==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-MAR-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 05-MAR-12 4E16 . COMPND 2 MOLECULE: PRECORRIN-4 C(11)-METHYLTRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: CLOSTRIDIUM DIFFICILE; . AUTHOR J.OSIPIUK,B.NOCEK,M.MAKOWSKA-GRZYSKA,L.PAPAZISI,W.F.ANDERSON . 229 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12453.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 166 72.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 27 11.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 22 9.6 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 . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 19 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 37 16.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 54 23.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 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 1 0 1 0 2 1 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 3 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 . 2 0 0 1 1 1 0 0 0 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 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 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 M 0 0 138 0, 0.0 2,-0.3 0, 0.0 104,-0.0 0.000 360.0 360.0 360.0-148.5 16.7 44.1 13.0 2 2 A N - 0 0 32 102,-0.1 102,-0.1 73,-0.0 73,-0.1 -0.845 360.0-165.1-122.6 89.6 19.7 42.1 14.3 3 3 A K - 0 0 76 -2,-0.3 74,-0.6 1,-0.1 2,-0.5 -0.340 26.3-109.3 -74.1 154.4 18.0 38.7 13.8 4 4 A V E -ab 77 105A 0 100,-1.9 102,-2.3 72,-0.1 2,-0.7 -0.787 41.3-138.5 -80.4 131.9 19.2 35.5 15.4 5 5 A H E -ab 78 106A 23 72,-3.0 74,-2.1 -2,-0.5 2,-0.6 -0.876 13.8-159.7-105.2 112.8 20.5 33.6 12.3 6 6 A F E -ab 79 107A 0 100,-3.3 102,-2.4 -2,-0.7 2,-0.4 -0.800 21.7-171.3 -88.2 123.0 19.8 29.9 12.0 7 7 A V E -ab 80 108A 0 72,-2.4 74,-2.5 -2,-0.6 2,-0.5 -0.954 23.7-132.4-128.7 127.5 22.3 28.6 9.6 8 8 A G E -a 81 0A 0 100,-2.3 10,-0.6 -2,-0.4 74,-0.2 -0.731 13.5-160.1 -81.9 125.3 22.7 25.2 7.9 9 9 A A - 0 0 4 72,-2.6 3,-0.4 -2,-0.5 73,-0.2 0.532 32.8-128.1 -79.9 -16.9 26.2 23.9 8.2 10 10 A G B -E 83 0B 1 73,-1.2 73,-2.2 71,-0.4 -1,-0.3 -0.385 43.6 -52.9 85.7-172.4 26.0 21.4 5.3 11 11 A P S S- 0 0 6 0, 0.0 183,-0.2 0, 0.0 -1,-0.2 0.480 94.1 -70.0 -92.3 1.7 27.0 17.8 5.5 12 12 A G S S+ 0 0 7 1,-0.5 2,-0.1 -3,-0.4 30,-0.1 -0.208 94.5 112.6 148.9 -47.7 30.5 18.0 6.9 13 13 A D > - 0 0 61 179,-0.2 3,-2.1 1,-0.1 -1,-0.5 -0.394 65.5-132.6 -60.1 123.2 32.9 19.5 4.4 14 14 A K G > S+ 0 0 61 1,-0.3 3,-1.0 2,-0.2 -1,-0.1 0.877 105.3 47.8 -31.8 -55.6 34.1 22.9 5.5 15 15 A E G 3 S+ 0 0 141 1,-0.3 -1,-0.3 -5,-0.0 -2,-0.1 0.406 90.5 79.1 -82.6 -3.2 33.4 24.3 2.0 16 16 A L G < + 0 0 60 -3,-2.1 95,-0.6 -7,-0.2 -1,-0.3 0.305 66.5 107.6 -90.9 7.9 30.0 22.9 1.6 17 17 A I S < S- 0 0 15 -3,-1.0 -8,-0.1 -4,-0.1 2,-0.1 -0.573 83.8-100.2 -70.0 149.5 28.5 25.7 3.8 18 18 A T > - 0 0 44 -10,-0.6 4,-3.2 91,-0.2 5,-0.2 -0.380 23.6-115.8 -60.9 148.0 26.6 28.2 1.6 19 19 A L H > S+ 0 0 130 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.950 120.7 50.9 -43.7 -50.9 28.2 31.4 0.7 20 20 A K H > S+ 0 0 142 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.903 109.9 49.8 -59.2 -44.3 25.5 33.1 2.8 21 21 A G H > S+ 0 0 0 1,-0.2 4,-3.0 2,-0.2 -1,-0.2 0.939 108.7 51.8 -56.0 -50.6 26.2 30.9 5.7 22 22 A Y H X S+ 0 0 95 -4,-3.2 4,-3.0 1,-0.2 -2,-0.2 0.899 108.5 50.7 -56.3 -44.3 29.9 31.6 5.4 23 23 A K H X S+ 0 0 130 -4,-2.2 4,-0.9 2,-0.2 -1,-0.2 0.921 114.0 44.4 -59.7 -45.6 29.3 35.4 5.5 24 24 A L H X S+ 0 0 35 -4,-2.2 4,-0.5 1,-0.2 3,-0.5 0.923 116.7 46.0 -67.6 -44.2 27.1 35.2 8.6 25 25 A L H >< S+ 0 0 0 -4,-3.0 3,-0.9 -5,-0.2 22,-0.4 0.894 109.6 52.1 -65.2 -41.2 29.4 32.8 10.3 26 26 A S H 3< S+ 0 0 28 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.700 117.3 41.5 -75.2 -11.3 32.6 34.7 9.5 27 27 A N H 3< S+ 0 0 94 -4,-0.9 49,-0.3 -3,-0.5 -1,-0.2 0.344 87.0 123.8-107.6 0.2 30.9 37.9 11.0 28 28 A A << - 0 0 0 -3,-0.9 19,-0.5 -4,-0.5 49,-0.2 -0.392 41.9-168.4 -74.4 140.2 29.2 36.4 14.0 29 29 A D S S+ 0 0 42 47,-2.2 22,-2.1 1,-0.3 2,-0.4 0.674 84.4 30.6 -91.1 -28.5 29.8 37.7 17.6 30 30 A V E -cd 51 77A 4 46,-2.5 48,-3.1 20,-0.2 2,-0.4 -0.993 69.9-175.2-137.5 127.1 28.1 34.7 19.1 31 31 A V E -cd 52 78A 0 20,-2.4 22,-2.4 -2,-0.4 2,-0.5 -0.983 8.4-168.5-127.2 