==== 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 27-FEB-06 2G71 . COMPND 2 MOLECULE: PHENYLETHANOLAMINE N-METHYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.D.A.TYNDALL,C.L.GEE,J.L.MARTIN . 531 4 2 0 2 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20496.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 375 70.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 48 9.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 56 10.5 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 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 61 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 150 28.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.5 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 1 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 0 1 4 1 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 21 A A > 0 0 117 0, 0.0 4,-1.4 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 -22.5 34.8 54.2 36.2 2 22 A A H > + 0 0 85 2,-0.2 4,-1.6 3,-0.1 5,-0.1 0.960 360.0 34.3 -66.9 -53.3 35.9 50.6 35.8 3 23 A V H >> S+ 0 0 27 1,-0.2 4,-2.3 2,-0.2 3,-0.6 0.969 116.1 56.5 -64.1 -52.8 34.3 50.3 32.4 4 24 A A H 34 S+ 0 0 28 1,-0.3 -1,-0.2 2,-0.2 -2,-0.2 0.798 106.0 53.7 -47.5 -33.3 35.1 53.9 31.6 5 25 A S H >< S+ 0 0 79 -4,-1.4 3,-1.3 1,-0.2 -1,-0.3 0.909 106.8 49.1 -69.7 -44.8 38.7 53.0 32.3 6 26 A A H X< S+ 0 0 32 -4,-1.6 3,-1.9 -3,-0.6 4,-0.3 0.872 102.3 62.5 -63.7 -38.4 38.7 50.1 29.8 7 27 A Y T 3< S+ 0 0 1 -4,-2.3 3,-0.5 1,-0.3 -1,-0.3 0.545 85.1 79.2 -66.9 -3.5 37.2 52.3 27.1 8 28 A Q T < S+ 0 0 124 -3,-1.3 -1,-0.3 -5,-0.2 -2,-0.2 0.722 94.6 45.2 -76.8 -19.3 40.3 54.4 27.3 9 29 A R S < S+ 0 0 151 -3,-1.9 198,-0.7 -4,-0.2 197,-0.5 0.415 83.4 134.0-101.1 0.6 42.2 51.8 25.2 10 30 A F B -A 205 0A 7 -3,-0.5 195,-0.2 -4,-0.3 75,-0.1 -0.299 45.6-151.9 -54.7 119.6 39.3 51.6 22.7 11 31 A E >> - 0 0 78 193,-2.4 4,-2.5 1,-0.2 3,-0.9 -0.846 4.0-158.2-102.2 104.5 40.7 51.8 19.2 12 32 A P H 3> S+ 0 0 18 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.849 93.2 46.6 -45.1 -47.3 38.1 53.2 16.7 13 33 A R H 3> S+ 0 0 120 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.779 111.2 51.2 -71.9 -26.7 39.7 51.7 13.6 14 34 A A H <> S+ 0 0 18 -3,-0.9 4,-2.4 2,-0.2 191,-0.2 0.870 111.1 49.4 -75.7 -36.4 40.0 48.3 15.3 15 35 A Y H X S+ 0 0 9 -4,-2.5 4,-1.9 189,-0.2 5,-0.4 0.934 111.9 47.6 -65.3 -47.0 36.3 48.4 16.2 16 36 A L H X>S+ 0 0 0 -4,-2.4 4,-2.9 -5,-0.2 5,-0.5 0.898 113.2 48.9 -60.1 -43.1 35.3 