==== 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 3KR0 . 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) . 20458.0 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 . 51 9.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 54 10.2 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 . 1 0.2 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 . 33 6.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 62 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 146 27.7 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 1 1 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 0 0 4 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 . 2 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 97 0, 0.0 3,-3.5 0, 0.0 4,-0.2 0.000 360.0 360.0 360.0 -68.6 34.8 51.9 32.1 2 25 A S G > + 0 0 105 1,-0.3 3,-1.7 2,-0.2 4,-0.4 0.720 360.0 75.4 -48.9 -21.2 38.5 52.8 32.2 3 26 A A G > S+ 0 0 35 1,-0.3 3,-1.6 2,-0.2 -1,-0.3 0.843 83.5 64.9 -57.0 -34.9 38.7 49.9 29.7 4 27 A Y G < S+ 0 0 9 -3,-3.5 -1,-0.3 1,-0.3 -2,-0.2 0.491 84.7 73.7 -69.0 -4.8 37.2 52.4 27.1 5 28 A Q G < S+ 0 0 136 -3,-1.7 -1,-0.3 -4,-0.2 -2,-0.2 0.782 98.0 46.2 -78.9 -24.5 40.4 54.4 27.4 6 29 A R S < S+ 0 0 177 -3,-1.6 198,-0.6 -4,-0.4 197,-0.4 0.464 83.6 132.4 -92.3 -4.4 42.2 51.8 25.4 7 30 A F - 0 0 7 -4,-0.2 195,-0.2 -3,-0.2 75,-0.1 -0.323 43.7-156.7 -56.7 113.5 39.4 51.6 22.8 8 31 A E > - 0 0 76 193,-2.6 4,-1.7 -2,-0.2 3,-0.2 -0.850 2.9-161.4 -95.9 108.4 40.9 51.8 19.2 9 32 A P H > S+ 0 0 16 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.884 89.3 53.3 -58.2 -44.2 38.1 53.0 16.8 10 33 A R H > S+ 0 0 120 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.902 111.2 47.0 -58.2 -41.3 39.9 51.7 13.6 11 34 A A H > S+ 0 0 17 -3,-0.2 4,-1.2 2,-0.2 191,-0.3 0.815 111.1 52.5 -71.1 -27.9 40.1 48.2 15.2 12 35 A Y H X S+ 0 0 9 -4,-1.7 4,-1.1 189,-0.2 5,-0.2 0.934 112.0 44.0 -70.9 -47.1 36.5 48.4 16.2 13 36 A L H >X S+ 0 0 0 -4,-2.7 4,-3.5 1,-0.2 3,-0.7 0.934 113.5 51.4 -58.7 -51.7 35.3 49.3 12.7 14 37 A R H 3< S+ 0 0 180 -4,-2.5 4,-0.4 -5,-0.2 -1,-0.2 0.836 110.8 50.0 -51.0 -36.5 37.6 46.7 11.2 15 38 A N H 3< S+ 0 0 28 -4,-1.2 -1,-0.2 -5,-0.2 -2,-0.2 0.730 128.4 16.2 -81.1 -22.9 36.1 44.1 13.6 16 39 A N H << S+ 0 0 21 -4,-1.1 -2,-0.2 -3,-0.7 -3,-0.2 0.611 128.2 39.4-126.9 -22.5 32.5 44.8 12.9 17 40 A Y S < S+ 0 0 9 -4,-3.5 -3,-0.2 -5,-0.2 -2,-0.1 0.218 100.7 72.2-125.9 14.5 32.0 46.8 9.7 18 41 A A S >> S- 0 0 29 -4,-0.4 4,-2.2 -5,-0.4 3,-0.5 -0.796 95.2 -31.2-117.3 165.1 34.5 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 -0.274 120.5 28.7 -56.7 148.6 34.1 41.7 6.0 20 43 A P T >4 S+ 0 0 65 0, 0.0 3,-1.2 0, 0.0 -4,-0.1 -0.934 140.4 23.3 -81.0 -29.2 32.8 39.3 7.0 21 44 A R T <4 S+ 0 0 15 -3,-0.5 10,-0.7 1,-0.3 -5,-0.1 0.804 125.8 56.2 -66.5 -26.4 30.2 41.1 9.1 22 45 A G T 3< S+ 0 0 9 -4,-2.2 2,-0.9 -8,-0.2 -1,-0.3 0.528 78.0 106.9 -83.1 -7.7 30.7 44.1 6.8 23 46 A D < + 0 0 78 -3,-1.2 3,-0.3 -5,-0.3 8,-0.2 -0.622 43.5 179.8 -76.0 109.8 29.9 42.3 3.6 24 47 A L + 0 0 6 -2,-0.9 -1,-0.2 1,-0.2 5,-0.1 0.527 59.4 90.5 -88.0 -3.8 26.4 43.6 2.7 25 48 A a S S+ 0 0 19 2,-0.1 359,-0.2 3,-0.1 -1,-0.2 0.929 75.3 67.6 -60.4 -48.9 26.1 41.4 -0.5 26 49 A N S > S- 0 0 75 -3,-0.3 3,-1.4 1,-0.1 357,-0.0 -0.591 74.7-150.5 -74.3 124.6 24.5 38.5 1.3 27 50 A P T 3 S+ 0 0 80 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.597 91.2 65.8 -76.4 -7.1 21.0 39.5 2.4 28 51 A N T 3 S+ 0 0 123 4,-0.1 2,-0.1 5,-0.0 -3,-0.1 0.303 81.7 107.1 -92.6 5.7 21.2 37.1 5.4 29 52 A G S <> S- 0 0 7 -3,-1.4 4,-1.7 -5,-0.1 5,-0.1 -0.301 82.3-111.1 -82.0 170.0 24.0 38.9 7.1 30 53 A V H > S+ 0 0 8 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.924 113.6 54.5 -67.5 -45.3 23.8 41.1 10.2 31 54 A G H > S+ 0 0 2 -10,-0.7 4,-2.4 1,-0.2 5,-0.3 0.945 109.2 45.9 -52.4 -57.3 24.4 44.4 8.4 32 55 A P H > S+ 0 0 5 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.899 113.5 51.9 -53.0 -43.1 21.6 43.9 5.9 33 56 A W H X S+ 0 0 32 -4,-1.7 4,-1.8 2,-0.2 -2,-0.2 0.937 109.3 48.9 -60.0 -49.1 19.3 42.9 8.8 34 57 A K H X S+ 0 0 9 -4,-2.8 4,-2.0 1,-0.2 3,-0.4 0.949 111.0 48.2 -59.0 -50.4 20.2 46.0 10.8 35 58 A L H X S+ 0 0 1 -4,-2.4 4,-2.9 1,-0.2 -1,-0.2 0.826 109.2 56.6 -59.8 -30.7 19.6 48.4 8.0 36 59 A R H X S+ 0 0 73 -4,-1.6 4,-3.2 -5,-0.3 5,-0.3 0.891 104.8 48.5 -71.1 -39.9 16.3 46.8 7.2 37 60 A C H X S+ 0 0 3 -4,-1.8 4,-2.3 -3,-0.4 5,-0.2 0.941 115.3 47.1 -66.0 -43.6 14.8 47.2 10.7 38 61 A L H X S+ 0 0 3 -4,-2.0 4,-2.2 -5,-0.2 5,-0.3 0.985 116.6 42.0 -58.8 -60.9 15.9 50.8 10.6 39 62 A A H X S+ 0 0 6 -4,-2.9 4,-2.6 1,-0.2 -2,-0.2 0.907 113.8 51.3 -51.7 -52.5 14.5 51.4 7.1 40 63 A Q H X S+ 0 0 83 -4,-3.2 4,-0.6 1,-0.2 -1,-0.2 0.928 110.0 50.5 -54.0 -46.9 11.3 49.5 7.7 41 64 A T H >< S+ 0 0 7 -4,-2.3 3,-1.1 -5,-0.3 5,-0.5 0.931 114.3 41.4 -61.1 -53.0 10.5 51.4 10.9 42 65 A F H >< S+ 0 0 3 -4,-2.2 3,-1.8 1,-0.2 -1,-0.2 0.832 104.7 67.2 -61.9 -33.0 11.0 54.8 9.4 43 66 A A H 3< S+ 0 0 78 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.693 88.2 69.1 -64.0 -16.8 9.1 53.8 6.3 44 67 A T T << S- 0 0 66 -3,-1.1 -1,-0.3 -4,-0.6 -2,-0.2 0.757 99.7-137.4 -70.3 -26.2 6.0 53.5 8.4 45 68 A G S < S+ 0 0 44 -3,-1.8 -3,-0.1 -4,-0.3 -2,-0.1 0.395 76.6 107.3 84.4 -2.8 6.0 57.2 8.8 46 69 A E + 0 0 106 -5,-0.5 2,-0.8 1,-0.2 -4,-0.1 0.605 63.6 68.5 -86.9 -10.2 5.2 57.0 12.5 47 70 A V S S+ 0 0 1 -6,-0.3 2,-0.3 -5,-0.2 -1,-0.2 -0.751 73.8 132.3-110.1 85.5 8.6 58.0 13.7 48 71 A S + 0 0 64 -2,-0.8 2,-0.3 105,-0.1 23,-0.1 -0.926 10.8 114.4-139.1 159.1 9.0 61.7 12.8 49 72 A G - 0 0 33 21,-1.2 23,-0.4 -2,-0.3 3,-0.1 -0.969 62.2 -87.3 168.4-165.8 10.0 65.1 14.2 50 73 A R S S+ 0 0 117 -2,-0.3 23,-2.8 1,-0.2 2,-0.3 0.778 99.1 40.3-104.9 -36.4 12.5 67.9 13.9 51 74 A T E +a 73 0A 5 21,-0.2 102,-1.2 20,-0.1 103,-0.7 -0.895 57.8 176.3-123.1 149.8 15.3 66.8 16.2 52 75 A L E -ab 74 154A 0 21,-2.2 23,-2.8 -2,-0.3 2,-0.4 -0.993 14.1-150.3-150.2 146.7 17.0 63.5 17.0 53 76 A I E -ab 75 155A 1 101,-1.7 103,-2.6 -2,-0.3 2,-0.6 -0.983 6.5-150.0-127.1 133.0 19.9 62.2 19.1 54 77 A D E -ab 76 156A 0 21,-2.8 23,-1.1 -2,-0.4 2,-0.7 -0.913 21.5-144.6-103.2 118.6 22.2 59.2 18.5 55 78 A I E S- b 0 157A 0 101,-3.3 103,-0.5 -2,-0.6 106,-0.1 -0.743 74.3 -8.5 -94.9 112.2 23.3 57.9 21.8 56 79 A G S S+ 0 0 2 -2,-0.7 102,-0.3 101,-0.1 -1,-0.3 0.989 73.2 177.4 69.1 61.2 26.8 56.5 21.9 57 80 A S > - 0 0 0 20,-3.2 3,-1.2 -3,-0.5 21,-0.2 0.743 11.2-170.6 -68.4 -27.9 27.5 56.7 18.2 58 81 A G T 3 - 0 0 0 19,-0.5 -1,-0.2 1,-0.2 29,-0.1 -0.369 62.1 -41.6 58.0-148.7 31.0 55.5 18.4 59 82 A P T 3 S+ 0 0 3 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 -0.151 114.5 