134.9 27.9 31.1 17.7 32 32 A I E -cd 53 79A 0 46,-2.5 48,-1.9 -2,-0.4 2,-0.3 -0.975 19.5-179.7-124.6 112.8 26.0 28.2 19.0 33 33 A Y E -cd 54 80A 39 20,-2.2 22,-1.7 -2,-0.5 2,-1.6 -0.815 36.1-104.6-120.7 156.5 26.9 25.0 17.4 34 34 A A >> - 0 0 15 46,-1.0 3,-1.7 -2,-0.3 4,-1.3 -0.597 46.5-120.3 -83.0 74.3 25.9 21.4 17.7 35 35 A G T 34 S- 0 0 10 -2,-1.6 3,-0.2 1,-0.3 -1,-0.1 0.160 84.8 -10.8 47.7-113.9 28.7 19.7 19.5 36 36 A S T 34 S+ 0 0 96 1,-0.2 -1,-0.3 3,-0.1 -2,-0.0 0.378 122.5 77.2-107.9 0.7 30.3 16.9 17.6 37 37 A L T <4 S+ 0 0 111 -3,-1.7 2,-0.4 2,-0.1 -2,-0.2 0.615 89.3 61.8 -79.0 -19.8 27.6 16.8 14.8 38 38 A V S < S- 0 0 1 -4,-1.3 44,-0.0 -3,-0.2 -5,-0.0 -0.907 99.1-106.8-108.2 137.8 29.0 19.9 13.2 39 39 A N > - 0 0 12 -2,-0.4 3,-1.8 1,-0.1 4,-0.4 -0.525 20.8-145.2 -64.3 118.1 32.5 19.8 11.8 40 40 A P G > S+ 0 0 81 0, 0.0 3,-1.7 0, 0.0 4,-0.4 0.830 93.3 75.2 -53.7 -36.2 34.8 21.9 14.1 41 41 A E G > S+ 0 0 82 1,-0.3 3,-1.6 2,-0.2 4,-0.3 0.838 87.0 64.6 -44.4 -36.0 36.9 23.1 11.1 42 42 A L G X S+ 0 0 3 -3,-1.8 3,-2.1 1,-0.3 -1,-0.3 0.870 89.0 65.9 -53.8 -42.0 33.9 25.4 10.3 43 43 A L G X S+ 0 0 32 -3,-1.7 3,-1.3 -4,-0.4 -1,-0.3 0.649 84.8 73.6 -57.3 -17.0 34.5 27.3 13.5 44 44 A E G < S+ 0 0 136 -3,-1.6 -1,-0.3 -4,-0.4 -2,-0.2 0.655 83.6 67.5 -74.1 -17.0 37.8 28.5 12.0 45 45 A Y G < S+ 0 0 50 -3,-2.1 -1,-0.3 -4,-0.3 -2,-0.2 0.644 85.3 100.3 -72.8 -17.1 35.9 30.8 9.8 46 46 A C S < S- 0 0 19 -3,-1.3 -20,-0.2 -4,-0.2 -19,-0.1 -0.342 84.4 -89.4 -70.0 151.6 34.8 32.8 12.9 47 47 A K > - 0 0 86 -19,-0.5 3,-1.6 -22,-0.4 -1,-0.1 -0.153 37.0-112.7 -51.6 149.4 36.3 36.2 14.2 48 48 A E T 3 S+ 0 0 182 1,-0.3 2,-0.3 -4,-0.0 -1,-0.1 0.896 117.7 44.4 -53.5 -40.3 39.3 36.0 16.6 49 49 A D T 3 S+ 0 0 139 2,-0.1 2,-0.3 0, 0.0 -1,-0.3 -0.264 85.0 131.8-106.7 45.9 37.1 37.4 19.4 50 50 A C < - 0 0 17 -3,-1.6 2,-0.7 -2,-0.3 -20,-0.2 -0.725 54.3-128.7 -96.6 149.0 34.0 35.4 18.8 51 51 A Q E -c 30 0A 101 -22,-2.1 -20,-2.4 -2,-0.3 2,-0.4 -0.881 23.9-162.3-107.3 116.4 32.1 33.6 21.6 52 52 A I E -c 31 0A 76 -2,-0.7 2,-0.4 -22,-0.2 -20,-0.2 -0.761 8.5-175.5-104.2 135.0 31.5 30.0 20.9 53 53 A H E -c 32 0A 47 -22,-2.4 -20,-2.2 -2,-0.4 2,-0.9 -0.997 18.7-142.3-130.5 137.3 28.9 27.9 22.8 54 54 A N E > -c 33 0A 35 -2,-0.4 3,-3.3 -22,-0.2 -20,-0.2 -0.802 5.5-161.5-106.2 98.6 28.5 24.2 22.3 55 55 A S G > S+ 0 0 12 -22,-1.7 3,-2.6 -2,-0.9 -21,-0.2 0.787 83.7 76.4 -48.6 -39.2 24.8 23.3 22.5 56 56 A A G 3 S+ 0 0 65 -23,-0.6 -1,-0.3 1,-0.3 -22,-0.1 0.736 101.6 41.2 -41.3 -29.6 25.6 19.7 23.1 57 57 A H G < S+ 0 0 162 -3,-3.3 2,-0.3 2,-0.1 -1,-0.3 -0.000 108.8 77.1-109.3 30.8 26.5 20.7 26.7 58 58 A M < - 0 0 30 -3,-2.6 2,-0.2 -5,-0.1 -5,-0.0 -0.973 69.1-131.7-140.4 142.5 23.6 23.1 27.2 59 59 A D >> - 0 0 108 -2,-0.3 4,-1.5 1,-0.1 3,-0.8 -0.481 42.2 -96.0 -83.3 171.2 19.8 22.9 28.0 60 60 A L H 3> S+ 0 0 54 1,-0.2 4,-2.2 2,-0.2 3,-0.4 0.924 121.6 55.0 -47.8 -56.1 17.3 24.9 26.0 61 61 A Q H 3> S+ 0 0 95 1,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.736 105.7 53.3 -58.4 -25.4 17.0 27.8 28.4 62 62 A E H <> S+ 0 0 85 -3,-0.8 4,-1.8 2,-0.2 -1,-0.3 0.886 106.2 51.1 -79.4 -41.3 20.8 28.3 28.3 63 63 A I H X S+ 0 0 12 -4,-1.5 4,-2.5 -3,-0.4 3,-0.5 0.987 112.2 48.6 -53.2 -56.7 20.9 28.6 24.5 64 64 A I H X S+ 0 0 1 -4,-2.2 4,-3.4 1,-0.3 5,-0.3 0.869 109.4 50.6 -53.2 -47.2 18.1 31.2 24.7 65 65 A D H X S+ 0 0 66 -4,-1.9 4,-2.3 1,-0.2 -1,-0.3 0.880 111.3 49.7 -56.2 -37.4 19.8 33.2 27.4 66 66 A V H X S+ 0 0 25 -4,-1.8 4,-1.6 -3,-0.5 -2,-0.2 0.930 113.7 45.8 -72.4 -42.3 22.9 33.2 25.3 67 67 A M H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 3,-0.4 0.964 112.9 49.1 -57.5 -58.8 20.8 34.4 22.2 68 68 A R H X S+ 0 0 61 -4,-3.4 4,-2.6 1,-0.3 -2,-0.2 0.876 110.5 50.3 -54.9 -44.5 18.9 37.1 24.1 69 69 A E H X S+ 0 0 117 -4,-2.3 4,-1.0 -5,-0.3 -1,-0.3 0.865 107.6 54.6 -67.5 -33.5 22.0 38.5 25.6 70 70 A G H ><>S+ 0 0 3 -4,-1.6 5,-2.1 -3,-0.4 3,-0.8 0.961 110.7 45.9 -58.1 -51.9 23.6 38.6 22.1 71 71 A I H ><5S+ 0 0 17 -4,-2.5 3,-2.1 1,-0.2 -2,-0.2 0.952 110.1 52.7 -55.8 -52.5 20.7 40.6 20.8 72 72 A E H 3<5S+ 0 0 127 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.610 112.8 44.4 -62.9 -18.7 20.6 43.1 23.7 73 73 A N T <<5S- 0 0 103 -4,-1.0 -1,-0.3 -3,-0.8 -2,-0.2 0.232 119.0-110.7-105.6 10.9 24.3 43.9 23.3 74 74 A N T < 5 + 0 0 131 -3,-2.1 