==== 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 METHYLTRANSFERASE 20-JUL-96 1XVA . COMPND 2 MOLECULE: GLYCINE N-METHYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR Z.FU,Y.HU,K.KONISHI,Y.TAKATA,H.OGAWA,T.GOMI,M.FUJIOKA,F.TAKU . 586 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 25879.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 418 71.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 42 7.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 82 14.0 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 . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.7 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 . 69 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 70 11.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 128 21.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.0 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 4 0 0 2 2 0 1 4 1 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 2 4 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 0 PARALLEL BRIDGES PER LADDER . 3 1 0 0 0 2 2 0 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 2 0 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 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 1 A V 0 0 189 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 143.0 99.5 95.8 -1.6 2 2 A D - 0 0 157 2,-0.0 2,-0.3 0, 0.0 0, 0.0 -0.940 360.0-178.2-130.9 149.9 97.8 93.2 0.5 3 3 A S - 0 0 88 -2,-0.3 2,-0.4 2,-0.0 0, 0.0 -0.954 15.5-144.0-143.8 156.6 97.4 89.4 0.1 4 4 A V - 0 0 138 -2,-0.3 2,-0.3 2,-0.0 -2,-0.0 -0.926 9.8-164.4-134.5 107.0 95.6 86.7 2.1 5 5 A Y - 0 0 181 -2,-0.4 2,-0.3 2,-0.0 3,-0.1 -0.718 6.7-167.4 -85.0 135.9 97.0 83.2 2.6 6 6 A R - 0 0 124 -2,-0.3 3,-0.1 1,-0.1 -2,-0.0 -0.922 28.1-125.4-117.5 152.8 94.6 80.4 3.8 7 7 A T S S- 0 0 76 -2,-0.3 2,-0.3 1,-0.2 -1,-0.1 0.919 91.9 -5.5 -50.7 -53.8 95.7 76.9 5.1 8 8 A R S S- 0 0 25 525,-0.2 -1,-0.2 502,-0.1 525,-0.2 -0.959 89.3 -83.5-148.0 156.1 93.4 75.2 2.6 9 9 A S > - 0 0 21 523,-1.4 3,-2.3 -2,-0.3 2,-0.4 -0.337 49.3 -95.6 -64.9 148.9 90.9 76.2 0.2 10 10 A