==== 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 3KPU . 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) . 20407.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 376 71.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 48 9.1 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 . 34 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 61 11.6 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 . 9 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 0 0 0 0 2 1 8 2 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 2 2 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 0 102 0, 0.0 3,-0.2 0, 0.0 205,-0.0 0.000 360.0 360.0 360.0 -42.3 34.7 52.3 32.2 2 25 A S > + 0 0 101 1,-0.2 3,-1.8 2,-0.1 4,-0.2 0.722 360.0 72.8 -77.7 -24.9 38.4 52.9 32.3 3 26 A A G > S+ 0 0 35 1,-0.3 3,-2.1 2,-0.2 4,-0.4 0.845 81.5 69.6 -57.6 -34.3 38.6 50.1 29.7 4 27 A Y G 3 S+ 0 0 10 1,-0.3 -1,-0.3 -3,-0.2 3,-0.2 0.547 81.4 77.2 -67.3 -2.4 37.2 52.5 27.0 5 28 A Q G < S+ 0 0 128 -3,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.669 95.8 44.5 -81.8 -15.9 40.4 54.4 27.1 6 29 A R S < S+ 0 0 172 -3,-2.1 198,-0.6 -4,-0.2 197,-0.5 0.459 82.9 131.3-101.4 -5.6 42.2 51.8 25.0 7 30 A F B -A 202 0A 8 -4,-0.4 195,-0.1 -3,-0.2 75,-0.1 -0.280 47.5-152.1 -51.9 117.1 39.3 51.5 22.6 8 31 A E > - 0 0 80 193,-1.6 4,-2.5 1,-0.2 3,-0.3 -0.854 4.8-155.8-101.0 108.2 40.7 51.8 19.1 9 32 A P H > S+ 0 0 16 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.855 93.8 47.3 -46.8 -46.9 38.1 53.3 16.6 10 33 A R H > S+ 0 0 118 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.888 110.8 51.0 -69.1 -37.3 39.8 51.7 13.5 11 34 A A H > S+ 0 0 16 -3,-0.3 4,-2.8 2,-0.2 -1,-0.2 0.932 111.2 49.0 -63.4 -43.6 40.1 48.2 15.2 12 35 A Y H X S+ 0 0 8 -4,-2.5 4,-1.3 1,-0.2 5,-0.3 0.917 112.9 47.6 -60.8 -42.6 36.4 48.4 16.1 13 36 A L H X>S+ 0 0 1 -4,-2.3 4,-2.2 -5,-0.2 5,-0.6 0.868 113.2 48.2 -67.3 -37.2 35.5 49.4 12.5 14 37 A R H X5S+ 0 0 188 -4,-2.5 4,-0.9 1,-0.2 -2,-0.2 0.943 112.1 49.3 -64.7 -48.0 37.6 46.6 11.1 15 38 A N H <5S+ 0 0 30 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.705 128.7 17.8 -64.7 -26.1 36.1 44.0 13.5 16 39 A N H <5S+ 0 0 24 -4,-1.3 -1,-0.2 -5,-0.2 -2,-0.2 0.632 127.7 38.3-125.5 -22.8 32.5 44.9 12.8 17 40 A Y H <5S+ 0 0 11 -4,-2.2 -3,-0.2 -5,-0.3 -2,-0.1 0.476 99.5 74.1-121.7 -3.9 32.0 46.8 9.6 18 41 A A