49.4 12.7 17 37 A R H X5S+ 0 0 183 -4,-1.8 4,-0.7 1,-0.2 -1,-0.2 0.920 111.2 49.0 -64.3 -45.4 37.5 46.6 11.2 18 38 A N H <5S+ 0 0 31 -4,-2.4 6,-0.2 1,-0.1 -1,-0.2 0.824 129.8 17.3 -65.4 -34.4 36.1 43.9 13.6 19 39 A N H <5S+ 0 0 28 -4,-1.9 -2,-0.2 -5,-0.1 -3,-0.2 0.707 128.0 39.9-114.2 -25.8 32.5 44.8 13.0 20 40 A Y H <5S+ 0 0 11 -4,-2.9 -3,-0.2 -5,-0.4 -2,-0.1 0.449 102.3 67.7-110.4 2.6 32.0 46.8 9.8 21 41 A A S X4 S+ 0 0 65 0, 0.0 3,-1.6 0, 0.0 219,-0.1 -0.936 139.2 26.2 -79.0 -30.6 32.8 39.1 6.9 24 44 A R T 34 S+ 0 0 13 -3,-0.4 10,-0.5 1,-0.3 9,-0.1 0.816 124.7 52.9 -60.9 -31.5 30.3 40.9 9.2 25 45 A G T 3< S+ 0 0 9 -4,-2.2 2,-0.6 -8,-0.2 -1,-0.3 0.429 78.3 115.8 -85.5 0.6 30.4 44.0 7.1 26 46 A D < - 0 0 73 -3,-1.6 8,-0.3 -5,-0.3 3,-0.2 -0.606 40.4-177.7 -72.8 116.1 29.7 42.2 3.8 27 47 A L + 0 0 8 -2,-0.6 -1,-0.2 1,-0.2 5,-0.1 0.517 64.8 81.4 -93.4 -4.0 26.3 43.6 2.7 28 48 A a S S+ 0 0 24 359,-0.0 360,-0.2 2,-0.0 -1,-0.2 0.855 75.6 76.0 -70.6 -35.7 26.0 41.3 -0.4 29 49 A N S > S- 0 0 50 -3,-0.2 3,-1.8 1,-0.2 5,-0.1 -0.674 71.4-153.0 -79.2 118.6 24.7 38.3 1.5 30 50 A P T 3 S+ 0 0 81 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 0.703 93.4 60.6 -64.4 -16.9 21.0 39.0 2.3 31 51 A N T 3 S+ 0 0 118 4,-0.1 -2,-0.1 5,-0.0 -4,-0.0 0.478 83.7 109.4 -87.7 -4.6 21.3 36.6 5.4 32 52 A G S <> S- 0 0 6 -3,-1.8 4,-1.2 1,-0.1 5,-0.1 -0.154 81.2-116.0 -68.3 167.6 24.1 38.8 7.0 33 53 A V H > S+ 0 0 11 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.807 110.8 62.7 -72.9 -29.1 23.6 40.8 10.1 34 54 A G H > S+ 0 0 7 -10,-0.5 4,-2.4 -8,-0.3 5,-0.2 0.965 104.6 41.2 -60.0 -58.8 24.2 44.0 8.1 35 55 A P H > S+ 0 0 5 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.879 115.0 55.6 -58.3 -37.2 21.3 43.8 5.7 36 56 A W H X S+ 0 0 30 -4,-1.2 4,-2.1 2,-0.2 -2,-0.2 0.943 108.7 45.0 -63.2 -48.8 19.1 42.7 8.7 37 57 A K H X S+ 0 0 16 -4,-2.7 4,-2.1 1,-0.2 -1,-0.2 0.940 113.3 50.0 -61.1 -46.8 20.0 45.7 10.8 38 58 A L H X S+ 0 0 2 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.830 109.9 51.8 -61.6 -32.7 19.5 48.1 7.9 39 59 A R H X S+ 0 0 78 -4,-2.0 4,-3.2 -5,-0.2 5,-0.3 0.909 107.2 51.7 -70.4 -42.2 16.1 46.5 7.1 40 60 A C H X S+ 0 0 0 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.944 115.0 43.2 -58.1 -47.7 14.8 46.9 10.7 41 61 A L H X S+ 0 0 2 -4,-2.1 4,-2.1 2,-0.2 5,-0.2 0.954 117.5 45.0 -63.0 -51.1 15.8 50.6 10.6 42 62 A A H X S+ 0 0 7 -4,-2.6 4,-1.8 1,-0.2 -2,-0.2 0.894 113.0 49.0 -61.7 -45.2 14.4 51.2 7.1 43 63 A Q H X S+ 0 0 