L T 3 S+ 0 0 46 1,-0.3 310,-0.3 -2,-0.1 -1,-0.1 -0.449 112.9 25.2 -62.5 114.7 87.4 76.8 1.0 11 11 A G T 3 S+ 0 0 2 -2,-0.4 -1,-0.3 1,-0.4 2,-0.3 0.261 94.1 113.3 107.9 -8.3 85.5 73.6 0.3 12 12 A V < - 0 0 1 -3,-2.3 8,-0.4 520,-0.1 -1,-0.4 -0.671 44.3-162.0-100.8 157.1 88.3 71.0 0.7 13 13 A A - 0 0 2 -2,-0.3 2,-0.3 6,-0.1 -4,-0.1 -0.743 1.5-160.7-123.8 172.4 88.7 68.4 3.4 14 14 A A > - 0 0 2 3,-0.4 3,-1.0 -2,-0.2 365,-0.1 -0.981 29.2-112.6-157.6 150.7 91.5 66.3 4.7 15 15 A E T 3 S+ 0 0 7 -2,-0.3 364,-0.9 1,-0.2 365,-0.3 0.771 106.6 52.4 -55.3 -43.9 91.8 63.0 6.7 16 16 A G T 3 S+ 0 0 3 416,-0.3 394,-0.5 362,-0.1 -1,-0.2 0.923 106.7 50.8 -54.3 -34.3 93.3 64.4 9.9 17 17 A I S < S- 0 0 23 -3,-1.0 -3,-0.4 1,-0.1 3,-0.1 -0.539 79.3 -96.6-134.8 150.1 90.9 67.0 10.6 18 18 A P - 0 0 58 0, 0.0 362,-0.2 0, 0.0 -1,-0.1 -0.323 56.2 -99.7 -64.8 145.6 87.3 68.4 11.1 19 19 A D > - 0 0 25 360,-0.5 3,-1.5 -6,-0.1 4,-0.3 -0.264 48.2 -81.1 -61.0 158.7 85.8 70.0 8.1 20 20 A Q T 3 S+ 0 0 46 -8,-0.4 3,-0.3 1,-0.2 -10,-0.0 0.784 114.9 12.4 -47.1 -61.4 85.7 73.8 7.7 21 21 A Y T > S+ 0 0 79 1,-0.2 3,-1.0 2,-0.1 6,-0.3 0.330 93.7 113.8-107.2 29.4 82.8 75.2 9.6 22 22 A A T < S+ 0 0 31 -3,-1.5 -1,-0.2 1,-0.3 -2,-0.1 0.629 75.4 33.7 -77.8 -32.5 81.9 72.2 11.6 23 23 A D T 3 S+ 0 0 101 -3,-0.3 -1,-0.3 -4,-0.3 2,-0.1 0.049 83.4 130.1-114.8 24.5 82.5 72.9 15.3 24 24 A G S <> S- 0 0 34 -3,-1.0 4,-1.5 1,-0.1 3,-0.4 -0.511 74.4-107.7 -68.6 151.1 81.8 76.6 15.3 25 25 A E H >> S+ 0 0 115 1,-0.2 4,-1.7 2,-0.2 3,-0.6 0.862 120.3 52.0 -33.6 -57.1 79.5 77.8 17.9 26 26 A A H 3> S+ 0 0 19 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.856 105.9 52.8 -60.8 -39.2 76.7 78.3 15.3 27 27 A A H 3> S+ 0 0 0 -3,-0.4 4,-1.4 -6,-0.3 -1,-0.2 0.760 108.2 54.4 -69.4 -18.9 77.0 74.8 13.9 28 28 A R H < S+ 0 0 6 -4,-2.5 3,-0.6 2,-0.1 -1,-0.2 0.842 118.8 44.5 -70.9 -26.7 67.6 70.2 13.9 35 35 A G H >< S+ 0 0 35 -4,-1.6 3,-0.8 -5,-0.2 2,-0.2 0.973 112.8 45.7 -78.7 -52.9 67.6 67.4 16.5 36 36 A D T 3< S+ 0 0 63 -4,-3.0 161,-1.2 1,-0.3 162,-0.8 -0.088 111.7 55.6 -91.3 35.6 65.3 68.7 19.2 37 37 A T T < S+ 0 0 7 -3,-0.6 -1,-0.3 -2,-0.2 159,-0.1 -0.318 82.1 86.2-149.7 51.5 62.8 69.8 16.6 38 38 A R < + 0 0 71 -3,-0.8 2,-0.5 157,-0.2 -2,-0.1 -0.061 53.0 109.0-142.0 42.8 62.2 66.5 14.8 39 39 A S - 0 0 63 156,-0.3 156,-3.1 -3,-0.0 -1,-0.0 -0.904 66.5-136.1-119.5 96.4 59.5 64.9 16.9 40 40 A R B -A 194 0A 72 -2,-0.5 2,-0.4 154,-0.3 154,-0.3 -0.034 7.3-112.8 -66.5 154.9 56.3 65.0 14.7 41 41 A T >> - 0 0 8 152,-2.6 4,-2.5 1,-0.1 3,-0.8 -0.663 13.9-132.6 -89.5 131.9 52.8 66.0 15.5 42 42 A A H 3> S+ 0 0 69 -2,-0.4 4,-2.6 1,-0.3 5,-0.2 0.832 108.7 58.1 -45.2 -42.4 49.9 63.5 15.5 43 43 A E H 3> S+ 0 0 111 2,-0.2 4,-2.6 1,-0.2 -1,-0.3 0.883 108.8 45.0 -55.3 -43.8 47.9 66.1 13.4 44 44 A Y H <> S+ 0 0 0 -3,-0.8 4,-3.4 148,-0.2 5,-0.4 0.965 112.4 49.8 -71.3 -50.0 50.5 66.1 10.8 45 45 A K H X S+ 0 0 64 -4,-2.5 4,-3.1 1,-0.2 5,-0.3 0.948 115.9 42.8 -53.0 -54.4 51.0 62.3 10.6 46 46 A A H X S+ 0 0 67 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.896 115.8 49.2 -59.6 -43.4 47.2 61.8 10.3 47 47 A W H X S+ 0 0 38 -4,-2.6 4,-1.8 -5,-0.2 -2,-0.2 0.937 115.8 41.5 -59.0 -55.1 46.8 64.6 7.8 48 48 A L H X S+ 0 0 0 -4,-3.4 4,-1.7 2,-0.2 5,-0.2 0.909 116.7 48.5 -67.9 -43.0 49.6 63.5 5.6 49 49 A L H X S+ 0 0 9 -4,-3.1 4,-2.8 -5,-0.4 5,-0.3 0.982 111.0 49.4 -60.6 -50.1 48.7 59.7 5.8 50 50 A G H X S+ 0 0 36 -4,-2.5 4,-2.5 -5,-0.3 -1,-0.2 0.878 110.6 50.9 -58.9 -39.6 45.0 60.2 5.1 51 51 A L H X S+ 0 0 16 -4,-1.8 4,-1.4 -5,-0.2 -1,-0.2 0.910 113.5 43.4 -61.7 -45.1 45.7 62.4 2.0 52 52 A L H <>S+ 0 0 0 -4,-1.7 5,-2.6 1,-0.2 3,-0.4 0.962 118.5 44.0 -69.8 -46.7 48.1 60.0 0.4 53 53 A R H ><5S+ 0 0 138 -4,-2.8 3,-1.8 -5,-0.2 -2,-0.2 0.896 107.8 60.5 -62.6 -38.0 45.9 57.0 1.2 54 54 A Q H 3<5S+ 0 0 144 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.803 111.7 39.0 -64.5 -32.3 42.8 58.9 0.1 55 55 A H T 3<5S- 0 0 60 -4,-1.4 -1,-0.3 -3,-0.4 -2,-0.2 0.313 115.7-112.7 -99.9 7.5 44.3 59.3 -3.4 56 56 A G T < 5 + 0 0 41 -3,-1.8 -3,-0.2 1,-0.2 2,-0.2 0.815 53.0 171.3 65.5 34.7 45.8 55.8 -3.5 57 57 A C < + 0 0 1 -5,-2.6 -1,-0.2 -6,-0.2 3,-0.1 -0.534 14.3 155.8 -74.8 140.4 