==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-SEP-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 15-AUG-13 4MA5 . COMPND 2 MOLECULE: PHOSPHORIBOSYLAMINOIMIDAZOLE CARBOXYLASE, ATPASE . SOURCE 2 ORGANISM_SCIENTIFIC: FRANCISELLA TULARENSIS SUBSP. TULARENS . AUTHOR K.TAN,M.ZHOU,K.KWON,W.F.ANDERSON,A.JOACHIMIAK,CENTER FOR STR . 363 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16053.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 249 68.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 19 5.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 70 19.3 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 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 22 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 31 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 94 25.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.1 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 1 1 0 1 2 1 3 1 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 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 0 PARALLEL BRIDGES PER LADDER . 1 0 2 4 2 1 1 0 1 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 1 1 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 1 A X 0 0 104 0, 0.0 24,-2.2 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 137.6 5.1 27.3 49.4 2 2 A K E -a 25 0A 83 22,-0.2 60,-2.3 58,-0.0 61,-1.1 -0.920 360.0-161.7-112.3 130.1 5.7 24.0 47.6 3 3 A I E -ab 26 63A 0 22,-3.1 24,-2.4 -2,-0.5 2,-0.4 -0.946 5.1-155.4-113.2 124.9 8.1 23.5 44.7 4 4 A G E -ab 27 64A 0 59,-2.5 61,-2.3 -2,-0.5 2,-0.5 -0.813 8.7-164.0 -95.3 136.2 7.8 20.5 42.4 5 5 A I E -ab 28 65A 1 22,-3.0 24,-2.5 -2,-0.4 2,-0.8 -0.987 16.9-139.6-122.7 128.5 10.9 19.4 40.6 6 6 A I E S+ab 29 66A 8 59,-2.2 61,-2.0 -2,-0.5 62,-0.4 -0.790 81.2 33.9 -84.5 115.6 10.9 17.1 37.6 7 7 A G - 0 0 15 22,-2.3 22,-0.3 -2,-0.8 23,-0.2 -0.077 63.1-143.7 111.5 144.3 13.8 14.8 38.3 8 8 A A + 0 0 2 20,-0.1 28,-2.5 -2,-0.1 29,-0.4 -0.068 58.9 117.2-130.2 31.8 15.3 13.5 41.5 9 9 A G S > S- 0 0 17 26,-0.2 4,-2.4 25,-0.1 3,-0.2 -0.016 85.5 -71.8 -89.5-165.4 19.0 13.5 40.7 10 10 A Q H > S+ 0 0 30 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.801 129.7 56.0 -65.1 -29.5 21.9 15.5 42.3 11 11 A L H > S+ 0 0 17 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.928 111.1 44.6 -68.6 -41.5 20.8 18.8 40.9 12 12 A A H > S+ 0 0 0 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.917 111.4 55.0 -62.5 -43.5 17.3 18.3 42.5 13 13 A R H X S+ 0 0 30 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.929 111.4 43.4 -55.8 -46.4 19.1 17.2 45.7 14 14 A X H X S+ 0 0 10 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.820 108.3 57.7 -75.0 -30.6 21.2 20.4 45.8 15 15 A L H X S+ 0 0 2 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.928 