99.4 -99.7 36.4 32.8 56.0 15.1 60 83 A T < + 0 0 0 -3,-1.2 27,-0.0 1,-0.1 40,-0.0 -0.898 39.6 176.0-128.4 156.1 29.8 54.7 13.0 61 84 A V >> + 0 0 1 -2,-0.3 3,-2.9 467,-0.1 4,-0.5 0.511 59.0 96.3-130.6 -16.3 27.0 56.4 11.0 62 85 A Y G >4 S+ 0 0 3 1,-0.3 3,-1.5 2,-0.2 4,-0.4 0.821 76.6 69.5 -48.7 -35.8 25.0 53.5 9.3 63 86 A Q G 34 S+ 0 0 1 1,-0.3 -1,-0.3 -6,-0.1 -2,-0.1 0.548 102.9 43.6 -65.5 -7.3 22.6 53.7 12.2 64 87 A L G <> S+ 0 0 0 -3,-2.9 4,-3.2 3,-0.1 -1,-0.3 0.478 83.2 98.6-112.5 -7.3 21.3 57.1 10.9 65 88 A L T << S+ 0 0 0 -3,-1.5 4,-0.3 -4,-0.5 -2,-0.1 0.922 94.6 30.4 -53.5 -60.0 21.1 56.5 7.1 66 89 A S T >4 S+ 0 0 5 -4,-0.4 3,-0.6 1,-0.2 -1,-0.3 0.774 121.0 57.9 -68.7 -23.4 17.3 55.8 6.8 67 90 A A G >4 S+ 0 0 1 1,-0.2 3,-2.9 2,-0.1 4,-0.5 0.908 88.0 71.2 -74.7 -40.9 16.8 58.1 9.8 68 91 A C G 3< S+ 0 0 0 -4,-3.2 -1,-0.2 1,-0.3 3,-0.2 0.596 89.0 63.0 -59.9 -15.5 18.3 61.3 8.4 69 92 A S G < S+ 0 0 32 -3,-0.6 -1,-0.3 -4,-0.3 -2,-0.1 0.533 105.0 47.3 -84.9 -5.6 15.5 61.9 5.9 70 93 A H S < S+ 0 0 47 -3,-2.9 -21,-1.2 1,-0.2 2,-0.4 0.501 109.0 50.5-111.5 -6.3 13.0 62.3 8.7 71 94 A F - 0 0 0 -4,-0.5 -1,-0.2 -3,-0.2 -21,-0.2 -0.974 55.2-164.4-140.9 121.7 14.7 64.7 11.1 72 95 A E S S+ 0 0 101 -2,-0.4 2,-0.6 -23,-0.4 -21,-0.2 0.711 83.0 52.4 -81.3 -22.5 16.4 68.0 10.1 73 96 A D E S+a 51 0A 13 -23,-2.8 -21,-2.2 55,-0.1 2,-0.5 -0.912 70.6 179.1-118.2 106.2 18.4 68.5 13.3 74 97 A I E -ac 52 128A 0 53,-3.0 55,-2.3 -2,-0.6 56,-0.9 -0.910 9.2-166.3-114.0 130.2 20.5 65.4 14.1 75 98 A T E -ac 53 130A 1 -23,-2.8 -21,-2.8 -2,-0.5 2,-0.3 -0.952 4.7-163.5-115.4 129.6 22.8 65.3 17.1 76 99 A M E -ac 54 131A 0 54,-2.5 56,-3.0 -2,-0.5 2,-0.3 -0.847 11.2-173.4-111.3 151.8 25.4 62.6 17.4 77 100 A T E + c 0 132A 0 -23,-1.1 -20,-3.2 -2,-0.3 -19,-0.5 -0.935 14.1 168.8-137.2 158.9 27.2 61.6 20.6 78 101 A D E - c 0 133A 0 54,-1.7 56,-0.5 -2,-0.3 6,-0.1 -0.885 35.0-132.3-166.0 156.7 30.0 59.6 22.2 79 102 A F S S+ 0 0 78 -2,-0.3 2,-0.4 54,-0.2 -1,-0.1 0.739 88.3 72.2 -72.3 -25.8 31.9 59.2 25.4 80 103 A L > - 0 0 6 1,-0.2 4,-1.8 -3,-0.1 5,-0.1 -0.788 66.0-150.3-101.3 134.1 35.3 59.1 23.7 81 104 A E H > S+ 0 0 101 -2,-0.4 4,-2.6 2,-0.2 5,-0.3 0.944 99.4 60.1 -55.1 -50.2 37.1 62.0 