==== 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 LYASE 01-FEB-06 2FWA . COMPND 2 MOLECULE: N5-CARBOXYAMINOIMIDAZOLE RIBONUCLEOTIDE MUTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ACETOBACTER ACETI; . AUTHOR C.M.STARKS,T.J.KAPPOCK . 320 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14187.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 228 71.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 44 13.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.6 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 . 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 . 20 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 31 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 121 37.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.2 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 0 0 0 4 0 2 0 0 2 0 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 0 0 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 PARALLEL BRIDGES PER LADDER . 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 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 1 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 20 A S 0 0 156 0, 0.0 31,-0.1 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 -34.2 7.4 47.4 -124.7 2 21 A A - 0 0 69 1,-0.1 31,-0.0 29,-0.1 55,-0.0 -0.503 360.0 -99.3 -70.5 135.9 8.4 44.9 -127.4 3 22 A P + 0 0 38 0, 0.0 29,-0.3 0, 0.0 -1,-0.1 -0.275 36.9 178.7 -59.7 137.7 12.0 45.4 -128.5 4 23 A V S S+ 0 0 39 27,-2.5 55,-3.2 1,-0.2 56,-1.6 0.418 73.4 47.6-114.5 -8.9 12.5 47.4 -131.7 5 24 A V E -ab 32 60A 0 26,-0.9 28,-1.9 53,-0.2 2,-0.5 -1.000 69.1-156.1-135.3 134.6 16.3 47.1 -131.5 6 25 A G E -ab 33 61A 0 54,-2.2 56,-3.1 -2,-0.4 2,-0.6 -0.952 3.0-162.0-113.5 126.0 18.4 44.0 -130.8 7 26 A I E +ab 34 62A 0 26,-3.3 28,-3.3 -2,-0.5 2,-0.3 -0.939 17.7 174.9-106.7 117.9 21.9 44.4 -129.4 8 27 A I E -ab 35 63A 0 54,-2.8 56,-2.1 -2,-0.6 2,-0.3 -0.920 7.2-174.4-123.0 149.7 24.0 41.2 -129.9 9 28 A M E -ab 36 64A 4 26,-1.3 28,-2.2 -2,-0.3 56,-0.2 -0.990 33.7-120.0-143.5 150.2 27.6 40.6 -129.1 10 29 A G S S- 0 0 14 54,-1.8 2,-0.3 -2,-0.3 31,-0.2 0.783 86.3 -18.2 -59.4 -33.2 30.1 37.7 -129.6 11 30 A S S > S- 0 0 30 26,-0.1 3,-2.1 1,-0.1 4,-0.4 -0.985 71.0 -86.6-165.3 