111.3 44.4 -59.1 -42.8 18.2 22.7 45.0 16 16 A S H X S+ 0 0 0 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.895 110.4 52.9 -72.0 -40.8 16.4 21.2 48.0 17 17 A L H < S+ 0 0 93 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.909 117.3 40.1 -57.8 -40.2 19.5 21.5 50.3 18 18 A A H < S+ 0 0 22 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.839 121.9 40.2 -76.9 -34.5 19.8 25.1 49.3 19 19 A G H ><>S+ 0 0 0 -4,-2.2 3,-1.3 -5,-0.2 5,-1.3 0.714 95.8 76.3 -94.2 -23.3 16.1 26.0 49.3 20 20 A T G ><5S+ 0 0 69 -4,-2.6 3,-2.3 1,-0.3 -1,-0.2 0.902 90.9 56.2 -58.2 -42.8 14.9 24.1 52.4 21 21 A P G 3 5S+ 0 0 107 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.691 96.7 66.1 -63.5 -14.8 16.4 26.6 54.9 22 22 A L G < 5S- 0 0 64 -3,-1.3 -2,-0.2 -4,-0.1 -3,-0.1 0.549 123.4-107.0 -77.8 -6.4 14.3 29.3 53.1 23 23 A G T < 5S+ 0 0 62 -3,-2.3 2,-0.2 1,-0.3 -3,-0.2 0.585 74.3 141.1 91.7 12.5 11.3 27.4 54.4 24 24 A L < - 0 0 19 -5,-1.3 2,-0.4 -8,-0.1 -1,-0.3 -0.620 46.1-135.2 -89.1 150.0 10.3 26.0 51.1 25 25 A E E -a 2 0A 65 -24,-2.2 -22,-3.1 -2,-0.2 2,-0.4 -0.904 19.1-150.3-109.0 130.6 9.0 22.4 50.7 26 26 A F E +a 3 0A 4 -2,-0.4 15,-2.1 -24,-0.2 16,-0.9 -0.837 15.8 178.6-111.5 137.0 10.3 20.2 47.9 27 27 A H E -ac 4 42A 10 -24,-2.4 -22,-3.0 -2,-0.4 2,-0.3 -1.000 13.3-155.0-133.9 133.6 8.7 17.4 45.9 28 28 A C E -ac 5 43A 0 14,-2.7 16,-2.4 -2,-0.4 2,-0.7 -0.790 17.2-141.4-111.2 151.5 10.3 15.4 43.1 29 29 A L E S+ac 6 44A 8 -24,-2.5 -22,-2.3 -22,-0.3 2,-0.3 -0.952 70.6 72.3-101.3 111.2 9.1 13.4 40.1 30 30 A G S S- 0 0 12 14,-1.6 2,-0.2 -2,-0.7 13,-0.0 -0.952 80.5 -42.2 174.3-157.4 11.4 10.4 39.9 31 31 A K > - 0 0 118 -2,-0.3 3,-1.9 14,-0.1 6,-0.2 -0.670 39.3-118.0-106.9 157.2 12.3 7.2 41.7 32 32 A N T 3 S+ 0 0 127 1,-0.3 -1,-0.1 -2,-0.2 5,-0.1 0.778 113.7 49.4 -53.1 -35.9 12.7 6.0 45.3 33 33 A G T 3 S+ 0 0 78 4,-0.1 -1,-0.3 3,-0.0 2,-0.1 0.388 84.7 115.7 -89.6 3.1 16.3 5.1 44.9 34 34 A D S X S- 0 0 61 -3,-1.9 3,-1.7 1,-0.1 4,-0.3 -0.414 76.9-114.2 -76.7 154.6 17.3 8.4 43.3 35 35 A C T 3 S+ 0 0 12 1,-0.3 3,-0.3 2,-0.1 -26,-0.2 0.633 108.3 60.8 -75.1 -14.5 19.7 10.6 45.3 36 36 A A T > S+ 0 0 0 -28,-2.5 3,-1.9 1,-0.2 4,-0.5 0.672 81.1 90.1 -76.2 -15.4 17.3 13.5 46.0 37 37 A E G X S+ 0 0 84 -3,-1.7 3,-1.1 -29,-0.4 -1,-0.2 0.842 80.7 53.5 -53.9 -41.5 14.9 11.3 48.0 38 38 A E G 3 S+ 0 0 110 -3,-0.3 -1,-0.3 -4,-0.3 -2,-0.1 0.628 113.9 42.5 -74.1 -11.7 16.5 11.7 51.4 39 39 A V G < S+ 0 0 40 -3,-1.9 2,-0.3 -4,-0.1 -1,-0.2 0.284 103.0 72.8-118.0 10.5 16.3 15.5 51.3 40 40 A V S < S- 0 0 18 -3,-1.1 -13,-0.2 -4,-0.5 3,-0.1 -0.880 78.8-120.8-123.8 159.9 12.9 16.1 49.8 41 41 A K S S- 0 0 141 -15,-2.1 2,-0.3 -2,-0.3 -14,-0.2 0.941 90.4 -3.8 -62.5 -53.3 9.4 15.8 51.2 42 42 A T E -c 27 0A 56 -16,-0.9 -14,-2.7 -3,-0.1 2,-0.4 -0.967 52.9-157.1-139.0 