22.2 82 105 A V H > S+ 0 0 62 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.883 106.6 45.6 -48.3 -48.5 38.8 59.6 19.7 83 106 A N H >> S+ 0 0 0 2,-0.2 4,-2.7 1,-0.2 3,-0.5 0.931 110.2 52.4 -61.4 -47.8 35.5 58.5 18.3 84 107 A R H 3X S+ 0 0 43 -4,-1.8 4,-1.5 1,-0.3 -2,-0.2 0.884 109.3 51.6 -56.8 -36.9 34.1 62.0 18.0 85 108 A Q H 3X S+ 0 0 94 -4,-2.6 4,-1.1 2,-0.2 -1,-0.3 0.815 109.7 49.9 -68.0 -31.0 37.2 62.9 16.1 86 109 A E H S+ 0 0 65 -4,-1.1 5,-0.8 1,-0.2 8,-0.3 0.869 113.1 37.1 -60.0 -34.9 36.7 62.9 9.7 90 113 A W H ><5S+ 0 0 7 -4,-1.2 3,-0.7 -3,-0.2 -2,-0.2 0.829 116.2 51.8 -85.7 -35.3 33.7 61.4 7.8 91 114 A L H 3<5S+ 0 0 17 -4,-2.5 -2,-0.2 1,-0.2 -3,-0.2 0.903 117.9 37.7 -66.4 -39.1 31.4 64.3 8.3 92 115 A Q T 3<5S- 0 0 128 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.272 107.8-125.7 -94.6 9.1 33.9 66.8 7.0 93 116 A E T < 5 + 0 0 140 -3,-0.7 -3,-0.2 -5,-0.1 -4,-0.1 0.706 53.4 165.2 51.9 22.5 35.1 64.3 4.4 94 117 A E > < - 0 0 91 -5,-0.8 3,-1.0 -6,-0.5 -1,-0.1 -0.014 45.8 -67.2 -60.4 171.9 38.6 64.9 5.8 95 118 A P T 3 S+ 0 0 117 0, 0.0 -1,-0.2 0, 0.0 -3,-0.1 -0.335 115.8 18.2 -66.5 143.3 41.4 62.5 4.9 96 119 A G T 3 S+ 0 0 57 1,-0.2 -6,-0.1 -3,-0.1 -7,-0.1 0.616 82.0 158.0 76.4 15.0 41.3 58.9 6.1 97 120 A A < - 0 0 32 -3,-1.0 2,-0.3 -8,-0.3 -1,-0.2 -0.141 49.6 -94.7 -60.7 167.1 37.6 58.9 6.9 98 121 A F - 0 0 30 -12,-0.3 2,-1.1 -39,-0.1 -1,-0.1 -0.626 35.3-116.0 -84.3 147.8 35.9 55.5 7.0 99 122 A N + 0 0 102 -2,-0.3 3,-0.3 1,-0.2 4,-0.2 -0.700 42.8 161.7 -88.7 96.7 34.3 54.3 3.9 100 123 A W >> + 0 0 2 -2,-1.1 4,-2.3 1,-0.2 3,-1.0 0.389 42.1 109.9 -89.3 6.3 30.6 54.0 4.6 101 124 A S H 3> S+ 0 0 14 1,-0.3 4,-2.8 2,-0.2 5,-0.2 0.832 73.3 53.6 -61.4 -40.0 29.6 53.9 0.9 102 125 A M H 3> S+ 0 0 63 -3,-0.3 4,-2.3 2,-0.2 -1,-0.3 0.868 112.1 47.3 -53.9 -39.8 28.5 50.3 0.8 103 126 A Y H <> S+ 0 0 8 -3,-1.0 4,-2.2 2,-0.2 -2,-0.2 0.886 111.0 50.7 -72.5 -43.5 26.2 51.0 3.7 104 127 A S H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.951 111.7 48.2 -53.5 -53.9 24.8 54.2 2.0 105 128 A Q H X S+ 0 0 7 -4,-2.8 4,-3.2 1,-0.2 -2,-0.2 0.960 112.2 47.7 -55.9 -53.8 24.1 52.2 -1.2 106 129 A H H X S+ 0 0 12 -4,-2.3 4,-3.2 1,-0.3 -1,-0.2 0.846 108.3 