S X4 S+ 0 0 66 0, 0.0 3,-1.6 0, 0.0 219,-0.1 -0.939 135.6 28.8 -78.0 -27.3 32.6 39.3 6.7 21 44 A R T 34 S+ 0 0 15 -3,-0.5 10,-0.9 1,-0.3 -4,-0.1 0.816 127.6 47.0 -63.1 -31.1 30.1 41.2 9.0 22 45 A G T 3< S+ 0 0 8 -4,-1.9 2,-1.2 -8,-0.2 -1,-0.3 0.236 76.3 119.3 -95.5 11.3 30.2 44.2 6.7 23 46 A D X - 0 0 69 -3,-1.6 3,-0.8 -5,-0.3 6,-0.2 -0.668 41.7-174.7 -74.8 103.2 29.7 42.3 3.4 24 47 A L T 3 + 0 0 12 -2,-1.2 -1,-0.2 1,-0.2 5,-0.1 0.638 67.3 80.3 -79.8 -8.5 26.5 43.9 2.4 25 48 A a T 3 S+ 0 0 21 -3,-0.1 359,-0.3 1,-0.1 -1,-0.2 0.798 78.4 75.7 -67.3 -29.3 26.1 41.6 -0.7 26 49 A N X - 0 0 46 -3,-0.8 3,-1.6 1,-0.1 5,-0.1 -0.779 68.4-159.1 -88.9 115.6 24.7 38.7 1.5 27 50 A P T 3 S+ 0 0 73 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.659 89.2 59.7 -67.2 -18.8 21.1 39.5 2.4 28 51 A N T 3 S+ 0 0 120 4,-0.1 2,-0.1 5,-0.0 -3,-0.0 0.354 86.0 105.6 -93.2 6.1 21.2 37.1 5.4 29 52 A G S <> S- 0 0 4 -3,-1.6 4,-2.0 -6,-0.2 5,-0.2 -0.369 82.2-111.7 -84.4 165.7 24.1 38.9 7.1 30 53 A V H > S+ 0 0 13 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.895 112.3 58.0 -63.5 -40.6 24.0 41.1 10.2 31 54 A G H > S+ 0 0 3 -10,-0.9 4,-2.5 1,-0.2 5,-0.2 0.970 109.8 40.8 -55.6 -59.9 24.8 44.3 8.2 32 55 A P H > S+ 0 0 0 0, 0.0 4,-3.1 0, 0.0 -1,-0.2 0.904 114.0 54.4 -58.3 -41.9 21.8 44.1 5.8 33 56 A W H X S+ 0 0 31 -4,-2.0 4,-2.7 2,-0.2 5,-0.2 0.940 109.2 47.5 -55.7 -50.9 19.5 42.9 8.6 34 57 A K H X S+ 0 0 10 -4,-2.9 4,-2.2 1,-0.2 -1,-0.2 0.971 114.6 45.8 -54.3 -53.5 20.4 46.0 10.7 35 58 A L H X S+ 0 0 2 -4,-2.5 4,-2.4 1,-0.2 5,-0.2 0.882 111.4 53.9 -59.0 -38.6 19.9 48.3 7.7 36 59 A R H X S+ 0 0 69 -4,-3.1 4,-2.6 -5,-0.2 5,-0.3 0.916 107.5 50.0 -60.7 -44.8 16.6 46.5 6.9 37 60 A C H X S+ 0 0 1 -4,-2.7 4,-1.8 1,-0.2 -2,-0.2 0.924 112.2 47.7 -61.5 -44.5 15.3 47.1 10.4 38 61 A L H X S+ 0 0 2 -4,-2.2 4,-2.0 -5,-0.2 -2,-0.2 0.941 115.9 43.2 -63.4 -46.3 16.1 50.8 10.4 39 62 A A H X S+ 0 0 6 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.928 111.6 50.9 -68.6 -49.7 14.6 51.4 6.9 40 63 A Q H X S+ 0 0 85 -4,-2.6 4,-0.7 -5,-0.2 -1,-0.2 0.934 110.7 52.4 -53.3 -47.4 11.4 49.4 7.3 41 64 A T H ><>S+ 0 0 1 -4,-1.8 3,-1.2 -5,-0.3 5,-0.5 0.934 112.7 41.3 -54.8 -54.6 10.7 51.2 10.6 42 65 A F H ><5S+ 0 0 4 -4,-2.0 3,-1.5 1,-0.3 5,-0.3 0.729 104.4 67.5 -68.5 -22.2 11.1 54.8 9.2 43 66 A A H 3<5S+ 0 0 81 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.695 