49.5 57.0 -3.5 58 58 A H + 0 0 122 1,-0.4 22,-2.2 -2,-0.2 2,-0.5 0.570 60.8 54.9-137.8 -43.5 52.2 54.3 -3.1 59 59 A R E -b 80 0B 96 20,-0.2 72,-2.0 70,-0.1 73,-1.1 -0.937 69.7-178.1 -98.5 127.4 55.5 55.7 -4.6 60 60 A V E -bc 81 132B 0 20,-2.3 22,-2.3 -2,-0.5 2,-0.6 -0.931 19.7-153.0-126.6 135.5 56.4 59.0 -3.1 61 61 A L E -bc 82 133B 0 71,-2.1 73,-2.6 -2,-0.4 2,-0.7 -0.970 6.6-159.2-103.6 119.5 59.4 61.3 -3.8 62 62 A D E -bc 83 134B 0 20,-3.0 22,-2.9 -2,-0.6 3,-0.4 -0.901 10.8-177.8 -91.6 116.3 60.4 63.5 -0.8 63 63 A V S S+ 0 0 2 71,-2.5 72,-0.1 -2,-0.7 54,-0.1 0.372 77.1 46.2-102.5 5.6 62.3 66.3 -2.6 64 64 A A S S+ 0 0 0 70,-0.4 -1,-0.3 523,-0.1 21,-0.2 -0.433 71.1 160.3-140.7 66.1 63.3 68.1 0.6 65 65 A C > + 0 0 0 19,-2.7 3,-2.0 -3,-0.4 5,-0.4 0.841 5.9 163.8 -59.7 -50.2 64.5 65.2 2.6 66 66 A G T 3 S- 0 0 0 1,-0.3 28,-0.4 242,-0.2 -1,-0.2 -0.415 79.1 -11.8 62.0-136.4 66.7 66.9 5.3 67 67 A T T 3 S- 0 0 0 26,-0.1 -1,-0.3 27,-0.1 30,-0.1 0.332 102.3-108.1 -75.3 -3.1 67.3 64.5 8.2 68 68 A G S <> S+ 0 0 0 -3,-2.0 4,-3.1 -4,-0.1 5,-0.2 0.393 75.6 136.2 99.7 -0.4 64.7 62.3 6.8 69 69 A V H > S+ 0 0 5 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.849 77.8 44.6 -56.0 -41.1 61.9 62.8 9.4 70 70 A D H > S+ 0 0 1 -5,-0.4 4,-1.5 1,-0.2 -1,-0.2 0.961 116.8 45.5 -66.8 -42.7 59.2 63.1 6.8 71 71 A S H > S+ 0 0 0 -6,-0.3 4,-3.2 1,-0.2 -2,-0.2 0.856 107.2 58.4 -69.0 -33.1 60.5 60.1 4.8 72 72 A I H X S+ 0 0 7 -4,-3.1 4,-2.7 2,-0.2 -1,-0.2 0.948 103.7 52.2 -64.8 -46.6 60.9 57.9 7.8 73 73 A M H X S+ 0 0 0 -4,-1.8 4,-1.5 1,-0.2 -1,-0.2 0.912 115.5 41.6 -51.9 -45.9 57.3 58.3 8.7 74 74 A L H <>S+ 0 0 0 -4,-1.5 5,-2.0 2,-0.2 -1,-0.2 0.865 110.6 55.0 -73.4 -36.5 56.3 57.2 5.2 75 75 A V H ><5S+ 0 0 4 -4,-3.2 3,-1.2 1,-0.2 -2,-0.2 0.926 109.6 50.4 -64.6 -40.5 58.9 54.4 5.0 76 76 A E H 3<5S+ 0 0 71 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.832 103.9 56.7 -63.7 -39.5 57.4 53.0 8.2 77 77 A E T 3<5S- 0 0 78 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.086 123.4-100.8 -86.1 16.0 53.8 53.1 6.9 78 78 A G T < 5S+ 0 0 64 -3,-1.2 2,-0.2 1,-0.2 -3,-0.2 