54.2 -61.1 -34.2 22.4 49.4 0.6 107 130 A A H X S+ 0 0 0 -4,-2.2 4,-3.0 2,-0.2 -1,-0.3 0.944 111.7 46.3 -61.5 -44.4 20.3 51.8 2.6 108 131 A C H X>S+ 0 0 1 -4,-2.5 4,-2.3 2,-0.2 5,-0.6 0.926 112.5 50.6 -59.7 -46.7 19.3 53.3 -0.7 109 132 A L H <5S+ 0 0 19 -4,-3.2 -2,-0.2 2,-0.2 -1,-0.2 0.957 114.2 43.4 -52.4 -56.7 18.7 49.9 -2.1 110 133 A I H <5S+ 0 0 55 -4,-3.2 -2,-0.2 1,-0.2 -1,-0.2 0.904 112.6 50.9 -61.6 -46.2 16.5 48.9 0.9 111 134 A E H <5S- 0 0 34 -4,-3.0 -1,-0.2 -5,-0.2 -2,-0.2 0.907 91.8-154.7 -61.4 -40.2 14.5 52.1 1.1 112 135 A G T <5 + 0 0 55 -4,-2.3 -3,-0.1 -5,-0.2 -4,-0.1 0.918 52.2 126.4 68.4 45.4 13.7 51.8 -2.7 113 136 A K S > - 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0 0 10 12,-1.9 5,-0.1 -2,-0.5 -206,-0.1 -0.457 28.5-132.3 -73.1 116.0 24.2 35.3 14.7 236 259 A P > - 0 0 36 0, 0.0 3,-1.7 0, 0.0 4,-0.3 -0.253 22.2-109.0 -67.8 155.9 25.2 32.7 12.0 237 260 A A G > S+ 0 0 72 1,-0.3 3,-3.4 2,-0.2 -2,-0.0 0.926 116.4 56.2 -45.3 -57.5 28.3 30.6 12.6 238 261 A H G 3 S+ 0 0 122 1,-0.3 -1,-0.3 3,-0.0 -217,-0.0 0.618 102.7 57.4 -61.8 -11.0 30.4 32.4 9.9 239 262 A L G < S+ 0 0 4 -3,-1.7 2,-0.8 -219,-0.1 -1,-0.3 0.375 81.2 97.5 -97.0 4.8 29.7 35.7 11.6 240 263 A Q < + 0 0 118 -3,-3.4 5,-0.1 -4,-0.3 7,-0.0 -0.840 48.2 162.9 -87.9 109.9 31.3 34.4 14.8 241 264 A T - 0 0 54 -2,-0.8 -1,-0.1 -226,-0.1 4,-0.1 0.365 53.6-108.6-120.7 2.9 34.7 35.8 14.4 242 265 A G S S+ 0 0 54 2,-0.4 3,-0.1 1,-0.1 -2,-0.1 0.672 95.6 103.4 74.1 11.9 36.5 35.8 17.8 243 266 A V S S- 0 0 20 -228,-0.1 -43,-2.5 1,-0.1 2,-0.3 0.385 100.4 -18.8 -94.4 -4.8 36.3 39.6 18.1 244 267 A D B -H 199 0B 15 -45,-0.2 -2,-0.4 2,-0.1 -45,-0.2 -0.926 59.7-114.6-172.5-166.2 33.5 38.9 20.6 245 268 A D + 0 0 36 -47,-1.0 -46,-0.1 -2,-0.3 -5,-0.1 0.130 49.6 150.8-141.4 20.3 31.0 36.4 21.8 246 269 A V - 0 0 6 -48,-0.2 -51,-0.2 1,-0.1 -50,-0.1 -0.237 26.6-166.3 -51.0 140.7 27.7 38.0 20.8 247 270 A K - 0 0 107 -53,-2.3 -12,-1.9 1,-0.3 2,-0.3 0.670 64.1 -10.6-103.4 -23.4 25.0 35.3 20.2 248 271 A G E -EF 194 234A 4 -54,-0.9 -54,-2.1 -14,-0.3 2,-0.3 -0.892 61.8-123.2-162.5 174.8 22.3 37.4 18.5 249 272 A V E -EF 193 233A 2 -16,-2.6 -16,-3.4 -2,-0.3 2,-0.3 -0.979 23.3-152.8-135.9 145.9 21.4 41.0 17.8 