83.7 74.9 -73.3 -15.4 9.2 53.8 6.0 44 67 A T T <<5S- 0 0 59 -3,-1.2 -1,-0.3 -4,-0.7 -2,-0.2 0.706 98.8-136.2 -64.1 -19.3 6.1 53.4 8.2 45 68 A G T < 5S+ 0 0 50 -3,-1.5 -2,-0.1 -4,-0.2 -3,-0.1 0.605 79.2 107.0 68.6 13.1 6.0 57.2 8.3 46 69 A E < + 0 0 104 -5,-0.5 2,-0.6 1,-0.2 -4,-0.1 0.473 62.0 67.7-101.6 -2.8 5.3 56.9 12.1 47 70 A V S S+ 0 0 2 -5,-0.3 2,-0.3 -6,-0.2 -1,-0.2 -0.883 72.2 122.9-119.9 99.5 8.7 58.1 13.3 48 71 A S + 0 0 64 -2,-0.6 2,-0.3 105,-0.1 23,-0.1 -0.944 13.4 120.9-153.3 165.0 9.2 61.7 12.5 49 72 A G - 0 0 36 21,-1.2 23,-0.3 -2,-0.3 3,-0.1 -0.966 64.0 -81.8 160.6-167.2 9.9 65.1 14.0 50 73 A R S S+ 0 0 120 -2,-0.3 23,-2.5 1,-0.2 22,-0.5 0.796 101.2 38.3 -98.4 -35.4 12.3 68.0 13.8 51 74 A T E -b 73 0B 6 21,-0.2 102,-1.0 20,-0.1 103,-0.9 -0.923 55.6-180.0-130.6 148.2 15.2 66.7 15.9 52 75 A L E -bc 74 154B 0 21,-2.3 23,-2.7 -2,-0.4 2,-0.4 -0.988 11.7-153.7-142.1 143.3 16.9 63.4 16.7 53 76 A I E -bc 75 155B 1 101,-1.9 103,-2.4 -2,-0.3 2,-0.6 -0.984 7.2-151.0-124.2 132.1 19.8 62.3 18.9 54 77 A D E > -bc 76 156B 0 21,-2.8 23,-1.0 -2,-0.4 2,-0.6 -0.874 19.1-146.7 -99.7 119.5 22.1 59.3 18.3 55 78 A I T 3 S- 0 0 0 101,-3.5 103,-0.5 -2,-0.6 106,-0.1 -0.770 74.6 -2.2 -97.5 119.1 23.3 57.9 21.6 56 79 A G T 3 S+ 0 0 0 -2,-0.6 -1,-0.3 101,-0.1 22,-0.2 0.950 74.3 175.2 69.9 51.6 26.8 56.4 21.7 57 80 A S X - 0 0 0 20,-3.1 3,-1.4 -3,-0.5 21,-0.2 0.783 10.1-176.1 -59.8 -32.6 27.4 56.9 18.0 58 81 A G T 3 - 0 0 0 19,-0.5 -1,-0.2 1,-0.2 29,-0.2 -0.375 61.9 -42.2 59.4-143.7 31.0 55.7 18.2 59 82 A P T 3 S+ 0 0 2 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 -0.025 113.8 100.4-103.1 27.7 32.8 56.1 14.8 60 83 A T < + 0 0 0 -3,-1.4 27,-0.0 1,-0.1 40,-0.0 -0.875 38.6 174.3-120.8 150.1 29.8 54.8 12.8 61 84 A V > + 0 0 0 -2,-0.3 3,-2.7 2,-0.1 4,-0.4 0.536 58.9 95.6-123.9 -14.8 27.2 56.6 10.7 62 85 A Y G > S+ 0 0 1 1,-0.3 3,-1.0 2,-0.2 4,-0.4 0.718 75.7 69.8 -53.8 -26.4 25.2 53.8 9.0 63 86 A Q G 3 S+ 0 0 1 1,-0.2 -1,-0.3 -6,-0.1 4,-0.1 0.558 101.9 43.9 -74.2 -6.8 22.6 54.0 11.9 64 87 A L G <> S+ 0 0 0 -3,-2.7 4,-2.5 2,-0.1 -1,-0.2 0.385 84.6 97.8-114.1 -0.3 21.4 57.3 10.7 65 88 A L T <4 S+ 0 0 0 -3,-1.0 4,-0.2 -4,-0.4 -2,-0.1 0.930 94.7 30.8 -55.1 -54.0 21.3 56.6 6.9 66 89 A S T >4 S+ 0 0 3 -4,-0.4 3,-0.6 1,-0.2 -1,-0.2 0.782 121.0 55.1 -76.3 -27.0 17.5 55.8 6.7 67 90 A A G >4 S+ 0 0 1 1,-0.2 3,-2.6 