2,-0.4 1,-0.2 -3,-0.2 0.978 65.2 152.1 57.5 61.8 24.0 44.2 19.5 75 75 A K < - 0 0 55 -5,-2.1 2,-0.4 -73,-0.1 -1,-0.2 -0.963 50.8-115.0-123.4 133.0 25.9 41.1 18.7 76 76 A S - 0 0 21 -2,-0.4 -46,-2.5 -49,-0.3 -47,-2.2 -0.612 34.8-156.9 -73.7 127.8 25.4 39.0 15.6 77 77 A V E -ad 4 30A 0 -74,-0.6 -72,-3.0 -2,-0.4 2,-0.4 -0.915 12.3-175.5-117.8 122.1 24.1 35.6 16.7 78 78 A V E -ad 5 31A 0 -48,-3.1 -46,-2.5 -2,-0.5 2,-0.7 -0.985 11.7-163.7-122.5 122.4 24.5 32.5 14.6 79 79 A R E -ad 6 32A 18 -74,-2.1 -72,-2.4 -2,-0.4 2,-0.7 -0.918 17.7-156.5 -97.3 105.6 23.0 29.0 15.6 80 80 A L E -ad 7 33A 0 -48,-1.9 -46,-1.0 -2,-0.7 2,-0.4 -0.751 14.1-178.1 -88.7 116.4 24.8 26.5 13.3 81 81 A Q E -a 8 0A 14 -74,-2.5 -72,-2.6 -2,-0.7 -71,-0.4 -0.867 30.7 -96.5-117.5 149.3 22.9 23.3 12.8 82 82 A T S S- 0 0 57 -2,-0.4 -44,-0.1 -74,-0.2 28,-0.1 -0.226 79.2 -31.5 -66.7 153.4 23.9 20.2 10.9 83 83 A G B S-E 10 0B 5 -73,-2.2 -73,-1.2 28,-0.1 2,-0.4 -0.211 118.9 -28.1 41.1-119.6 22.9 19.6 7.3 84 84 A D > - 0 0 27 3,-0.3 3,-1.0 -76,-0.1 29,-0.1 -0.991 49.4-144.0-126.1 141.1 19.5 21.2 7.0 85 85 A F T 3> S+ 0 0 22 -2,-0.4 4,-0.7 1,-0.3 6,-0.5 0.413 93.4 74.0 -83.1 -6.6 17.0 21.7 9.8 86 86 A S T 34 S+ 0 0 86 1,-0.2 2,-0.5 2,-0.1 -1,-0.3 0.667 100.7 49.2 -75.5 -18.7 13.9 21.0 7.7 87 87 A I T <4 S- 0 0 56 -3,-1.0 -3,-0.3 1,-0.1 -1,-0.2 -0.892 141.5 -22.5-124.6 101.2 14.9 17.3 7.7 88 88 A Y T 4 S+ 0 0 90 -2,-0.5 -2,-0.1 -3,-0.2 -1,-0.1 0.910 97.5 130.2 69.7 52.9 15.7 16.2 11.3 89 89 A G < - 0 0 12 -4,-0.7 -4,-0.1 -8,-0.0 -3,-0.1 0.589 50.3-151.9-120.6 -19.0 16.4 19.6 12.8 90 90 A S > + 0 0 91 1,-0.2 4,-0.5 -5,-0.1 3,-0.2 0.768 48.2 138.7 50.6 30.2 14.5 20.3 16.0 91 91 A I H > + 0 0 23 -6,-0.5 4,-1.9 1,-0.2 -1,-0.2 0.698 51.3 79.9 -75.8 -20.2 14.6 24.1 15.3 92 92 A R H > S+ 0 0 181 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.906 87.4 54.4 -58.4 -45.9 10.9 24.4 16.5 93 93 A E H > S+ 0 0 121 -3,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.938 111.1 44.5 -51.9 -52.5 11.8 24.5 20.2 94 94 A Q H X S+ 0 0 9 -4,-0.5 4,-1.5 2,-0.2 -1,-0.2 0.844 114.4 50.2 -66.1 -33.0 14.2 27.4 19.7 95 95 A V H >X S+ 0 0 17 -4,-1.9 4,-2.2 