86 -4,-3.2 4,-0.7 2,-0.2 -1,-0.2 0.898 110.1 53.1 -63.2 -40.4 11.1 49.4 7.6 44 64 A T H >< S+ 0 0 2 -4,-1.9 3,-1.4 -5,-0.3 5,-0.5 0.966 113.0 40.9 -60.2 -55.4 10.5 51.2 10.9 45 65 A F H >< S+ 0 0 4 -4,-2.1 3,-1.5 1,-0.3 5,-0.3 0.777 106.2 66.3 -65.0 -25.8 10.9 54.7 9.5 46 66 A A H 3< S+ 0 0 82 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.680 86.3 69.9 -69.5 -17.3 9.0 53.6 6.3 47 67 A T T << S- 0 0 64 -3,-1.4 -1,-0.3 -4,-0.7 -2,-0.2 0.671 100.8-136.8 -72.2 -16.3 5.9 53.2 8.5 48 68 A G S < S+ 0 0 43 -3,-1.5 -3,-0.1 -4,-0.3 -2,-0.1 0.512 77.1 108.4 73.3 5.4 5.9 57.0 8.8 49 69 A E + 0 0 98 -5,-0.5 2,-0.7 1,-0.2 -4,-0.1 0.489 61.8 71.4 -92.2 -3.2 5.2 56.8 12.5 50 70 A V S S+ 0 0 2 -5,-0.3 2,-0.3 -6,-0.2 -1,-0.2 -0.800 72.4 130.2-114.0 87.6 8.7 57.9 13.6 51 71 A S + 0 0 67 -2,-0.7 2,-0.3 105,-0.1 23,-0.1 -0.927 11.1 110.7-138.5 161.5 8.8 61.6 12.7 52 72 A G - 0 0 35 21,-1.1 23,-0.3 -2,-0.3 3,-0.1 -0.968 64.2 -87.1 167.2-157.5 9.8 64.9 14.2 53 73 A R S S+ 0 0 123 -2,-0.3 23,-2.6 1,-0.2 2,-0.4 0.719 98.4 45.9-113.6 -36.8 12.4 67.6 14.0 54 74 A T E +b 76 0B 7 21,-0.2 102,-1.1 20,-0.1 103,-0.9 -0.891 55.3 175.1-118.1 145.3 15.1 66.5 16.4 55 75 A L E -bc 77 157B 0 21,-2.0 23,-2.8 -2,-0.4 2,-0.4 -0.998 13.1-155.3-145.2 139.5 16.9 63.2 16.9 56 76 A I E -bc 78 158B 1 101,-1.9 103,-2.1 -2,-0.3 2,-0.7 -0.967 7.6-149.3-120.6 132.6 19.8 62.2 19.1 57 77 A D E > -bc 79 159B 0 21,-3.2 23,-1.0 -2,-0.4 3,-0.6 -0.903 19.1-146.4-102.1 114.1 22.1 59.2 18.5 58 78 A I E 3 S- c 0 160B 0 101,-2.7 103,-0.6 -2,-0.7 106,-0.1 -0.687 75.2 -5.1 -84.4 124.6 23.3 57.8 21.8 59 79 A G T 3 S+ 0 0 1 -2,-0.5 -1,-0.2 101,-0.1 22,-0.2 0.931 74.0 174.9 59.8 48.6 26.8 56.3 21.9 60 80 A S X - 0 0 0 20,-2.5 3,-1.6 -3,-0.6 21,-0.2 0.756 12.7-174.7 -56.5 -28.6 27.3 56.7 18.1 61 81 A G T 3 - 0 0 0 19,-0.7 -1,-0.2 1,-0.2 29,-0.1 -0.335 61.0 -39.5 60.8-147.9 30.9 55.6 18.4 62 82 A P T 3 S+ 0 0 2 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 0.071 115.3 97.0 -98.6 25.7 32.7 55.9 15.0 63 83 A T < + 0 0 0 -3,-1.6 27,-0.1 1,-0.1 40,-0.0 -0.832 40.3 176.5-119.5 156.5 29.7 54.7 13.0 64 84 A V > + 0 0 0 -2,-0.3 3,-2.7 2,-0.1 4,-0.5 0.467 58.8 98.2-128.7 -10.3 26.9 56.4 11.0 65 85 A Y G > S+ 0 0 2 1,-0.3 3,-1.0 2,-0.2 4,-0.4 0.789 76.8 68.1 -52.0 -31.0 25.0 53.5 9.4 66 86 A Q G 3 S+ 0 0 1 1,-0.2 -1,-0.3 2,-0.1 4,-0.1 0.543 103.8 43.5 -69.3 -5.8 22.4 53.7 12.2 67 87 A L G <> S+ 0 0 0 -3,-2.7 4,-2.7 2,-0.1 -1,-0.2 0.432 83.0 97.6-117.2 -2.0 21.3 57.1 10.9 68 88 A L T <4 