156.3 8.1 13.3 48.6 43 43 A V E -c 28 0A 32 -2,-0.3 2,-0.4 -16,-0.2 -14,-0.2 -0.995 15.8-168.1-129.4 131.6 9.3 11.6 45.4 44 44 A T E -c 29 0A 50 -16,-2.4 -14,-1.6 -2,-0.4 2,-0.9 -0.980 14.0-142.7-126.7 129.0 6.6 10.3 43.0 45 45 A D + 0 0 99 -2,-0.4 2,-0.4 -16,-0.2 -14,-0.1 -0.791 34.8 153.4 -98.7 105.2 7.4 7.9 40.1 46 46 A I - 0 0 31 -2,-0.9 2,-0.2 8,-0.0 -2,-0.1 -0.998 47.0-115.9-130.5 130.7 5.3 8.8 37.1 47 47 A E > - 0 0 46 -2,-0.4 3,-1.4 1,-0.1 7,-0.2 -0.493 23.8-133.9 -64.4 132.9 6.2 8.0 33.5 48 48 A L T 3 S+ 0 0 69 1,-0.3 -1,-0.1 -2,-0.2 6,-0.1 0.605 101.3 66.3 -69.6 -12.3 6.6 11.3 31.7 49 49 A T T 3 S+ 0 0 124 1,-0.2 2,-2.1 2,-0.0 -1,-0.3 0.786 80.5 82.4 -75.7 -28.4 4.6 10.1 28.7 50 50 A K <> + 0 0 118 -3,-1.4 4,-1.8 1,-0.2 3,-0.3 -0.529 65.4 176.6 -76.2 79.8 1.5 9.9 30.9 51 51 A V H > + 0 0 54 -2,-2.1 4,-2.7 1,-0.2 5,-0.2 0.879 69.4 49.2 -62.2 -48.7 0.8 13.7 30.5 52 52 A N H > S+ 0 0 135 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.852 112.0 51.3 -61.4 -33.7 -2.4 14.1 32.4 53 53 A D H > S+ 0 0 88 -3,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.881 110.7 47.6 -68.8 -39.3 -0.9 12.2 35.4 54 54 A V H X S+ 0 0 0 -4,-1.8 4,-2.4 2,-0.2 -2,-0.2 0.903 113.4 48.0 -68.1 -40.9 2.1 14.4 35.4 55 55 A V H X S+ 0 0 17 -4,-2.7 4,-1.7 2,-0.2 -2,-0.2 0.918 109.9 52.8 -66.1 -42.4 -0.1 17.5 35.2 56 56 A A H < S+ 0 0 59 -4,-2.5 4,-0.2 -5,-0.2 -2,-0.2 0.897 111.0 47.5 -57.5 -42.1 -2.2 16.2 38.0 57 57 A W H >< S+ 0 0 8 -4,-2.1 3,-1.5 1,-0.2 -2,-0.2 0.918 109.7 53.2 -62.7 -44.4 0.9 15.7 40.1 58 58 A A H >< S+ 0 0 0 -4,-2.4 3,-2.1 1,-0.3 -2,-0.2 0.812 94.9 68.9 -64.3 -31.1 2.1 19.2 39.3 59 59 A K T 3< S+ 0 0 123 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.570 84.6 71.5 -70.3 -7.4 -1.1 20.8 40.4 60 60 A Q T < S+ 0 0 116 -3,-1.5 -1,-0.3 -4,-0.2 2,-0.2 0.590 97.4 63.9 -76.3 -11.2 -0.3 19.9 44.0 61 61 A F S < S- 0 0 14 -3,-2.1 -58,-0.2 -4,-0.1 3,-0.1 -0.631 77.0-130.5-121.0 169.3 2.4 22.5 44.0 62 62 A D S S+ 0 0 89 -60,-2.3 22,-0.4 1,-0.3 2,-0.3 0.742 90.5 3.7 -93.1 -24.8 2.9 26.3 43.7 63 63 A V E -b 3 0A 2 -61,-1.1 -59,-2.5 20,-0.1 2,-0.4 -0.974 66.0-144.7-158.4 151.3 5.6 26.3 41.0 64 64 A I E +bd 4 85A 0 20,-2.6 22,-2.8 -2,-0.3 2,-0.2 -0.945 18.8 167.4-122.8 140.1 7.4 23.7 38.9 65 65 A T E -b 5 0A 1 -61,-2.3 -59,-2.2 -2,-0.4 2,-0.3 -0.792 17.7-144.2-136.3-174.7 11.0 23.5 37.7 66 66 A F E -b 6 0A 3 20,-0.3 -59,-0.2 -61,-0.3 3,-0.1 -0.982 14.6-148.0-152.5 155.8 13.1 20.7 36.2 67 67 A E S S+ 0 0 31 -61,-2.0 2,-0.5 -2,-0.3 -60,-0.1 0.561 84.8 54.5-106.1 -9.4 16.7 19.4 36.2 68 68 A N > - 0 0 51 -62,-0.4 3,-1.3 1,-0.1 -1,-0.2 -0.938 59.0-161.3-133.2 114.5 17.0 18.1 32.7 69 69 A E T 3 S+ 0 0 14 -2,-0.5 27,-0.2 1,-0.3 -1,-0.1 0.505 80.7 82.6 -74.3 -1.9 16.2 20.2 29.6 70 70 A N T 3 + 0 0 44 25,-0.1 -1,-0.3 2,-0.1 