==== 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 3KQO . 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) . 20482.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 381 72.3 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 . 41 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 58 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 148 28.1 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 2 0 0 0 0 2 2 7 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 1 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 96 0, 0.0 205,-0.0 0, 0.0 164,-0.0 0.000 360.0 360.0 360.0 -8.5 34.6 52.3 32.0 2 25 A S > + 0 0 102 1,-0.2 3,-1.9 2,-0.1 4,-0.2 0.682 360.0 70.7 -88.5 -23.5 38.4 52.9 31.9 3 26 A A G > S+ 0 0 36 1,-0.3 3,-2.2 2,-0.2 4,-0.3 0.847 85.7 67.8 -59.6 -33.5 38.7 50.0 29.5 4 27 A Y G 3 S+ 0 0 13 1,-0.3 -1,-0.3 2,-0.2 3,-0.2 0.510 83.4 74.3 -67.2 -2.6 37.0 52.3 26.9 5 28 A Q G < S+ 0 0 129 -3,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.635 97.9 45.7 -82.5 -14.1 40.2 54.4 27.1 6 29 A R S < S+ 0 0 176 -3,-2.2 197,-0.5 -4,-0.2 198,-0.5 0.384 82.6 129.8-104.6 -1.2 42.0 51.7 25.0 7 30 A F B -A 202 0A 8 -4,-0.3 195,-0.2 -3,-0.2 75,-0.1 -0.402 46.1-155.3 -60.0 116.8 39.1 51.4 22.5 8 31 A E > - 0 0 82 193,-2.1 4,-2.2 -2,-0.3 3,-0.3 -0.852 3.4-157.9 -99.5 106.9 40.5 51.6 19.0 9 32 A P H > S+ 0 0 17 0, 0.0 4,-3.0 0, 0.0 5,-0.2 0.854 91.4 51.0 -52.4 -43.8 37.8 52.8 16.5 10 33 A R H > S+ 0 0 113 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.916 109.7 50.6 -62.7 -41.3 39.5 51.3 13.4 11 34 A A H > S+ 0 0 17 -3,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.905 112.4 47.4 -61.9 -40.2 39.9 47.9 15.1 12 35 A Y H X S+ 0 0 8 -4,-2.2 4,-1.8 2,-0.2 5,-0.3 0.932 112.1 49.0 -65.0 -45.8 36.2 48.1 16.0 13 36 A L H X S+ 0 0 0 -4,-3.0 4,-2.3 1,-0.2 5,-0.5 0.883 112.7 48.4 -60.7 -41.0 35.2 49.1 12.4 14 37 A R H X S+ 0 0 187 -4,-2.9 4,-0.8 -5,-0.2 -1,-0.2 0.919 111.7 50.9 -61.9 -43.6 37.3 46.3 11.0 15 38 A N H < S+ 0 0 28 -4,-2.3 6,-0.2 -5,-0.2 -2,-0.2 0.780 128.3 15.2 -68.3 -30.4 35.7 43.8 13.5 16 39 A N H < S+ 0 0 25 -4,-1.8 -2,-0.2 -5,-0.1 -3,-0.2 0.629 129.3 38.9-121.0 -20.2 32.1 44.7 12.7 17 40 A Y H < S+ 0 0 10 -4,-2.3 -3,-0.2 -5,-0.3 -2,-0.1 0.411 100.0 70.7-124.5 1.4 31.8 46.6 9.5 18 41 A A S X S- 0 0 30 -4,-0.8 4,-1.4 -5,-0.5 3,-0.4 -0.742 96.5 -33.8-103.7 161.9 34.4 45.1 7.2 19 42 A P T 4 S+ 0 0 101 