0.575 72.8 142.1 90.2 11.3 54.8 50.9 4.0 79 79 A F < - 0 0 21 -5,-2.0 2,-0.8 1,-0.0 -1,-0.2 -0.524 58.1-115.6 -76.5 153.0 55.2 53.4 1.1 80 80 A S E -b 59 0B 78 -22,-2.2 -20,-2.3 -2,-0.2 2,-0.4 -0.797 48.7-171.3 -83.9 107.6 58.0 53.0 -1.5 81 81 A V E -b 60 0B 6 -2,-0.8 30,-1.8 -22,-0.2 2,-0.5 -0.923 25.9-172.0-119.5 135.0 59.9 56.3 -0.8 82 82 A T E -bd 61 111B 21 -22,-2.3 -20,-3.0 -2,-0.4 2,-0.5 -0.990 14.7-164.0-115.6 127.7 62.8 58.1 -2.5 83 83 A S E +bd 62 112B 0 28,-3.1 30,-3.0 -2,-0.5 2,-0.3 -0.957 8.9 178.3-116.7 123.4 64.3 61.0 -0.7 84 84 A V E + d 0 113B 1 -22,-2.9 -19,-2.7 -2,-0.5 2,-0.3 -0.870 5.5 163.0-119.3 157.4 66.5 63.6 -2.2 85 85 A D E - d 0 114B 2 28,-1.3 30,-1.8 -2,-0.3 224,-0.1 -0.964 35.7-136.8-160.4 159.9 68.2 66.7 -0.8 86 86 A A S S+ 0 0 19 222,-1.1 2,-0.8 -2,-0.3 226,-0.5 0.507 81.2 87.0 -92.8 -14.2 71.0 69.0 -1.9 87 87 A S > - 0 0 0 221,-0.5 4,-2.4 224,-0.2 5,-0.2 -0.826 51.3-172.6 -99.3 114.2 72.5 69.3 1.5 88 88 A D H > S+ 0 0 57 -2,-0.8 4,-2.5 2,-0.2 -1,-0.2 0.892 87.4 60.0 -57.5 -45.2 75.1 66.7 2.5 89 89 A K H 4 S+ 0 0 58 1,-0.2 4,-0.3 2,-0.2 -1,-0.2 0.848 114.0 38.1 -60.5 -30.3 75.3 68.0 6.1 90 90 A M H >> S+ 0 0 3 2,-0.2 3,-2.0 -3,-0.1 4,-0.6 0.929 110.5 56.0 -85.3 -41.3 71.6 67.2 6.4 91 91 A L H >X S+ 0 0 1 -4,-2.4 4,-2.8 1,-0.3 3,-1.0 0.842 92.2 76.6 -59.1 -39.0 71.4 64.0 4.4 92 92 A K H 3X S+ 0 0 35 -4,-2.5 4,-1.8 1,-0.2 -1,-0.3 0.845 93.2 50.3 -32.2 -42.4 74.0 62.6 6.7 93 93 A Y H <> S+ 0 0 51 -3,-2.0 4,-1.3 -4,-0.3 -1,-0.2 0.833 110.9 46.2 -81.4 -25.8 71.3 62.2 9.3 94 94 A A H < S+ 0 0 27 -4,-2.1 3,-1.8 1,-0.3 -1,-0.2 0.928 109.0 50.8 -67.9 -45.2 71.9 52.2 8.3 100 100 A N H 3< S+ 0 0 113 -4,-2.1 -1,-0.3 1,-0.3 3,-0.2 0.810 120.0 36.9 -68.1 -27.1 70.8 51.7 11.9 101 101 A R T >< S+ 0 0 53 -4,-1.9 3,-2.1 -3,-0.2 -1,-0.3 0.192 80.2 119.1-106.5 21.2 67.5 50.3 10.8 102 102 A R T < + 0 0 48 -3,-1.8 -1,-0.1 1,-0.3 -2,-0.1 0.538 68.2 65.6 -63.5 -12.0 68.9 48.5 7.7 103 103 A K T 3 S+ 0 0 143 -3,-0.2 -1,-0.3 -4,-0.2 -2,-0.1 0.551 79.7 83.1 -85.5 -16.4 67.6 45.2 9.1 104 104 A E S X> S- 0 0 82 -3,-2.1 4,-1.6 1,-0.1 