250 273 A F E -EF 192 232A 0 -58,-2.5 -58,-1.6 -2,-0.3 2,-0.4 -0.903 5.0-158.3-122.3 150.6 18.1 42.6 18.8 251 274 A F E -EF 191 231A 0 -20,-3.1 -20,-2.7 -2,-0.3 2,-0.4 -0.993 11.7-175.0-128.0 129.4 16.1 45.5 17.5 252 275 A A E -EF 190 230A 1 -62,-3.1 -62,-2.7 -2,-0.4 2,-0.6 -0.980 16.1-166.1-127.6 133.4 13.5 47.5 19.5 253 276 A W E +EF 189 229A 20 -24,-3.4 -25,-2.2 -2,-0.4 -24,-2.0 -0.954 26.1 176.7-111.4 110.5 11.1 50.2 18.5 254 277 A A E -EF 188 227A 0 -66,-3.5 -66,-3.8 -2,-0.6 2,-0.5 -0.913 20.1-151.5-123.8 143.0 9.9 51.8 21.7 255 278 A Q E -EF 187 226A 52 -29,-2.9 -29,-2.9 -2,-0.4 2,-0.3 -0.957 19.6-127.7-119.5 119.6 7.6 54.7 22.3 256 279 A K E F 0 225A 41 -70,-1.5 -71,-1.7 -2,-0.5 -31,-0.2 -0.444 360.0 360.0 -61.0 121.9 7.7 56.9 25.4 257 280 A V 0 0 133 -33,-2.0 -1,-0.0 -2,-0.3 -2,-0.0 -0.956 360.0 360.0-122.2 360.0 4.2 57.0 26.8 258 !* 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 0.0 259 14 B P 0 0 193 0, 0.0 2,-0.5 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-141.7 25.2 54.2 -55.7 260 15 B D - 0 0 122 1,-0.1 4,-0.4 2,-0.0 0, 0.0 -0.818 360.0-179.7-105.8 124.5 28.5 53.4 -54.1 261 16 B S S > S+ 0 0 47 -2,-0.5 4,-2.3 1,-0.1 5,-0.3 0.879 70.9 74.8 -84.8 -39.6 28.9 52.3 -50.4 262 17 B A H > S+ 0 0 55 1,-0.2 4,-1.5 2,-0.2 5,-0.2 0.786 91.1 51.2 -44.9 -49.3 32.7 51.9 -50.4 263 18 B P H >> S+ 0 0 79 0, 0.0 4,-1.7 0, 0.0 3,-0.6 0.961 113.8 43.2 -62.4 -51.4 33.8 55.5 -50.3 264 19 B G H >> S+ 0 0 24 -4,-0.4 4,-2.2 -3,-0.3 3,-0.6 0.950 113.2 52.1 -55.9 -53.6 31.6 56.5 -47.4 265 20 B Q H 3X S+ 0 0 37 -4,-2.3 4,-1.9 1,-0.2 -1,-0.3 0.779 109.6 51.6 -52.1 -26.9 32.5 53.4 -45.5 266 21 B A H < S+ 0 0 60 -4,-1.7 3,-1.3 2,-0.2 -1,-0.2 0.948 108.6 48.1 -68.6 -50.4 39.5 56.4 -41.5 271 26 B A H >< S+ 0 0 29 -4,-2.4 3,-1.9 -3,-0.4 -2,-0.2 0.894 105.5 59.3 -58.3 -41.1 38.0 58.8 -39.0 272 27 B Y G >< S+ 0 0 3 -4,-2.3 3,-1.2 1,-0.3 -1,-0.3 0.612 85.0 77.2 -69.0 -12.5 37.8 56.0 -36.3 273 28 B Q G < S+ 0 0 121 -3,-1.3 -1,-0.3 -4,-0.4 -2,-0.2 0.631 97.7 48.7 -69.6 -12.3 41.5 55.4 -36.4 274 29 B R G < S+ 0 0 124 -3,-1.9 198,-1.1 -4,-0.2 197,-0.5 0.413 81.6 124.9-104.6 0.4 41.7 58.6 -34.3 275 30 B F < - 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