172.8 30.8 37.1 -125.9 12 31 A Q G > S+ 0 0 128 -2,-0.3 3,-1.6 1,-0.3 4,-0.4 0.823 118.7 66.9 -56.1 -33.7 30.7 38.4 -122.4 13 32 A S G 3 S+ 0 0 91 1,-0.3 -1,-0.3 2,-0.2 3,-0.2 0.668 94.9 57.5 -64.4 -17.1 34.1 40.0 -123.0 14 33 A D G X> S+ 0 0 12 -3,-2.1 4,-2.9 1,-0.2 3,-1.2 0.609 84.6 84.3 -87.1 -13.5 32.3 42.4 -125.4 15 34 A W H <> S+ 0 0 83 -3,-1.6 4,-2.5 -4,-0.4 5,-0.2 0.861 77.5 63.9 -57.3 -40.5 29.9 43.6 -122.8 16 35 A E H 34 S+ 0 0 115 -4,-0.4 -1,-0.3 -3,-0.2 -2,-0.1 0.823 116.4 33.0 -54.1 -29.6 32.3 46.2 -121.4 17 36 A T H X4 S+ 0 0 18 -3,-1.2 3,-1.3 -4,-0.2 4,-0.3 0.883 118.9 48.6 -92.2 -49.6 32.0 47.9 -124.8 18 37 A M H >X S+ 0 0 0 -4,-2.9 4,-1.7 1,-0.3 3,-1.1 0.657 91.5 78.4 -70.0 -15.8 28.4 47.1 -125.8 19 38 A R H 3X S+ 0 0 93 -4,-2.5 4,-2.8 1,-0.3 -1,-0.3 0.781 86.8 63.2 -62.9 -24.5 26.9 48.2 -122.5 20 39 A H H <> S+ 0 0 53 -3,-1.3 4,-1.4 -5,-0.2 -1,-0.3 0.807 102.1 48.3 -70.0 -29.3 27.4 51.7 -123.8 21 40 A A H <> S+ 0 0 0 -3,-1.1 4,-2.1 -4,-0.3 -2,-0.2 0.895 112.0 50.0 -75.5 -40.2 24.9 51.0 -126.6 22 41 A D H X S+ 0 0 42 -4,-1.7 4,-2.1 1,-0.2 -2,-0.2 0.939 109.7 50.2 -61.6 -48.5 22.5 49.5 -124.0 23 42 A A H X S+ 0 0 56 -4,-2.8 4,-2.2 1,-0.2 -1,-0.2 0.878 110.2 50.6 -58.9 -40.0 22.7 52.6 -121.8 24 43 A L H X S+ 0 0 5 -4,-1.4 4,-2.0 2,-0.2 -1,-0.2 0.919 109.8 48.2 -66.6 -45.3 22.1 54.9 -124.7 25 44 A L H <>S+ 0 0 0 -4,-2.1 5,-3.1 1,-0.2 -1,-0.2 0.887 113.5 48.6 -62.7 -38.4 18.9 53.1 -125.9 26 45 A T H ><5S+ 0 0 82 -4,-2.1 3,-1.2 3,-0.2 -1,-0.2 0.887 107.8 55.3 -68.1 -38.6 17.6 53.0 -122.3 27 46 A E H 3<5S+ 0 0 117 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.890 112.1 42.3 -60.7 -40.7 18.4 56.7 -121.9 28 47 A L T 3<5S- 0 0 5 -4,-2.0 -1,-0.3 -5,-0.1 -2,-0.2 0.341 116.3-117.7 -88.0 6.3 16.3 57.5 -125.0 29 48 A E T < 5 + 0 0 138 -3,-1.2 -3,-0.2 1,-0.2 -2,-0.1 0.901 57.1 157.9 57.7 47.0 13.6 55.0 -123.8 30 49 A I < - 0 0 6 -5,-3.1 -1,-0.2 -6,-0.1 -2,-0.1 -0.902 43.5-125.0-103.8 113.6 14.0 52.7 -126.8 31 50 A P + 0 0 49 0, 0.0 -27,-2.5 0, 0.0 -26,-0.9 -0.354 48.1 154.7 -57.8 130.1 12.7 49.2 -126.0 32 51 A H E -a 5 0A 40 -29,-0.3 2,-0.4 -28,-0.2 -26,-0.2 -0.973 40.1-128.5-155.1 166.8 15.5 46.7 -126.8 33 52 A E E -a 6 0A 45 -28,-1.9 -26,-3.3 -2,-0.3 2,-0.5 -0.932 15.5-155.1-119.9 144.7 