3,-0.6 -0.852 86.1-133.1 -84.5 120.2 64.0 46.1 8.9 105 105 A P H 3> S+ 0 0 90 0, 0.0 4,-0.8 0, 0.0 -1,-0.1 0.780 101.8 56.3 -53.2 -27.8 63.1 45.2 5.2 106 106 A A H >4 S+ 0 0 43 1,-0.2 3,-1.2 2,-0.2 4,-0.3 0.976 108.7 47.9 -70.8 -42.7 61.2 48.6 4.5 107 107 A F H X4 S+ 0 0 2 -3,-0.6 3,-0.8 1,-0.3 -1,-0.2 0.755 103.5 60.1 -68.0 -30.5 64.3 50.6 5.6 108 108 A D H 3< S+ 0 0 31 -4,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.766 106.7 49.9 -62.5 -24.5 66.5 48.4 3.4 109 109 A K T << S+ 0 0 135 -3,-1.2 2,-0.4 -4,-0.8 -2,-0.2 0.493 81.7 113.9 -95.3 -0.8 64.4 49.6 0.5 110 110 A W < - 0 0 3 -3,-0.8 2,-0.5 -4,-0.3 -28,-0.2 -0.518 54.7-151.5 -74.1 122.1 64.5 53.4 1.2 111 111 A V E -d 82 0B 63 -30,-1.8 -28,-3.1 -2,-0.4 2,-0.5 -0.826 15.2-179.2 -92.2 131.1 66.4 55.3 -1.5 112 112 A I E +d 83 0B 7 -2,-0.5 2,-0.3 -30,-0.2 -28,-0.2 -0.994 14.2 168.6-128.4 126.4 68.2 58.5 -0.3 113 113 A E E -d 84 0B 90 -30,-3.0 -28,-1.3 -2,-0.5 2,-0.3 -0.915 38.6-108.1-138.6 155.3 70.0 60.4 -3.0 114 114 A E E +d 85 0B 76 -2,-0.3 2,-0.3 -30,-0.2 -28,-0.2 -0.693 52.6 143.8 -78.6 138.0 71.7 63.7 -3.6 115 115 A A - 0 0 8 -30,-1.8 2,-0.4 -2,-0.3 -28,-0.1 -0.943 35.8-141.9-168.6 158.3 69.7 66.0 -6.0 116 116 A N > - 0 0 33 -2,-0.3 3,-1.7 1,-0.1 4,-0.5 -0.983 22.1-127.2-128.2 142.9 68.9 69.7 -6.5 117 117 A W G > S+ 0 0 5 192,-0.4 3,-0.7 -2,-0.4 4,-0.3 0.817 109.0 59.1 -60.3 -32.0 65.6 71.2 -7.5 118 118 A L G 3 S+ 0 0 45 1,-0.2 -1,-0.3 2,-0.1 3,-0.1 0.724 122.1 20.9 -67.3 -27.4 67.4 73.1 -10.2 119 119 A T G X> S+ 0 0 45 -3,-1.7 3,-2.2 1,-0.1 4,-0.8 0.147 86.7 129.5-123.5 16.3 68.7 70.0 -12.0 120 120 A L H X> + 0 0 0 -3,-0.7 4,-2.2 -4,-0.5 3,-1.0 0.810 68.8 55.1 -55.7 -38.1 66.2 67.6 -10.5 121 121 A D H 34 S+ 0 0 82 -4,-0.3 -1,-0.3 1,-0.3 5,-0.2 0.816 109.2 47.7 -59.2 -34.5 65.2 66.1 -13.8 122 122 A K H <4 S+ 0 0 169 -3,-2.2 -1,-0.3 1,-0.1 -2,-0.2 0.526 117.6 43.7 -80.8 -13.9 68.9 65.2 -14.5 123 123 A D H << S+ 0 0 68 -3,-1.0 -2,-0.2 -4,-0.8 -1,-0.1 0.703 109.8 47.3-106.9 -29.7 69.3 63.7 -11.1 124 124 A V S < S- 0 0 13 -4,-2.2 2,-1.0 -5,-0.2 -1,-0.2 -0.973 71.8-135.3-121.3 128.2 