Q T 3<5S- 0 0 130 -4,-3.3 -1,-0.3 -5,-0.2 -2,-0.2 0.280 108.6-122.6 -95.9 8.8 33.8 66.8 7.0 93 116 A E T < 5 + 0 0 139 -3,-1.1 -3,-0.2 -5,-0.2 -4,-0.1 0.860 54.0 168.0 51.0 38.9 35.0 64.3 4.4 94 117 A E > < - 0 0 90 -5,-1.8 3,-1.1 -6,-0.4 2,-0.1 -0.148 43.0 -69.4 -73.4 173.4 38.5 64.7 5.8 95 118 A P T 3 S+ 0 0 118 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 -0.410 116.3 19.8 -67.0 140.6 41.5 62.4 5.0 96 119 A G T 3 S+ 0 0 58 1,-0.2 -6,-0.1 -2,-0.1 3,-0.1 0.576 83.0 160.9 81.4 11.1 41.4 58.8 6.3 97 120 A A < - 0 0 35 -3,-1.1 -1,-0.2 -8,-0.3 2,-0.2 -0.185 47.0-101.0 -62.3 155.9 37.7 58.8 6.9 98 121 A F - 0 0 29 -12,-0.3 2,-1.0 -39,-0.1 -1,-0.1 -0.536 35.3-116.7 -76.9 147.8 36.0 55.4 7.1 99 122 A N + 0 0 99 -2,-0.2 3,-0.3 1,-0.2 4,-0.1 -0.748 42.6 162.2 -93.4 102.9 34.2 54.2 4.0 100 123 A W >> + 0 0 2 -2,-1.0 4,-2.0 1,-0.2 3,-1.6 0.416 42.3 109.8 -91.4 0.5 30.5 53.9 4.7 101 124 A S H 3> S+ 0 0 13 1,-0.3 4,-2.8 2,-0.2 5,-0.2 0.760 72.3 57.0 -59.4 -31.0 29.5 53.9 1.1 102 125 A M H 3> S+ 0 0 61 -3,-0.3 4,-2.2 2,-0.2 -1,-0.3 0.896 110.6 45.8 -61.4 -37.9 28.5 50.3 1.0 103 126 A Y H <> S+ 0 0 6 -3,-1.6 4,-2.5 2,-0.2 -2,-0.2 0.917 112.3 49.6 -72.5 -44.5 26.0 51.0 3.8 104 127 A S H X S+ 0 0 0 -4,-2.0 4,-2.6 2,-0.2 5,-0.2 0.962 111.9 49.4 -51.8 -56.2 24.7 54.1 2.2 105 128 A Q H X S+ 0 0 7 -4,-2.8 4,-2.7 1,-0.2 -2,-0.2 0.906 112.1 47.8 -52.4 -46.9 24.2 52.2 -1.1 106 129 A H H X S+ 0 0 13 -4,-2.2 4,-3.2 1,-0.2 -1,-0.2 0.870 108.9 52.8 -69.2 -33.7 22.4 49.4 0.7 107 130 A A H X S+ 0 0 0 -4,-2.5 4,-3.1 2,-0.2 -1,-0.2 0.912 111.7 46.9 -63.1 -44.5 20.1 51.8 2.6 108 131 A C H X>S+ 0 0 2 -4,-2.6 4,-2.0 2,-0.2 5,-0.6 0.932 112.9 50.3 -60.7 -45.7 19.2 53.4 -0.7 109 132 A L H <5S+ 0 0 16 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.957 115.8 41.5 -53.0 -56.8 18.7 49.9 -2.1 110 133 A I H <5S+ 0 0 53 -4,-3.2 -2,-0.2 1,-0.2 -1,-0.2 0.929 110.9 54.4 -61.1 -52.1 16.4 48.9 0.8 111 134 A E H <5S- 0 0 35 -4,-3.1 -1,-0.2 -5,-0.2 -2,-0.2 0.861 91.9-153.9 -55.2 -37.4 14.5 52.1 1.1 112 135 A G T <5 + 0 0 54 -4,-2.0 -3,-0.1 -5,-0.2 -1,-0.1 0.892 53.5 124.2 69.0 42.3 13.6 51.8 -2.6 113 136 A K S > - 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