17.0 43.3 -126.1 34 53 A T E +a 7 0A 49 -2,-0.4 2,-0.3 -28,-0.2 -26,-0.2 -0.969 27.6 159.6-124.3 114.9 20.6 42.7 -125.2 35 54 A L E -a 8 0A 69 -28,-3.3 -26,-1.3 -2,-0.5 2,-0.6 -0.847 41.3-121.3-134.7 167.2 22.0 39.2 -126.0 36 55 A I E +a 9 0A 63 -2,-0.3 2,-0.4 -28,-0.2 -26,-0.2 -0.950 35.9 164.7-109.1 121.4 25.2 37.2 -126.6 37 56 A V - 0 0 3 -28,-2.2 2,-0.5 -2,-0.6 -26,-0.1 -0.950 19.9-156.9-140.0 115.6 25.2 35.5 -130.0 38 57 A S > - 0 0 13 -2,-0.4 4,-1.9 1,-0.1 8,-0.3 -0.846 10.5-160.8-100.1 123.8 28.5 34.1 -131.3 39 58 A A T 4 S+ 0 0 13 -2,-0.5 -1,-0.1 1,-0.2 8,-0.1 0.854 97.1 37.4 -67.3 -32.0 28.9 33.7 -135.1 40 59 A H T 4 S+ 0 0 120 2,-0.1 -1,-0.2 1,-0.1 -2,-0.0 0.872 128.2 29.5 -87.8 -40.2 31.7 31.2 -134.4 41 60 A R T 4 S+ 0 0 208 1,-0.2 -2,-0.2 -31,-0.2 3,-0.1 0.737 133.4 27.7 -92.9 -28.1 30.6 29.4 -131.3 42 61 A T X + 0 0 31 -4,-1.9 4,-1.9 1,-0.1 -1,-0.2 -0.436 68.6 153.8-132.1 60.8 26.8 29.5 -131.8 43 62 A P H > S+ 0 0 60 0, 0.0 4,-2.5 0, 0.0 5,-0.1 0.858 75.4 49.1 -57.6 -40.7 26.2 29.7 -135.6 44 63 A D H > S+ 0 0 137 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.855 108.0 54.7 -70.5 -32.3 22.7 28.2 -135.5 45 64 A R H > S+ 0 0 133 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.908 111.0 46.6 -64.4 -40.4 21.7 30.5 -132.7 46 65 A L H X S+ 0 0 2 -4,-1.9 4,-3.2 -8,-0.3 5,-0.4 0.933 109.6 52.7 -66.3 -47.8 22.8 33.4 -134.9 47 66 A A H X S+ 0 0 7 -4,-2.5 4,-2.7 1,-0.2 -2,-0.2 0.927 114.2 43.0 -53.7 -48.8 21.0 32.1 -138.0 48 67 A D H X S+ 0 0 95 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.905 114.6 50.1 -64.9 -44.0 17.7 31.7 -136.1 49 68 A Y H X S+ 0 0 15 -4,-2.3 4,-1.0 -5,-0.2 -2,-0.2 0.955 117.5 38.6 -59.8 -52.0 18.1 35.1 -134.4 50 69 A A H < S+ 0 0 0 -4,-3.2 4,-0.5 1,-0.2 3,-0.4 0.906 114.6 54.2 -66.6 -43.0 18.8 37.0 -137.6 51 70 A R H < S+ 0 0 129 -4,-2.7 4,-0.3 -5,-0.4 3,-0.2 0.881 118.0 34.7 -59.6 -40.3 16.3 35.0 -139.7 52 71 A T H X S+ 0 0 26 -4,-2.1 4,-2.3 -5,-0.2 -1,-0.2 0.498 88.0 100.7 -95.6 -4.9 13.5 35.8 -137.3 53 72 A A T <>S+ 0 0 0 -4,-1.0 5,-2.0 -3,-0.4 4,-0.2 0.897 85.0 45.0 -45.8 -55.7 14.4 39.3 -136.3 54 73 A A T >45S+ 0 0 53 -4,-0.5 3,-2.0 1,-0.2 -1,-0.2 0.920 111.6 52.1 -56.8 -49.2 12.0 41.1 -138.6 55 74 A E T 345S+ 0 0 155 -4,-0.3 -1,-0.2 1,-0.3 -2,-0.2 