66.2 61.6 -10.4 125 125 A P + 0 0 113 0, 0.0 3,-0.1 0, 0.0 -3,-0.1 -0.767 24.3 175.6 -79.0 104.5 64.6 59.1 -12.8 126 126 A A > + 0 0 19 -2,-1.0 3,-2.1 1,-0.2 2,-0.7 0.861 10.9 179.9 -66.7 -40.3 60.9 59.8 -12.6 127 127 A G T 3 S- 0 0 71 1,-0.3 -1,-0.2 -3,-0.2 3,-0.1 -0.630 81.5 -7.6 66.6-110.2 60.3 57.2 -15.3 128 128 A D T 3 S- 0 0 156 -2,-0.7 -1,-0.3 1,-0.2 2,-0.1 0.524 121.3 -97.8 -89.5 -3.4 56.5 57.5 -15.5 129 129 A G < - 0 0 8 -3,-2.1 -1,-0.2 36,-0.1 35,-0.2 -0.130 36.8 -78.6 108.7 160.9 56.5 59.8 -12.4 130 130 A F E - e 0 164B 2 33,-3.4 35,-3.1 1,-0.1 -70,-0.2 -0.537 30.6-125.5 -92.0 162.5 55.9 59.5 -8.8 131 131 A D E S+ 0 0 22 -72,-2.0 38,-2.3 1,-0.3 2,-0.3 0.846 94.4 6.2 -74.7 -42.6 52.4 59.2 -7.1 132 132 A A E -ce 60 169B 0 -73,-1.1 -71,-2.1 36,-0.2 2,-0.4 -0.985 63.4-155.8-134.8 145.1 53.0 62.1 -4.8 133 133 A V E -ce 61 170B 0 36,-2.0 38,-2.3 -2,-0.3 2,-0.4 -0.991 18.3-161.5-108.6 134.9 55.9 64.6 -4.6 134 134 A I E +ce 62 171B 0 -73,-2.6 -71,-2.5 -2,-0.4 -70,-0.4 -0.944 24.9 165.9-117.3 141.7 56.3 66.2 -1.1 135 135 A C E + e 0 172B 0 36,-1.9 38,-1.5 -2,-0.4 5,-0.4 -0.537 30.8 155.9-146.1 70.1 58.2 69.4 -0.2 136 136 A L + 0 0 0 451,-0.4 3,-0.4 36,-0.2 -66,-0.1 -0.356 36.2 59.4 -98.4 169.8 57.0 70.1 3.3 137 137 A G S S- 0 0 3 1,-0.2 -1,-0.2 -2,-0.1 37,-0.0 0.576 117.1 -74.8 91.9 7.4 58.4 72.1 6.2 138 138 A N S S+ 0 0 1 -3,-0.3 -1,-0.2 449,-0.2 -2,-0.1 0.759 91.5 138.7 72.5 34.0 58.8 75.4 4.5 139 139 A S > + 0 0 0 -3,-0.4 3,-1.9 1,-0.2 170,-0.4 0.788 55.0 66.7 -83.0 -23.2 61.8 74.2 2.6 140 140 A F G > S+ 0 0 1 33,-0.5 3,-2.1 -5,-0.4 -1,-0.2 0.920 92.0 65.0 -68.7 -32.8 61.0 75.7 -0.8 141 141 A A G 3 S+ 0 0 0 1,-0.3 102,-2.8 32,-0.3 -1,-0.3 0.536 82.9 78.3 -66.4 -5.7 61.5 79.2 0.7 142 142 A H G < S+ 0 0 10 -3,-1.9 -1,-0.3 100,-0.2 -2,-0.2 0.693 71.8 92.2 -71.7 -21.5 65.2 78.4 1.3 143 143 A L S < S- 0 0 12 -3,-2.1 10,-0.0 -4,-0.2 100,-0.0 -0.689 72.8-145.8 -81.5 112.5 65.9 79.0 -2.3 144 144 A P - 0 0 66 0, 0.0 2,-0.8 0, 0.0 71,-0.1 -0.136 14.6-116.5 -71.5 165.2 67.0 82.7 -2.7 145 145 A D > + 0 0 6 69,-0.3 3,-0.5 1,-0.2 5,-0.1 -0.801 