2,-0.1 4,-0.5 0.837 86.5 78.2 -74.3 -34.9 16.7 58.2 9.5 68 91 A C G 3< S+ 0 0 0 -4,-2.5 3,-0.2 1,-0.3 -1,-0.2 0.608 86.8 58.9 -60.9 -15.3 18.3 61.4 8.1 69 92 A S G < S+ 0 0 32 -3,-0.6 -1,-0.3 -4,-0.2 -2,-0.1 0.424 104.7 50.5 -94.2 2.3 15.4 62.1 5.7 70 93 A H S < S+ 0 0 44 -3,-2.6 -21,-1.2 1,-0.2 2,-0.4 0.391 109.9 51.1-111.9 -1.9 12.8 62.3 8.5 71 94 A F - 0 0 1 -4,-0.5 -1,-0.2 -3,-0.2 -21,-0.2 -0.982 54.1-168.2-142.2 127.6 14.8 64.7 10.8 72 95 A E S S+ 0 0 99 -22,-0.5 2,-0.6 -2,-0.4 -21,-0.2 0.728 82.2 51.9 -86.6 -24.9 16.3 68.1 9.9 73 96 A D E +b 51 0B 15 -23,-2.5 -21,-2.3 55,-0.1 2,-0.4 -0.950 69.3 177.5-117.4 113.8 18.3 68.5 13.1 74 97 A I E -bd 52 128B 0 53,-2.7 55,-1.8 -2,-0.6 56,-1.1 -0.955 12.4-163.5-120.2 131.9 20.5 65.6 14.1 75 98 A T E -bd 53 130B 0 -23,-2.7 -21,-2.8 -2,-0.4 2,-0.4 -0.954 6.3-161.3-111.9 128.5 22.9 65.4 17.1 76 99 A M E -bd 54 131B 0 54,-2.8 56,-3.3 -2,-0.5 2,-0.3 -0.860 15.1-176.7-106.6 148.0 25.6 62.7 17.2 77 100 A T E + d 0 132B 0 -23,-1.0 -20,-3.1 -2,-0.4 -19,-0.5 -0.945 13.8 162.8-141.0 156.9 27.2 61.7 20.5 78 101 A D E - d 0 133B 0 54,-2.0 56,-1.2 -2,-0.3 6,-0.0 -0.951 38.2-126.5-167.4 163.5 29.9 59.6 22.1 79 102 A F S S+ 0 0 76 -2,-0.3 2,-0.3 54,-0.2 -1,-0.1 0.813 88.6 70.4 -79.1 -34.3 31.9 59.1 25.3 80 103 A L > - 0 0 10 1,-0.1 4,-1.7 53,-0.0 5,-0.1 -0.686 67.2-147.0 -94.4 140.4 35.4 59.1 23.6 81 104 A E H > S+ 0 0 102 -2,-0.3 4,-2.2 2,-0.2 5,-0.2 0.919 100.5 58.4 -62.5 -46.7 37.1 62.0 22.0 82 105 A V H > S+ 0 0 62 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.889 106.1 49.0 -54.3 -42.0 38.7 59.7 19.3 83 106 A N H > S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.935 108.8 52.1 -62.7 -45.7 35.3 58.5 18.2 84 107 A R H X S+ 0 0 46 -4,-1.7 4,-2.6 1,-0.2 -1,-0.2 0.859 111.5 47.9 -58.5 -34.8 34.0 62.1 17.9 85 108 A Q H X S+ 0 0 88 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.858 107.4 54.5 -74.9 -36.4 37.1 63.0 15.8 86 109 A E H X S+ 0 0 11 -4,-2.1 4,-1.2 -5,-0.2 12,-0.3 0.907 111.2 46.6 -63.4 -40.2 36.6 59.9 13.6 87 110 A L H >X S+ 0 0 2 -4,-2.5 4,-2.9 2,-0.2 3,-0.9 0.964 108.2 55.1 -62.2 -54.5 33.0 61.2 13.0 88 111 A G H 3X S+ 0 0 19 -4,-2.6 4,-2.7 1,-0.3 6,-0.3 0.891 104.3 57.1 -40.9 -46.3 34.3 64.7 12.3 89 112 A R H 3<>S+ 0 0 69 -4,-2.3 5,-1.7 1,-0.2 8,-0.3 0.843 111.9 38.6 -61.9 -37.1 36.5 63.2 9.7 90 113 A W H X<5S+ 0 0 8 -4,-1.2 3,-0.6 -3,-0.9 -1,-0.2 0.831 115.7 52.3 -81.9 -34.4 33.7 61.6 7.7 91 114 A L H 3<5S+ 0 0 19 -4,-2.9 -2,-0.2 1,-0.2 -3,-0.2 0.889 116.2 39.4 -66.4 -38.9 31.3 64.5 8.2 92 115 A Q T 3<5S- 0 0 129 -4,-2.7 -1,-0.2 -5,-0.3 -2,-0.2 0.330 107.9-123.3 -93.1 5.7 33.9 67.0 6.9 93 116 A E T < 5 + 0 0 141 -3,-0.6 -3,-0.2 -5,-0.2 -4,-0.1 0.830 54.1 167.5 52.5 32.7 35.0 64.7 4.2 94 117 A E > < - 0 0 90 -5,-1.7 3,-1.0 -6,-0.3 -1,-0.1 -0.186 42.9 -73.8 -68.6 168.7 38.5 65.1 5.7 95 118 A P T 3 S+ 0 0 118 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.340 113.1 17.1 -70.6 146.3 41.3 62.7 4.7 96 119 A G T 3 S+ 0 0 56 1,-0.2 -6,-0.1 -3,-0.1 3,-0.1 0.666 84.2 156.5 70.4 16.2 41.5 59.1 5.9 97 120 A A < - 0 0 28 -3,-1.0 -1,-0.2 -8,-0.3 2,-0.1 -0.344 53.1 -92.4 -65.6 155.5 37.8 59.2 6.9 98 121 A F - 0 0 40 -12,-0.3 2,-0.8 -39,-0.1 -1,-0.1 -0.419 38.3-118.8 -67.5 147.7 36.2 55.8 7.0 99 122 A N + 0 0 98 1,-0.1 3,-0.2 -2,-0.1 4,-0.1 -0.806 39.5 165.6 -95.5 105.3 34.4 54.7 3.8 100 123 A W >> + 0 0 2 -2,-0.8 4,-2.0 1,-0.2 3,-1.3 0.371 42.8 110.1 -96.6 5.0 30.7 54.3 4.5 101 124 A S H 3> S+ 0 0 13 1,-0.3 4,-3.0 2,-0.2 5,-0.2 0.848 70.9 57.1 -59.2 -44.6 29.7 54.2 0.8 102 125 A M H 3> S+ 0 0 64 -3,-0.2 4,-1.5 1,-0.2 -1,-0.3 0.863 112.0 44.9 -45.8 -42.5 28.8 50.5 0.6 103 126 A Y H <> S+ 0 0 7 -3,-1.3 4,-2.4 2,-0.2 -2,-0.2 0.885 111.2 50.8 -74.6 -44.1 26.3 51.2 3.5 104 127 A S H X S+ 0 0 0 -4,-2.0 4,-2.4 1,-0.2 5,-0.2 0.929 111.5 50.4 -53.8 -48.0 24.9 54.4 1.9 105 128 A Q H X S+ 0 0 9 -4,-3.0 4,-2.3 1,-0.2 -2,-0.2 0.903 110.4 49.0 -57.7 -41.9 24.4 52.4 -1.3 106 129 A H H X S+ 0 0 19 -4,-1.5 4,-3.0 -5,-0.2 -1,-0.2 0.838 109.0 51.5 -75.5 -32.5 22.6 49.6 0.5 107 130 A A H X S+ 0 0 0 -4,-2.4 4,-2.8 2,-0.2 -1,-0.2 0.926 111.0 48.6 -65.1 -44.8 20.3 52.0 2.3 108 131 A C H X>S+ 0 0 1 -4,-2.4 4,-1.3 2,-0.2 5,-0.6 0.914 113.7 49.2 -58.8 -41.0 19.4 53.6 -1.0 109 132 A L H <5S+ 0 0 16 -4,-2.3 3,-0.4 -5,-0.2 -2,-0.2 0.959 115.2 41.1 -60.7 -54.0 18.9 50.1 -2.3 110 133 A I H <5S+ 0 0 50 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.813 109.7 59.5 -67.3 -33.3 16.7 48.9 0.5 111 134 A E H <5S- 0 0 32 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.807 89.2-152.4 -71.0 -28.6 14.7 52.2 0.7 112 135 A G T <5 + 0 0 59 -4,-1.3 -3,-0.1 -3,-0.4 -4,-0.1 0.840 57.1 120.4 63.6 36.8 13.5 51.9 -2.9 113 136 A K S > - 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