S+ 0 0 0 -3,-1.0 4,-0.2 -4,-0.5 -2,-0.1 0.854 96.1 31.0 -57.1 -41.1 21.1 56.4 7.1 69 89 A S T 4 S+ 0 0 6 -4,-0.4 3,-0.5 1,-0.1 -1,-0.2 0.739 119.5 55.5 -89.5 -23.9 17.4 55.7 7.0 70 90 A A T >> S+ 0 0 0 1,-0.2 3,-2.4 2,-0.1 4,-0.6 0.846 87.2 76.9 -76.0 -36.0 16.6 58.1 9.9 71 91 A C T 3< S+ 0 0 0 -4,-2.7 3,-0.3 1,-0.3 -1,-0.2 0.691 87.8 59.3 -51.5 -24.4 18.2 61.3 8.4 72 92 A S T 34 S+ 0 0 32 -3,-0.5 -1,-0.3 1,-0.2 -2,-0.1 0.309 106.5 48.3 -90.2 12.0 15.3 61.9 6.0 73 93 A H T <4 S+ 0 0 52 -3,-2.4 -21,-1.1 1,-0.2 2,-0.4 0.432 109.6 51.2-123.8 -8.6 12.8 62.2 8.8 74 94 A F < - 0 0 0 -4,-0.6 -1,-0.2 -3,-0.3 -21,-0.2 -0.968 54.8-167.0-138.6 121.0 14.7 64.6 11.1 75 95 A E S S+ 0 0 106 -2,-0.4 2,-0.6 -23,-0.3 -21,-0.2 0.741 83.3 50.6 -76.6 -26.2 16.2 67.9 10.1 76 96 A D E S+b 54 0B 11 -23,-2.6 -21,-2.0 55,-0.1 2,-0.5 -0.938 71.1 178.1-117.6 109.4 18.3 68.4 13.3 77 97 A I E -bd 55 131B 0 53,-3.2 55,-2.1 -2,-0.6 56,-1.0 -0.940 11.3-164.6-116.8 134.1 20.4 65.4 14.2 78 98 A T E -bd 56 133B 2 -23,-2.8 -21,-3.2 -2,-0.5 2,-0.3 -0.964 5.4-163.4-116.2 126.7 22.8 65.2 17.2 79 99 A M E -bd 57 134B 0 54,-2.8 56,-2.7 -2,-0.5 2,-0.3 -0.793 14.3-174.3-106.8 152.6 25.4 62.4 17.4 80 100 A T E + d 0 135B 0 -23,-1.0 -20,-2.5 -2,-0.3 -19,-0.7 -0.956 15.7 164.7-147.0 163.9 27.2 61.5 20.6 81 101 A D E - d 0 136B 0 54,-1.7 56,-0.5 -2,-0.3 6,-0.1 -0.894 37.6-129.7-176.3 150.2 29.9 59.5 22.3 82 102 A F S S+ 0 0 63 -2,-0.3 2,-0.5 54,-0.2 -1,-0.1 0.759 89.4 76.4 -72.6 -28.8 31.9 59.1 25.5 83 103 A L > - 0 0 8 1,-0.2 4,-1.9 -3,-0.1 5,-0.2 -0.754 64.0-154.6 -97.6 131.6 35.2 58.9 23.6 84 104 A E H > S+ 0 0 106 -2,-0.5 4,-2.7 1,-0.2 5,-0.2 0.917 99.0 59.4 -60.5 -44.5 37.0 61.9 22.1 85 105 A V H > S+ 0 0 56 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.871 106.4 47.1 -54.3 -40.3 38.6 59.5 19.6 86 106 A N H > S+ 0 0 0 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.908 110.4 50.1 -70.2 -41.5 35.2 58.4 18.3 87 107 A R H X S+ 0 0 50 -4,-1.9 4,-2.0 1,-0.2 -2,-0.2 0.882 110.7 52.8 -63.0 -34.5 33.9 62.0 18.0 88 108 A Q H X S+ 0 0 83 -4,-2.7 4,-1.8 2,-0.2 -2,-0.2 0.936 108.6 48.9 -62.8 -48.3 37.1 62.7 16.1 89 109 A E H X S+ 0 0 9 -4,-2.1 4,-1.0 1,-0.2 12,-0.3 0.881 109.7 51.3 -60.5 -41.7 36.5 59.7 13.7 90 110 A L H >X S+ 0 0 2 -4,-2.5 4,-2.8 1,-0.2 3,-0.7 0.902 106.9 55.4 -62.8 -40.1 32.9 60.9 13.1 91 111 A G H 3X S+ 0 0 18 -4,-2.0 4,-3.1 1,-0.2 6,-0.4 0.906 100.3 58.4 -59.1 -43.4 34.2 64.3 12.3 92 112 A R H 3<>S+ 0 0 59 -4,-1.8 5,-1.4 1,-0.2 8,-0.3 0.797 113.2 