39.9 167.2-108.9 98.1 66.2 84.8 -5.7 146 146 A S T 3 S+ 0 0 89 -2,-0.8 -1,-0.2 1,-0.2 4,-0.1 0.695 70.2 48.1 -89.2 -22.2 69.5 85.7 -7.0 147 147 A K T 3 S- 0 0 141 2,-0.4 2,-1.1 1,-0.0 -1,-0.2 0.306 101.5-122.9-103.0 10.3 68.7 87.1 -10.4 148 148 A G S < S+ 0 0 35 -3,-0.5 2,-0.3 1,-0.1 -2,-0.1 -0.025 94.6 77.8 78.7 -39.1 66.0 89.5 -9.1 149 149 A D S S- 0 0 71 -2,-1.1 2,-1.3 1,-0.0 3,-0.5 -0.723 99.1-113.0 -86.5 156.8 63.3 88.0 -11.5 150 150 A Q S > S+ 0 0 40 -2,-0.3 4,-2.3 1,-0.2 3,-0.2 0.027 72.2 132.4 -93.6 48.3 62.1 84.7 -10.0 151 151 A S H > S+ 0 0 41 -2,-1.3 4,-2.7 1,-0.3 -1,-0.2 0.883 70.7 52.1 -67.6 -38.2 63.6 82.5 -12.7 152 152 A E H > S+ 0 0 57 -3,-0.5 4,-2.2 2,-0.2 -1,-0.3 0.889 108.8 49.8 -61.8 -38.8 65.2 80.1 -10.3 153 153 A H H > S+ 0 0 0 -3,-0.2 4,-2.4 1,-0.2 5,-0.2 0.912 112.2 50.0 -62.8 -40.7 61.9 79.5 -8.4 154 154 A R H X S+ 0 0 94 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.943 111.9 45.9 -60.0 -51.8 60.2 78.9 -11.8 155 155 A L H X S+ 0 0 75 -4,-2.7 4,-2.6 2,-0.2 3,-0.3 0.983 114.9 47.3 -55.3 -58.9 62.8 76.4 -12.9 156 156 A A H X S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.879 112.9 48.3 -48.7 -46.0 62.8 74.5 -9.6 157 157 A L H X S+ 0 0 1 -4,-2.4 4,-2.5 -5,-0.2 -1,-0.2 0.886 111.4 50.6 -71.2 -34.1 59.0 74.4 -9.4 158 158 A K H X S+ 0 0 113 -4,-2.2 4,-2.5 -3,-0.3 -2,-0.2 0.946 110.4 48.6 -68.8 -45.4 58.8 73.1 -13.0 159 159 A N H X S+ 0 0 4 -4,-2.6 4,-0.6 2,-0.2 -2,-0.2 0.913 112.6 49.0 -63.0 -38.0 61.4 70.4 -12.3 160 160 A I H >< S+ 0 0 0 -4,-2.4 3,-1.1 -5,-0.2 4,-0.3 0.926 110.0 52.7 -62.6 -44.1 59.4 69.4 -9.2 161 161 A A H >< S+ 0 0 4 -4,-2.5 3,-1.9 1,-0.2 -2,-0.2 0.900 101.4 60.8 -54.8 -41.9 56.2 69.4 -11.3 162 162 A S H 3< S+ 0 0 55 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.738 94.9 60.9 -65.4 -19.8 57.7 67.1 -13.8 163 163 A M T << S+ 0 0 6 -3,-1.1 -33,-3.4 -4,-0.6 2,-0.5 0.581 84.6 96.3 -83.9 -8.3 58.3 64.3 -11.2 164 164 A V E < S-e 130 0B 3 -3,-1.9 -33,-0.2 -4,-0.3 6,-0.1 -0.704 75.6-131.8 -85.5 126.2 54.6 64.1 -10.6 165 165 A R E > - 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