0.866 105.4 56.9 -55.8 -39.3 9.1 38.7 -137.7 56 75 A R T 3<5S- 0 0 98 -4,-2.3 -1,-0.3 -3,-0.1 -2,-0.2 0.468 123.9-103.5 -74.1 -1.4 9.7 39.4 -134.0 57 76 A G T < 5 + 0 0 36 -3,-2.0 -3,-0.2 1,-0.3 -2,-0.1 0.454 68.6 149.4 95.7 -0.5 9.3 43.1 -134.6 58 77 A L < - 0 0 3 -5,-2.0 -1,-0.3 -6,-0.2 -53,-0.2 -0.424 23.0-176.9 -68.3 143.1 12.9 44.2 -134.5 59 78 A N + 0 0 36 -55,-3.2 2,-0.3 1,-0.4 -54,-0.2 0.698 68.0 20.6-108.7 -33.9 13.7 47.3 -136.7 60 79 A V E -b 5 0A 0 -56,-1.6 -54,-2.2 21,-0.1 2,-0.5 -0.997 62.1-152.5-140.4 143.0 17.5 47.6 -136.2 61 80 A I E -bc 6 83A 0 21,-2.2 23,-3.0 -2,-0.3 2,-0.6 -0.968 4.4-163.2-118.2 131.6 20.2 45.2 -135.1 62 81 A I E -bc 7 84A 0 -56,-3.1 -54,-2.8 -2,-0.5 2,-0.4 -0.969 14.7-174.9-112.6 118.6 23.4 46.4 -133.4 63 82 A A E -bc 8 85A 0 21,-2.9 23,-2.7 -2,-0.6 2,-0.4 -0.962 5.1-174.5-121.0 131.4 26.1 43.8 -133.4 64 83 A G E +bc 9 86A 0 -56,-2.1 -54,-1.8 -2,-0.4 2,-0.3 -0.957 15.2 144.1-126.2 142.8 29.5 44.0 -131.8 65 84 A A E - c 0 87A 8 21,-1.6 23,-2.6 -2,-0.4 2,-0.3 -0.975 29.6-132.8-165.7 162.2 32.5 41.6 -131.9 66 85 A G E + c 0 88A 32 -2,-0.3 2,-0.4 21,-0.2 4,-0.2 -0.827 65.6 9.7-124.5 164.3 36.3 41.7 -131.9 67 86 A G S S+ 0 0 17 21,-0.5 2,-2.7 -2,-0.3 34,-0.3 -0.594 135.6 12.6 74.9-129.0 39.1 40.0 -133.8 68 87 A A S S- 0 0 66 -2,-0.4 2,-2.0 1,-0.1 3,-0.2 -0.575 89.9-171.3 -78.6 76.5 37.7 38.2 -136.9 69 88 A A + 0 0 1 -2,-2.7 4,-0.4 28,-0.3 -2,-0.1 -0.475 28.2 147.5 -75.7 74.5 34.5 40.1 -136.1 70 89 A N > + 0 0 52 -2,-2.0 4,-2.7 -4,-0.2 5,-0.3 0.519 42.5 96.7 -87.9 -3.9 32.2 38.4 -138.6 71 90 A L H > S+ 0 0 2 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.907 83.6 44.4 -53.3 -53.4 29.1 38.7 -136.4 72 91 A P H > S+ 0 0 0 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.944 115.7 49.0 -58.7 -46.5 27.6 41.9 -137.9 73 92 A G H > S+ 0 0 10 -4,-0.4 4,-1.2 1,-0.2 -2,-0.2 0.896 112.6 45.3 -59.9 -45.3 28.2 40.6 -141.5 74 93 A M H X S+ 0 0 69 -4,-2.7 4,-0.8 2,-0.2 -1,-0.2 0.842 111.2 53.6 -69.6 -32.4 26.7 37.2 -140.9 75 94 A C H >X S+ 0 0 0 -4,-2.1 4,-1.1 -5,-0.3 3,-1.1 0.937 108.9 49.2 -65.9 -44.2 23.7 38.7 -139.1 76 95 A A H 3< S+ 0 0 2 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.787 101.3 65.7 -64.1 -26.7 23.1 41.0 -142.1 77 96 A A H 3< S+ 0 0 39 -4,-1.2 -1,-0.2 1,-0.2 -2,-0.2 0.805 110.4 35.3 -65.6 -28.6 23.4 37.9 -144.4 78 97 A W H << S+ 0 0 80 -3,-1.1 2,-0.3 -4,-0.8 -1,-0.2 0.543 113.4 60.8-102.7 -12.0 20.2 36.5 -142.8 79 98 A T < - 0 0 4 -4,-1.1 -28,-0.1 2,-0.1 4,-0.1 -0.897 56.9-153.1-122.6 152.4 18.2 39.6 -142.2 80 99 A R S S+ 0 0 64 -2,-0.3 213,-0.1 -30,-0.2 -1,-0.1 0.518 72.5 102.7 -91.0 -10.4 16.7 42.4 -144.4 81 100 A L S S- 0 0 19 -31,-0.2 2,-0.2 1,-0.1 -21,-0.1 -0.325 89.0 -91.0 -72.4 155.7 16.9 44.8 -141.4 82 101 A P - 0 0 1 0, 0.0 -21,-2.2 0, 0.0 2,-0.5 -0.499 42.1-156.7 -68.4 133.5 19.6 47.4 -141.1 83 102 A V E -c 61 0A 2 27,-0.2 29,-2.4 -2,-0.2 2,-0.5 -0.964 4.5-162.0-116.2 126.6 22.6 46.0 -139.2 84 103 A L E -cd 62 112A 1 -23,-3.0 -21,-2.9 -2,-0.5 2,-0.4 -0.918 11.8-147.8-108.7 132.9 25.0 48.3 -137.5 85 104 A G E -cd 63 113A 0 27,-2.7 29,-2.5 -2,-0.5 -21,-0.2 -0.852 9.6-162.6-109.9 137.7 28.4 47.0 -136.5 86 105 A V E -c 64 0A 0 -23,-2.7 -21,-1.6 -2,-0.4 2,-0.6 -0.944 16.4-142.3-115.3 113.1 30.6 47.9 -133.5 87 106 A P E -c 65 0A 0 0, 0.0 30,-3.0 0, 0.0 2,-0.3 -0.641 18.7-144.0 -76.1 117.5 34.3 46.9 -133.8 88 107 A V E -c 66 0A 9 -23,-2.6 -21,-0.5 -2,-0.6 2,-0.3 -0.646 24.6-105.8 -83.1 137.6 35.4 45.8 -130.3 89 108 A E - 0 0 113 -2,-0.3 2,-0.2 -23,-0.1 5,-0.1 -0.466 37.9-147.7 -65.2 120.4 39.0 46.7 -129.4 90 109 A S > - 0 0 21 -2,-0.3 4,-1.0 1,-0.1 6,-0.1 -0.565 17.1-117.3 -89.4 156.1 41.1 43.6 -129.5 91 110 A R T 4 S+ 0 0 220 -2,-0.2 -1,-0.1 2,-0.2 3,-0.1 0.946 105.2 24.6 -56.9 -57.0 44.1 43.0 -127.2 92 111 A A T 4 S+ 0 0 78 1,-0.2 -1,-0.1 2,-0.0 -3,-0.0 0.973 131.2 32.4 -77.4 -56.8 46.9 42.8 -129.8 93 112 A L T >4 S- 0 0 102 1,-0.0 3,-2.3 2,-0.0 4,-0.2 0.252 96.4-126.9 -90.6 13.2 45.7 44.8 -132.9 94 113 A K T 3< S- 0 0 126 -4,-1.0 -3,-0.1 1,-0.3 -5,-0.1 0.736 71.3 -52.6 49.9 32.7 43.6 47.4 -131.0 95 114 A G T 3> S+ 0 0 0 -7,-0.1 4,-3.0 21,-0.0 -1,-0.3 0.485 109.7 116.3 86.8 1.2 40.5 46.7 -133.0 96 115 A M H <> S+ 0 0 68 -3,-2.3 4,-2.2 2,-0.2 5,-0.2 0.894 84.0 45.0 -69.0 -36.7 42.1 47.2 -136.4 97 116 A D H > S+ 0 0 43 2,-0.2 4,-2.2 1,-0.2 -28,-0.3 0.922 114.0 49.7 -69.4 -41.0 41.3 43.6 -137.1 98 117 A S H > S+ 0 0 0 -10,-0.2 4,-0.8 2,-0.2 -2,-0.2 0.927 111.8 48.9 -60.7 -47.2 37.8 44.1 -135.7 99 118 A L H >X S+ 0 0 0 -4,-3.0 4,-3.0 