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 -0.186 120.0 29.4 -49.9 149.9 33.8 41.5 5.8 20 43 A P T >4 S+ 0 0 67 0, 0.0 3,-1.5 0, 0.0 219,-0.1 -0.934 139.2 25.9 -79.8 -29.7 32.5 39.1 6.8 21 44 A R T 34 S+ 0 0 11 -3,-0.4 10,-0.5 1,-0.3 -5,-0.1 0.733 125.4 56.7 -62.8 -19.7 30.0 41.0 9.0 22 45 A G T 3< S+ 0 0 9 -4,-1.4 2,-0.5 -8,-0.2 -1,-0.3 0.545 75.6 111.2 -90.1 -9.2 30.5 43.8 6.6 23 46 A D < - 0 0 74 -3,-1.5 8,-0.3 -5,-0.2 3,-0.2 -0.553 40.1-179.8 -69.9 119.5 29.5 41.9 3.4 24 47 A L + 0 0 11 -2,-0.5 -1,-0.2 1,-0.2 5,-0.1 0.546 63.2 83.7 -96.8 -8.6 26.2 43.4 2.3 25 48 A a S S+ 0 0 20 1,-0.1 359,-0.3 358,-0.1 -1,-0.2 0.849 77.9 70.7 -66.2 -37.3 25.7 41.2 -0.8 26 49 A N S > S- 0 0 73 -3,-0.2 3,-1.9 1,-0.1 5,-0.1 -0.754 72.4-152.9 -86.2 118.8 24.2 38.3 1.2 27 50 A P T 3 S+ 0 0 73 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.650 91.7 61.9 -66.2 -16.8 20.7 39.2 2.3 28 51 A N T 3 S+ 0 0 122 4,-0.1 -4,-0.0 5,-0.0 -3,-0.0 0.437 83.5 104.0 -90.4 -0.8 20.9 36.8 5.3 29 52 A G S <> S- 0 0 6 -3,-1.9 4,-1.7 -6,-0.1 5,-0.1 -0.244 82.9-112.5 -75.8 169.6 23.9 38.6 6.8 30 53 A V H > S+ 0 0 8 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.830 110.8 60.3 -75.4 -33.1 23.6 40.9 9.9 31 54 A G H > S+ 0 0 4 -10,-0.5 4,-2.3 -8,-0.3 5,-0.2 0.978 108.9 41.2 -57.1 -59.1 24.5 44.1 8.0 32 55 A P H > S+ 0 0 0 0, 0.0 4,-3.0 0, 0.0 5,-0.2 0.921 113.0 55.9 -58.0 -42.6 21.5 43.9 5.6 33 56 A W H X S+ 0 0 30 -4,-1.7 4,-2.4 1,-0.2 -2,-0.2 0.926 108.9 47.3 -54.4 -47.2 19.2 42.8 8.5 34 57 A K H X S+ 0 0 12 -4,-2.7 4,-2.0 2,-0.2 -1,-0.2 0.938 114.4 44.9 -60.1 -48.1 20.2 45.9 10.5 35 58 A L H X S+ 0 0 2 -4,-2.3 4,-2.7 1,-0.2 -1,-0.2 0.877 111.9 54.4 -63.9 -37.9 19.6 48.2 7.5 36 59 A R H X S+ 0 0 71 -4,-3.0 4,-2.5 -5,-0.2 5,-0.3 0.910 106.7 50.3 -61.3 -46.2 16.4 46.4 6.8 37 60 A C H X S+ 0 0 1 -4,-2.4 4,-1.8 -5,-0.2 -2,-0.2 0.935 113.3 46.0 -59.2 -46.6 15.0 47.0 10.3 38 61 A L H X S+ 0 0 2 -4,-2.0 4,-2.1 2,-0.2 5,-0.2 0.950 114.9 46.2 -63.2 -47.6 15.8 50.7 10.2 39 62 A A H X S+ 0 0 6 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.937 111.4 49.4 -62.3 -51.8 14.3 51.2 6.7 40 63 A Q H X S+ 0 0 75 -4,-2.5 4,-0.7 1,-0.2 -1,-0.2 0.897 110.4 53.1 -55.2 -43.6 11.1 49.3 7.3 41 64 A T H >< S+ 0 0 2 -4,-1.8 3,-1.1 -5,-0.3 5,-0.5 0.951 113.8 39.7 -58.5 -53.3 10.5 51.2 10.5 42 65 A F H >< S+ 0 0 2 -4,-2.1 3,-1.8 1,-0.2 5,-0.3 0.829 105.3 67.5 -67.6 -30.5 10.9 54.7 