39.4 -57.9 -30.0 36.5 62.9 9.6 93 113 A W H X<5S+ 0 0 9 -4,-1.0 3,-0.7 -3,-0.7 -2,-0.2 0.882 115.1 49.7 -87.0 -43.5 33.5 61.4 7.8 94 114 A L H 3<5S+ 0 0 18 -4,-2.8 -2,-0.2 1,-0.2 -3,-0.2 0.905 119.0 39.9 -61.2 -40.2 31.1 64.3 8.3 95 115 A Q T 3<5S- 0 0 129 -4,-3.1 -1,-0.2 -5,-0.2 -2,-0.2 0.457 108.3-125.6 -87.2 -2.0 33.7 66.7 7.0 96 116 A E T < 5 + 0 0 135 -3,-0.7 -3,-0.2 -5,-0.2 -4,-0.1 0.802 53.9 164.4 60.4 29.8 34.9 64.3 4.3 97 117 A E > < - 0 0 90 -5,-1.4 3,-1.0 -6,-0.4 2,-0.2 0.017 45.3 -68.9 -67.9 178.7 38.4 64.7 5.7 98 118 A P T 3 S+ 0 0 114 0, 0.0 -1,-0.2 0, 0.0 -6,-0.0 -0.522 116.1 18.0 -76.2 139.6 41.3 62.4 4.9 99 119 A G T 3 S+ 0 0 58 1,-0.2 -6,-0.1 -2,-0.2 3,-0.1 0.510 81.1 157.9 83.9 4.0 41.2 58.8 6.3 100 120 A A < - 0 0 30 -3,-1.0 -1,-0.2 -8,-0.3 2,-0.1 -0.235 52.0 -99.4 -58.1 151.1 37.4 58.8 7.0 101 121 A F - 0 0 29 -12,-0.3 2,-0.9 -39,-0.1 -1,-0.1 -0.457 37.5-116.0 -70.0 149.0 35.9 55.4 7.1 102 122 A N + 0 0 101 1,-0.1 3,-0.3 -2,-0.1 4,-0.1 -0.785 42.1 164.4 -94.4 105.3 34.2 54.4 3.9 103 123 A W >> + 0 0 2 -2,-0.9 4,-2.3 1,-0.2 3,-0.5 0.253 41.3 112.3 -99.1 10.7 30.5 53.9 4.5 104 124 A S H 3> S+ 0 0 15 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.828 73.5 56.8 -56.2 -33.3 29.5 54.0 0.8 105 125 A M H 3> S+ 0 0 60 -3,-0.3 4,-1.9 1,-0.2 -1,-0.2 0.920 110.1 44.0 -64.3 -42.8 28.5 50.3 0.8 106 126 A Y H <> S+ 0 0 13 -3,-0.5 4,-2.4 2,-0.2 -2,-0.2 0.892 111.6 53.1 -68.2 -40.4 26.0 50.9 3.7 107 127 A S H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.938 110.0 49.7 -58.9 -45.5 24.6 54.1 2.1 108 128 A Q H X S+ 0 0 5 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.885 111.6 47.2 -61.1 -42.9 24.1 52.1 -1.1 109 129 A H H X S+ 0 0 14 -4,-1.9 4,-3.1 2,-0.2 -1,-0.2 0.841 108.3 54.3 -71.4 -31.5 22.2 49.3 0.7 110 130 A A H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 -1,-0.2 0.911 112.0 46.1 -65.5 -39.9 20.1 51.8 2.6 111 131 A C H X>S+ 0 0 1 -4,-2.1 4,-1.7 -5,-0.2 5,-0.6 0.899 113.4 49.2 -66.6 -40.7 19.1 53.2 -0.7 112 132 A L H <5S+ 0 0 18 -4,-2.3 -2,-0.2 2,-0.2 -1,-0.2 0.944 115.6 42.7 -62.1 -50.7 18.5 49.8 -2.1 113 133 A I H <5S+ 0 0 53 -4,-3.1 -2,-0.2 1,-0.2 -1,-0.2 0.899 111.5 53.1 -64.6 -45.8 16.4 48.7 0.8 114 134 A E H <5S- 0 0 37 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.867 92.3-153.1 -60.5 -35.4 14.4 51.9 1.1 115 135 A G T <5 + 0 0 55 -4,-1.7 -3,-0.1 -5,-0.2 -4,-0.1 0.897 52.6 126.1 64.1 44.8 13.5 51.6 -2.6 116 136 A K S > - 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