1,-0.2 3,-1.0 0.945 114.0 42.9 -59.4 -53.2 37.2 47.2 -137.9 100 119 A L H 3X S+ 0 0 68 -4,-2.2 4,-1.2 1,-0.2 -1,-0.2 0.862 109.8 57.8 -64.4 -34.9 38.4 45.7 -141.2 101 120 A S H 3< S+ 0 0 53 -4,-2.2 -1,-0.2 -34,-0.3 -2,-0.2 0.676 119.0 31.9 -68.0 -18.3 36.5 42.4 -140.5 102 121 A I H << S+ 0 0 0 -3,-1.0 3,-0.4 -4,-0.8 -2,-0.2 0.831 119.8 43.3-105.3 -50.6 33.3 44.5 -140.2 103 122 A V H < S+ 0 0 2 -4,-3.0 2,-1.6 1,-0.2 172,-0.2 0.851 97.2 73.2 -70.0 -35.7 33.5 47.5 -142.5 104 123 A Q < + 0 0 85 -4,-1.2 -1,-0.2 -5,-0.4 -4,-0.1 -0.100 65.4 154.7 -75.9 41.6 35.0 45.8 -145.6 105 124 A M - 0 0 27 -2,-1.6 170,-0.3 -3,-0.4 178,-0.1 -0.497 46.3-115.9 -70.7 133.3 31.7 44.0 -146.5 106 125 A P > - 0 0 94 0, 0.0 3,-1.4 0, 0.0 -1,-0.1 -0.305 44.9 -79.9 -66.7 156.7 31.4 43.1 -150.2 107 126 A G T 3 S+ 0 0 27 1,-0.2 173,-0.1 3,-0.0 172,-0.1 -0.269 113.8 46.5 -57.4 139.6 28.7 44.8 -152.2 108 127 A G T 3 S+ 0 0 0 171,-0.3 -1,-0.2 -3,-0.1 202,-0.1 -0.038 106.2 54.5 119.3 -33.0 25.3 43.2 -151.7 109 128 A V S < S- 0 0 31 -3,-1.4 2,-0.1 2,-0.0 -32,-0.1 -0.863 75.2-160.7-137.7 100.7 25.2 42.8 -147.9 110 129 A P - 0 0 13 0, 0.0 2,-0.3 0, 0.0 -27,-0.2 -0.393 16.9-175.1 -85.9 159.4 25.8 46.0 -145.9 111 130 A V - 0 0 1 -8,-0.2 2,-0.8 162,-0.1 -27,-0.2 -0.909 25.4-136.0-148.4 114.8 26.8 46.7 -142.3 112 131 A G E -d 84 0A 0 -29,-2.4 -27,-2.7 -2,-0.3 2,-0.4 -0.693 30.9-150.1 -76.4 114.1 26.8 50.3 -141.1 113 132 A T E -dE 85 273A 0 160,-2.6 160,-2.5 -2,-0.8 2,-0.2 -0.706 14.1-167.3 -96.1 137.5 30.1 50.5 -139.2 114 133 A L - 0 0 2 -29,-2.5 6,-0.2 -2,-0.4 150,-0.1 -0.567 38.4 -65.1-109.9 176.2 30.8 52.7 -136.2 115 134 A A - 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0 0 4 -170,-0.3 -1,-0.2 -172,-0.2 5,-0.2 -0.129 61.5 -88.3 -61.8 156.3 33.5 49.6 -147.3 276 135 B I S S- 0 0 29 -30,-0.1 3,-0.4 4,-0.1 4,-0.3 -0.434 89.2 -8.8 -64.6 134.1 36.2 51.5 -149.2 277 136 B G S >> S- 0 0 7 -30,-3.0 4,-1.8 1,-0.2 3,-0.6 -0.313 118.5 -12.8 85.4-161.7 35.2 52.2 -152.8 278 137 B A H 3> S+ 0 0 44 1,-0.3 4,-2.5 2,-0.2 5,-0.2 0.818 129.4 56.1 -50.2 -42.6 32.4 51.0 -155.1 279 138 B S H 3> S+ 0 0 52 -3,-0.4 4,-2.6 1,-0.2 -171,-0.3 0.902 107.8 50.0 -60.5 -40.6 31.3 48.2 -152.8 280 139 B G H <> S+ 0 0 0 -3,-0.6 4,-2.1 -4,-0.3 -2,-0.2 0.891 109.5 50.3 -65.3 -40.3 30.8 50.8 -150.0 281 140 B A H X S+ 0 0 0 -4,-1.8 4,-1.7 2,-0.2 -2,-0.2 0.928 112.3 46.9 -64.4 -44.7 28.8 53.1 -152.3 282 141 B K H X S+ 0 0 70 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.936 114.6 47.3 -62.8 -45.3 26.5 50.2 -153.3 283 142 B N H X S+ 0 0 0 -4,-2.6 4,-2.8 2,-0.2 -1,-0.2 0.808 104.9 58.9 -67.8 -28.3 26.1 49.1 -149.7 284 143 B A H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.930 109.4 45.5 -65.0 -40.6 25.4 52.6 -148.5 285 144 B A H X S+ 0 0 0 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.883 113.3 49.3 -67.3 -39.4 22.4 52.6 -150.9 286 145 B L H X S+ 0 0 4 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.890 112.0 48.2 -67.4 -38.8 21.3 49.2 -149.8 287 146 B L H X S+ 0 0 1 -4,-2.8 4,-1.5 2,-0.2 -2,-0.2 0.920 110.5 51.6 -67.0 -42.0 21.6 50.1 -146.1 288 147 B A H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.901 109.9 50.6 -60.0 -41.1 19.6 53.3 -146.9 289 148 B A H X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 -1,-0.2 0.904 107.3 52.0 -63.8 -42.6 17.0 51.1 -148.6 290 149 B S H < S+ 0 0 6 -4,-2.2 4,-0.4 2,-0.2 -1,-0.2 0.791 110.1 50.9 -65.6 -26.6 16.7 48.8 -145.6 291 150 B I H >< S+ 0 0 0 -4,-1.5 3,-1.1 2,-0.2 4,-0.2 0.946 113.6 42.5 -73.8 -49.7 16.2 51.8 -143.4 292 151 B L H >< S+ 0 0 9 -4,-2.4 3,-1.6 1,-0.2 -2,-0.2 0.808 104.2 67.0 -65.7 -31.2 13.4 53.2 -145.6 293 152 B A G >< S+ 0 0 18 -4,-2.6 3,-0.8 1,-0.3 7,-0.3 0.740 84.0 75.2 -62.0 -23.2 11.9 49.7 -146.0 294 153 B L G < S+ 0 0 40 -3,-1.1 -1,-0.3 -4,-0.4 -2,-0.2 0.733 113.7 19.9 -62.3 -23.7 11.1 49.8 -142.3 295 154 B Y G < S+ 0 0 73 -3,-1.6 -1,-0.2 -4,-0.2 -2,-0.2 0.090 114.8 72.6-134.4 22.1 8.2 52.1 -143.0 296 155 B N <> - 0 0 65 -3,-0.8 4,-2.7 -4,-0.2 3,-0.2 -0.791 54.8-172.2-140.7 91.8 7.5 51.6 -146.7 297 156 B P H > S+ 0 0 108 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.863 86.8 53.7 -51.8 -43.5 5.9 48.2 -147.4 298 157 B A H > S+ 0 0 56 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.924 113.1 42.6 -60.3 -46.2 6.2 48.6 -151.2 299 158 B L H > S+ 0 0 3 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.886 109.9 57.7 -67.3 -39.7 10.0 49.2 -150.9 300 159 B A H X S+ 0 0 36 -4,-2.7 4,-2.3 -7,-0.3 -1,-0.2 0.903 107.8 48.1 -57.1 -41.8 10.3 46.5 -148.3 301 160 