9.0 43 66 A A H 3< S+ 0 0 83 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.731 86.2 71.8 -64.0 -19.0 9.0 53.6 5.9 44 67 A T T << S- 0 0 65 -3,-1.1 -1,-0.3 -4,-0.7 -2,-0.2 0.793 97.9-137.8 -64.5 -27.8 5.9 53.3 8.1 45 68 A G S < S+ 0 0 48 -3,-1.8 -2,-0.1 -4,-0.3 -3,-0.1 0.574 77.9 106.2 78.1 10.3 5.8 57.1 8.3 46 69 A E + 0 0 99 -5,-0.5 2,-0.7 1,-0.2 -4,-0.1 0.532 64.1 69.8 -96.5 -8.8 5.0 56.8 12.0 47 70 A V S S+ 0 0 1 -5,-0.3 2,-0.3 -6,-0.3 -1,-0.2 -0.842 72.8 128.4-111.8 93.7 8.4 57.9 13.1 48 71 A S + 0 0 63 -2,-0.7 2,-0.3 105,-0.1 23,-0.1 -0.868 11.7 110.6-142.4 170.3 8.7 61.6 12.2 49 72 A G - 0 0 39 21,-0.8 23,-0.3 -2,-0.3 3,-0.1 -0.978 64.2 -82.8 152.2-160.7 9.6 65.0 13.6 50 73 A R S S+ 0 0 118 -2,-0.3 23,-2.5 1,-0.2 2,-0.4 0.727 97.6 40.5-114.7 -35.6 12.2 67.7 13.5 51 74 A T E +b 73 0B 6 21,-0.2 102,-1.4 20,-0.1 103,-0.7 -0.942 56.0 179.4-128.3 146.1 15.0 66.6 15.7 52 75 A L E -bc 74 154B 1 21,-2.3 23,-2.7 -2,-0.4 2,-0.4 -0.999 12.2-154.4-144.5 139.9 16.7 63.3 16.5 53 76 A I E -bc 75 155B 2 101,-1.8 103,-2.3 -2,-0.3 2,-0.6 -0.971 7.8-150.2-119.8 132.6 19.6 62.2 18.7 54 77 A D E > -bc 76 156B 0 21,-3.2 2,-0.6 -2,-0.4 23,-0.6 -0.892 19.0-143.6-100.8 122.6 21.8 59.2 18.1 55 78 A I E 3 S- c 0 157B 0 101,-3.6 103,-0.5 -2,-0.6 106,-0.2 -0.775 74.6 -6.7 -98.3 114.0 23.0 57.7 21.3 56 79 A G T 3 S+ 0 0 1 -2,-0.6 -1,-0.3 101,-0.1 22,-0.2 0.948 71.7 176.1 70.5 50.7 26.5 56.3 21.4 57 80 A S X - 0 0 0 20,-3.0 3,-1.5 -3,-0.5 21,-0.2 0.760 13.3-172.4 -55.4 -28.3 27.2 56.6 17.7 58 81 A G T 3 - 0 0 0 19,-0.6 -1,-0.2 1,-0.2 29,-0.1 -0.348 61.9 -41.3 56.2-147.0 30.7 55.4 18.1 59 82 A P T 3 S+ 0 0 2 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 -0.012 115.7 99.5 -95.6 28.8 32.6 55.8 14.8 60 83 A T < + 0 0 0 -3,-1.5 27,-0.1 1,-0.1 40,-0.0 -0.888 40.2 176.6-124.1 150.7 29.6 54.6 12.7 61 84 A V > + 0 0 1 -2,-0.3 3,-2.3 2,-0.1 4,-0.4 0.490 58.9 96.7-124.3 -10.6 26.9 56.3 10.6 62 85 A Y G > S+ 0 0 1 1,-0.3 3,-1.5 2,-0.2 4,-0.4 0.802 75.2 69.9 -53.0 -32.5 24.9 53.5 9.0 63 86 A Q G 3 S+ 0 0 1 1,-0.3 -1,-0.3 -6,-0.1 4,-0.1 0.627 102.8 42.8 -66.9 -11.6 22.4 53.7 11.8 64 87 A L G <> S+ 0 0 0 -3,-2.3 4,-2.6 2,-0.1 -1,-0.3 0.383 82.8 99.7-111.4 1.1 21.1 57.1 10.5 65 88 A L T <4 S+ 0 0 0 -3,-1.5 4,-0.3 -4,-0.4 -2,-0.1 0.888 95.7 30.8 -58.7 -43.5 21.1 56.3 6.7 66 89 A S T 4 S+ 0 0 4 -4,-0.4 3,-0.4 1,-0.1 -1,-0.2 0.711 118.9 58.3 -85.2 -21.8 17.3 55.7 6.6 