2,-0.2 3,-0.5 0.976 109.7 47.2 -72.1 -54.2 11.8 29.3 17.5 96 96 A E H >X S+ 0 0 104 -4,-2.7 4,-2.3 1,-0.3 3,-0.6 0.952 111.2 53.5 -49.8 -50.8 8.8 29.1 19.7 97 97 A D H 3X S+ 0 0 30 -4,-2.3 4,-1.1 -5,-0.3 -1,-0.3 0.843 109.4 48.8 -54.1 -35.0 11.0 30.1 22.7 98 98 A L H S+ 0 0 1 -4,-1.5 5,-2.7 -3,-0.5 4,-0.6 0.792 107.7 53.4 -75.2 -31.2 12.1 33.2 20.7 99 99 A N H X<5S+ 0 0 82 -4,-2.2 3,-2.8 -3,-0.6 -2,-0.2 0.990 102.5 58.9 -61.1 -59.1 8.6 34.2 19.7 100 100 A K H 3<5S+ 0 0 166 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.838 114.1 38.1 -24.6 -54.6 7.8 34.0 23.5 101 101 A L H 3<5S- 0 0 75 -4,-1.1 -1,-0.3 -5,-0.2 -2,-0.2 0.473 112.1-118.9 -90.3 -3.1 10.5 36.8 23.8 102 102 A N T <<5 + 0 0 146 -3,-2.8 2,-0.5 -4,-0.6 -3,-0.2 0.884 56.4 157.8 69.3 38.2 9.7 38.7 20.6 103 103 A I < - 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0 0 64 -3,-1.9 2,-0.3 -6,-0.2 -6,-0.2 -0.162 29.9-165.8 -52.4 144.8 33.8 9.3 5.2 198 200 A K E -I 190 0D 103 -8,-1.4 -8,-2.3 2,-0.0 2,-0.5 -0.996 7.5-153.9-135.5 146.4 33.6 5.5 4.3 199 201 A I E -I 189 0D 64 -2,-0.3 2,-0.6 -10,-0.2 -10,-0.2 -0.965 5.1-168.8-122.8 121.1 31.4 3.8 1.8 200 202 A V E -I 188 0D 7 -12,-3.3 -12,-2.5 -2,-0.5 2,-0.3 -0.965 14.5-169.0-112.5 116.6 30.2 0.2 2.0 201 203 A K E +I 187 0D 88 -2,-0.6 2,-0.3 -14,-0.2 -14,-0.2 -0.773 27.4 106.2-100.4 142.6 28.7 -0.9 -1.3 202 204 A G E -I 186 0D 11 -16,-2.4 -16,-2.2 -2,-0.3 2,-0.3 -0.902 57.2 -77.8-174.6-155.2 26.7 -4.2 -1.7 203 205 A T E > -I 185 0D 35 -18,-0.3 4,-1.0 -2,-0.3 3,-0.5 -0.791 50.4 -90.7-124.3 175.4 23.4 -5.8 -2.2 204 206 A L T 4 S+ 0 0 1 -20,-1.2 4,-0.4 -22,-0.4 3,-0.2 0.833 121.3 47.2 -58.4 -35.0 20.6 -6.7 0.3 205 207 A S T 4 S+ 0 0 60 -23,-1.6 4,-0.3 1,-0.2 -1,-0.2 0.840 119.6 34.6 -71.7 -34.4 21.9 -10.2 1.1 206 208 A D T > S+ 0 0 51 -3,-0.5 4,-1.9 -24,-0.3 -1,-0.2 0.359 94.2 80.0-108.9 2.8 25.5 -9.3 1.7 207 209 A I H X S+ 0 0 0 -4,-1.0 4,-2.4 2,-0.2 5,-0.2 0.793 83.8 62.8 -91.9 -27.9 25.6 -5.9 3.3 208 210 A A H > S+ 0 0 20 -4,-0.4 4,-2.1 2,-0.2 -1,-0.2 0.967 111.8 40.6 -57.1 -57.0 24.8 -7.0 6.8 209 211 A V H > S+ 0 0 75 -4,-0.3 4,-2.9 2,-0.2 5,-0.3 0.937 113.8 53.2 -49.4 -55.0 28.0 -9.0 6.8 