B A H X S+ 0 0 55 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.913 111.4 49.3 -66.0 -43.2 8.9 44.0 -150.9 302 161 B R H X S+ 0 0 67 -4,-1.9 4,-2.0 1,-0.2 -2,-0.2 0.894 112.9 47.6 -63.6 -39.7 11.2 45.3 -153.6 303 162 B L H X S+ 0 0 6 -4,-2.9 4,-2.8 2,-0.2 5,-0.2 0.896 110.0 52.3 -67.9 -40.8 14.2 44.9 -151.3 304 163 B E H X S+ 0 0 87 -4,-2.3 4,-2.6 -5,-0.2 -2,-0.2 0.915 111.3 47.1 -60.1 -44.1 13.2 41.4 -150.2 305 164 B T H X S+ 0 0 96 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.876 111.7 51.6 -65.2 -38.1 12.9 40.4 -153.9 306 165 B W H X S+ 0 0 30 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.926 112.6 43.9 -65.6 -47.0 16.3 42.0 -154.6 307 166 B R H X S+ 0 0 17 -4,-2.8 4,-2.2 2,-0.2 -2,-0.2 0.919 113.7 51.7 -64.0 -43.9 18.0 40.2 -151.7 308 167 B A H X S+ 0 0 42 -4,-2.6 4,-2.3 -5,-0.2 -2,-0.2 0.904 110.5 48.5 -59.5 -43.0 16.3 36.9 -152.7 309 168 B L H X S+ 0 0 108 -4,-2.3 4,-1.8 2,-0.2 -1,-0.2 0.896 107.8 54.7 -65.3 -41.0 17.4 37.3 -156.3 310 169 B Q H < S+ 0 0 52 -4,-2.1 4,-0.4 1,-0.2 -2,-0.2 0.931 111.3 45.0 -58.2 -46.1 21.0 38.0 -155.2 311 170 B T H >< S+ 0 0 90 -4,-2.2 3,-1.0 1,-0.2 -2,-0.2 0.911 113.9 48.3 -64.8 -43.3 21.1 34.8 -153.2 312 171 B A H 3< S+ 0 0 84 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.734 105.2 61.2 -70.8 -21.4 19.5 32.7 -155.9 313 172 B S T 3< S+ 0 0 78 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.531 75.3 108.7 -84.2 -7.3 21.9 34.1 -158.5 314 173 B V S < S- 0 0 97 -3,-1.0 -3,-0.0 -4,-0.4 -4,-0.0 -0.581 71.6-125.6 -73.5 125.5 25.1 32.8 -156.9 315 174 B P - 0 0 98 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.278 4.4-134.7 -68.4 157.2 26.5 29.9 -159.0 316 175 B N S S+ 0 0 175 1,-0.2 -2,-0.0 2,-0.0 0, 0.0 0.699 85.4 18.0 -86.1 -21.5 27.2 26.5 -157.4 317 176 B S S S- 0 0 90 0, 0.0 -1,-0.2 0, 0.0 2,-0.1 -0.988 82.6-105.5-147.7 155.0 30.6 26.1 -158.9 318 177 B P - 0 0 97 0, 0.0 2,-1.7 0, 0.0 -2,-0.0 -0.403 37.2-106.1 -78.7 158.1 33.3 28.3 -160.5 319 178 B I - 0 0 167 1,-0.2 2,-0.3 -2,-0.1 0, 0.0 -0.687 34.8-166.6 -83.6 88.6 33.9 28.3 -164.2 320 179 B T 0 0 122 -2,-1.7 -1,-0.2 1,-0.1 0, 0.0 0.176 360.0 360.0 -64.7 21.4 37.2 26.4 -163.9 321 180 B E 0 0 219 -2,-0.3 -1,-0.1 0, 0.0 0, 0.0 0.424 360.0 360.0 66.5 360.0 37.8 27.4 -167.5