67 90 A A T >4 S+ 0 0 0 1,-0.2 3,-2.6 2,-0.1 4,-0.4 0.872 86.2 74.8 -74.8 -38.1 16.6 58.1 9.4 68 91 A C G >< S+ 0 0 0 -4,-2.6 3,-0.7 1,-0.3 -1,-0.2 0.705 87.6 59.3 -59.0 -27.3 18.1 61.3 7.9 69 92 A S G 3 S+ 0 0 36 -3,-0.4 -1,-0.3 -4,-0.3 -2,-0.1 0.430 107.1 49.6 -80.9 2.9 15.3 61.9 5.4 70 93 A H G < S+ 0 0 45 -3,-2.6 -21,-0.8 1,-0.2 2,-0.4 0.448 109.4 50.7-113.8 -5.4 12.8 62.1 8.3 71 94 A F < - 0 0 0 -3,-0.7 -1,-0.2 -4,-0.4 -21,-0.2 -0.972 53.8-166.9-143.5 121.7 14.7 64.6 10.6 72 95 A E S S+ 0 0 102 -2,-0.4 2,-0.6 -22,-0.3 -21,-0.2 0.765 83.1 49.4 -81.8 -26.2 16.1 67.9 9.7 73 96 A D E S+b 51 0B 15 -23,-2.5 -21,-2.3 55,-0.1 2,-0.4 -0.941 70.8 179.4-118.0 112.4 18.2 68.4 12.8 74 97 A I E -bd 52 128B 0 53,-2.9 55,-2.4 -2,-0.6 56,-1.2 -0.924 12.8-163.7-116.2 136.9 20.4 65.4 13.9 75 98 A T E -bd 53 130B 1 -23,-2.7 -21,-3.2 -2,-0.4 2,-0.3 -0.973 6.6-164.4-115.4 121.2 22.7 65.1 16.9 76 99 A M E -bd 54 131B 1 54,-2.6 56,-2.7 -2,-0.5 2,-0.3 -0.737 14.5-174.2 -97.7 155.2 25.3 62.4 16.9 77 100 A T E + d 0 132B 0 -23,-0.6 -20,-3.0 -2,-0.3 -19,-0.6 -0.990 16.1 168.0-146.3 151.2 27.0 61.4 20.2 78 101 A D E - d 0 133B 0 54,-1.9 56,-0.7 -2,-0.3 6,-0.1 -0.948 35.2-132.9-158.5 156.8 29.7 59.4 21.8 79 102 A F S S+ 0 0 71 -2,-0.3 2,-0.3 54,-0.2 -1,-0.1 0.910 89.3 71.6 -67.2 -43.4 31.6 59.0 25.1 80 103 A L > - 0 0 8 1,-0.1 4,-1.4 -3,-0.1 5,-0.1 -0.553 68.4-148.4 -85.7 138.3 35.0 58.9 23.4 81 104 A E H > S+ 0 0 108 -2,-0.3 4,-1.9 2,-0.2 5,-0.2 0.869 99.6 58.5 -64.7 -40.7 36.8 61.8 21.7 82 105 A V H > S+ 0 0 64 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.896 105.8 49.1 -60.6 -39.8 38.5 59.4 19.2 83 106 A N H > S+ 0 0 0 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.873 109.0 52.6 -64.8 -38.0 35.0 58.2 18.0 84 107 A R H X S+ 0 0 47 -4,-1.4 4,-1.9 2,-0.2 -1,-0.2 0.828 110.4 48.7 -67.2 -31.0 33.8 61.8 17.6 85 108 A Q H X S+ 0 0 89 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.887 107.8 53.3 -72.8 -40.9 36.9 62.6 15.5 86 109 A E H X S+ 0 0 10 -4,-2.2 4,-1.1 1,-0.2 12,-0.3 0.893 111.1 47.6 -62.0 -38.5 36.3 59.5 13.3 87 110 A L H >X S+ 0 0 2 -4,-2.0 4,-3.0 2,-0.2 3,-0.5 0.919 108.5 54.3 -64.7 -46.5 32.8 60.8 12.8 88 111 A G H 3X S+ 0 0 19 -4,-1.9 4,-2.8 1,-0.2 6,-0.3 0.890 103.3 57.1 -55.0 -42.4 34.1 64.3 12.0 89 112 A R H 3<>S+ 0 0 65 -4,-2.4 5,-2.1 1,-0.2 8,-0.3 0.839 112.3 40.4 -60.2 -35.8 36.4 62.8 9.3 90 113 A W H X<5S+ 0 0 7 -4,-1.1 3,-1.2 -3,-0.5 -2,-0.2 0.909 115.1 50.4 -80.1 -43.1 33.4 61.2 7.5 91 114 A L H 3<5S+ 0 0 21 -4,-3.0 -2,-0.2 1,-0.3 -3,-0.2 0.897 117.0 40.9 -58.5 -41.1 31.1 64.2 8.0 92 115 A Q T 3<5S- 0 0 134 -4,-2.8 -1,-0.3 -5,-0.2 -2,-0.2 0.281 109.2-122.3 -93.2 9.8 33.7 66.6 6.7 93 116 A E T < 5 + 0 0 146 -3,-1.2 -3,-0.2 -5,-0.1 -4,-0.1 0.809 55.2 165.1 52.4 34.1 34.8 64.2 3.9 94 117 A E > < - 0 0 92 -5,-2.1 3,-0.9 -6,-0.3 2,-0.2 -0.109 43.5 -79.3 -72.2 173.2 38.4 64.4 5.3 95 118 A P T 3 S+ 0 0 114 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.496 113.4 26.0 -74.1 146.2 41.2 62.0 4.5 96 119 A G T 3 S+ 0 0 55 1,-0.3 -6,-0.1 -2,-0.2 3,-0.1 0.416 83.8 153.8 83.9 -2.4 41.3 58.6 6.1 97 120 A A < - 0 0 29 -3,-0.9 -1,-0.3 -8,-0.3 2,-0.1 -0.237 53.6-103.0 -55.5 144.5 37.5 58.6 6.6 98 121 A F - 0 0 32 -12,-0.3 2,-0.9 -39,-0.1 -1,-0.1 -0.484 35.3-120.0 -66.4 142.6 35.9 55.2 6.8 99 122 A N + 0 0 97 1,-0.1 3,-0.3 -2,-0.1 4,-0.1 -0.793 39.0 167.9 -92.1 107.0 34.1 54.4 3.6 100 123 A W >> + 0 0 2 -2,-0.9 4,-2.1 1,-0.2 3,-0.9 0.280 42.9 111.5 -97.9 9.2 30.4 53.9 4.3 101 124 A S H 3> S+ 0 0 14 1,-0.3 4,-2.8 2,-0.2 5,-0.2 0.812 71.1 57.4 -61.0 -34.7 29.4 53.9 0.6 102 125 A M H 3> S+ 0 0 67 -3,-0.3 4,-2.0 2,-0.2 -1,-0.3 0.890 111.0 45.0 -58.1 -40.4 28.4 50.2 0.5 103 126 A Y H <> S+ 0 0 8 -3,-0.9 4,-2.5 2,-0.2 -2,-0.2 0.880 112.0 50.6 -72.3 -40.7 26.0 50.9 3.3 104 127 A S H X S+ 0 0 0 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.910 112.7 47.9 -61.8 -42.4 24.6 54.1 1.7 105 128 A Q H X S+ 0 0 9 -4,-2.8 4,-2.4 -5,-0.2 -2,-0.2 0.909 112.0 48.9 -63.6 -42.5 24.1 52.1 -1.5 106 129 A H H X S+ 0 0 17 -4,-2.0 4,-2.9 2,-0.2 5,-0.2 0.864 108.9 52.6 -70.7 -34.6 22.4 49.3 0.3 107 130 A A H X S+ 0 0 0 -4,-2.5 4,-2.9 2,-0.2 -1,-0.2 0.925 110.6 47.8 -63.3 -45.2 20.1 51.7 2.2 108 131 A C H X>S+ 0 0 1 -4,-2.1 4,-1.3 2,-0.2 5,-0.6 0.908 112.2 51.4 -60.6 -41.3 19.1 53.2 -1.2 109 132 A L H <5S+ 0 0 16 -4,-2.4 3,-0.5 1,-0.2 -2,-0.2 0.970 115.3 39.8 -55.9 -58.6 18.6 49.7 -2.5 110 133 A I H <5S+ 0 0 53 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.881 109.9 58.4 -60.4 -44.1 16.3 48.6 0.4 111 134 A E H <5S- 0 0 33 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.789 91.0-152.3 -64.3 -27.1 14.4 51.9 0.6 112 135 A G T <5 + 0 0 58 -4,-1.3 -3,-0.1 -3,-0.5 -2,-0.1 0.853 56.1 120.1 62.9 41.2 13.3 51.5 -3.0 113 136 A K S > - 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