210 212 A K H X S+ 0 0 72 -4,-1.9 4,-0.6 1,-0.3 -2,-0.2 0.795 110.9 47.5 -60.8 -30.0 30.0 -6.2 5.0 211 213 A V H < S+ 0 0 5 -4,-2.4 4,-0.4 2,-0.2 3,-0.3 0.893 112.2 47.5 -76.0 -42.1 28.9 -3.8 7.6 212 214 A K H >< S+ 0 0 144 -4,-2.1 3,-0.9 1,-0.2 -2,-0.2 0.911 112.8 50.5 -64.0 -39.8 29.8 -6.0 10.5 213 215 A E H 3< S+ 0 0 139 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.586 107.1 51.9 -82.1 -13.4 33.2 -6.8 8.9 214 216 A N T 3< S- 0 0 50 -4,-0.6 2,-3.1 -3,-0.3 -1,-0.3 0.524 90.9-161.6 -84.2 -9.6 33.9 -3.1 8.4 215 217 A N < + 0 0 128 -3,-0.9 -2,-0.1 -4,-0.4 -3,-0.1 0.099 30.2 157.3 52.3 -26.1 33.0 -2.9 12.1 216 218 A I - 0 0 60 -2,-3.1 -1,-0.2 1,-0.1 -2,-0.1 0.082 22.6-167.9 -39.4 113.4 32.5 0.9 11.4 217 219 A N + 0 0 84 -3,-0.1 -52,-0.1 -51,-0.0 -1,-0.1 0.007 38.8 72.9 -86.6-163.7 30.2 2.0 14.3 218 220 A K S S- 0 0 154 -54,-0.2 2,-0.1 -28,-0.0 -52,-0.0 0.033 90.7 -46.8 76.1 169.5 28.3 5.3 14.6 219 221 A T - 0 0 106 -54,-0.1 -28,-0.5 -53,-0.0 2,-0.3 -0.441 61.1-176.9 -73.8 147.5 25.2 6.5 12.6 220 222 A A E -H 163 0D 7 -57,-1.6 -57,-2.1 -30,-0.2 2,-0.5 -0.849 27.9-115.8-133.0 169.5 25.0 6.1 8.8 221 223 A L E -HJ 162 189D 9 -32,-2.3 -32,-2.4 -2,-0.3 2,-0.5 -0.952 26.2-156.3 -95.3 127.9 22.9 6.9 5.7 222 224 A I E -HJ 161 188D 0 -61,-3.5 -61,-3.1 -2,-0.5 2,-0.4 -0.941 4.5-163.7-104.5 133.9 21.7 3.9 3.9 223 225 A M E -HJ 160 187D 0 -36,-3.4 -36,-2.6 -2,-0.5 2,-0.4 -0.970 11.2-173.6-108.4 127.2 20.8 4.4 0.3 224 226 A V E +HJ 159 186D 0 -65,-2.2 -65,-2.1 -2,-0.4 -38,-0.2 -0.978 26.5 61.8-128.1 135.0 18.7 1.7 -1.4 225 227 A G S > S- 0 0 1 -40,-2.2 3,-1.9 -2,-0.4 4,-0.3 -0.677 82.7 -71.5 141.2 170.9 17.5 1.0 -5.0 226 228 A R G > S+ 0 0 127 -70,-0.3 3,-2.3 1,-0.3 4,-0.2 0.760 111.1 80.8 -63.4 -19.3 18.2 0.2 -8.6 227 229 A F G > S+ 0 0 1 1,-0.3 3,-0.6 2,-0.2 -103,-0.5 0.623 83.1 61.4 -66.9 -16.1 19.5 3.8 -8.9 228 230 A L G < S+ 0 0 12 -3,-1.9 -1,-0.3 1,-0.2 -2,-0.2 0.650 83.8 77.1 -78.6 -21.6 22.8 2.5 -7.4 229 231 A G G < 0 0 54 -3,-2.3 -1,-0.2 -4,-0.3 -2,-0.2 0.539 360.0 360.0 -60.0 -9.7 23.1 0.2 -10.4 230 232 A E < 0 0 155 -3,-0.6 -2,-0.2 -4,-0.2 -1,-0.1 0.592 360.0 360.0-121.4 360.0 24.2 3.5 -12.3