3,-0.1 0.454 68.3 114.3 -81.6 4.3 15.8 17.1 27.4 71 71 A I S < S- 0 0 18 -3,-1.3 2,-0.2 1,-0.1 25,-0.1 -0.271 85.3 -77.6 -72.0 160.6 12.3 16.7 28.6 72 72 A S > - 0 0 66 1,-0.2 4,-1.7 2,-0.1 -1,-0.1 -0.399 33.4-154.9 -61.6 122.0 9.3 17.0 26.3 73 73 A H H > S+ 0 0 63 1,-0.2 4,-2.0 -2,-0.2 -1,-0.2 0.778 96.6 57.6 -74.6 -21.9 8.7 20.7 25.8 74 74 A E H > S+ 0 0 123 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.856 102.9 53.4 -69.7 -38.6 5.1 19.9 25.0 75 75 A L H > S+ 0 0 2 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.907 109.2 49.2 -59.7 -43.8 4.8 18.3 28.5 76 76 A I H X S+ 0 0 1 -4,-1.7 4,-3.0 2,-0.2 -2,-0.2 0.902 109.8 50.8 -64.0 -40.8 6.1 21.5 29.9 77 77 A K H X S+ 0 0 42 -4,-2.0 4,-1.5 2,-0.2 -2,-0.2 0.936 110.5 49.9 -59.1 -46.6 3.6 23.6 27.9 78 78 A A H < S+ 0 0 37 -4,-2.5 4,-0.4 1,-0.2 -2,-0.2 0.904 115.4 42.6 -58.8 -45.3 0.8 21.3 29.2 79 79 A I H >X S+ 0 0 0 -4,-2.3 4,-2.7 1,-0.2 3,-2.4 0.952 110.0 56.1 -65.0 -50.4 1.9 21.7 32.8 80 80 A N H 3< S+ 0 0 79 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.747 95.6 66.3 -58.9 -26.6 2.6 25.4 32.6 81 81 A H T 3< S+ 0 0 157 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.753 117.1 26.4 -64.9 -23.7 -1.0 26.0 31.4 82 82 A E T <4 S+ 0 0 99 -3,-2.4 2,-0.4 -4,-0.4 -2,-0.2 0.764 134.7 17.4-108.2 -43.8 -2.1 24.9 34.9 83 83 A V S < S- 0 0 13 -4,-2.7 -1,-0.4 -19,-0.0 -20,-0.1 -0.998 90.9 -95.2-138.1 135.3 0.8 25.7 37.2 84 84 A S - 0 0 52 -2,-0.4 -20,-2.6 -22,-0.4 2,-0.5 -0.177 37.5-164.3 -49.9 125.0 3.8 28.0 36.6 85 85 A V B -d 64 0A 3 -22,-0.2 -20,-0.2 -5,-0.1 4,-0.1 -0.970 15.9-128.7-111.5 130.6 6.9 26.2 35.2 86 86 A Y S S+ 0 0 53 -22,-2.8 -20,-0.3 -2,-0.5 2,-0.2 -0.996 80.1 31.5-128.1 136.3 10.3 28.0 35.3 87 87 A P S S- 0 0 1 0, 0.0 153,-0.1 0, 0.0 155,-0.1 0.554 101.8 -94.5 -82.8-170.2 12.2 28.4 33.2 88 88 A S > - 0 0 26 150,-0.2 4,-1.6 -2,-0.2 5,-0.1 -0.060 14.2-123.5 -73.9 159.2 10.2 28.7 30.0 89 89 A A H > S+ 0 0 26 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.822 113.9 58.4 -64.2 -31.7 9.2 26.1 27.3 90 90 A K H > S+ 0 0 96 148,-0.2 4,-2.1 2,-0.2 5,-0.2 0.907 104.5 49.4 -65.0 -41.8 10.9 28.3 24.8 91 91 A A H > S+ 0 0 0 147,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.891 114.1 46.6 -62.1 -40.5 14.2 28.1 26.7 92 92 A I H X S+ 0 0 0 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.941 111.0 51.3 -65.9 -49.0 13.8 24.3 26.8 93 93 A A H < S+ 0 0 18 -4,-2.9 4,-0.3 1,-0.2 -2,-0.2 0.865 116.3 39.6 -58.9 -41.8 12.9 24.0 23.1 94 94 A I H >< S+ 0 0 24 -4,-2.1 3,-0.7 -5,-0.2 7,-0.4 0.904 117.3 47.0 -78.2 -40.1 15.9 26.0 21.9 95 95 A S H 3< S+ 0 0 7 -4,-2.2 164,-0.2 -5,-0.2 -2,-0.2 0.806 107.5 56.6 -73.1 -28.2 18.5 24.6 24.3 96 96 A Q T 3< S+ 0 0 16 -4,-2.2 2,-0.5 -5,-0.2 -1,-0.2 0.541 101.5 61.0 -82.6 -8.8 17.6 20.9 23.8 97 97 A D S <> S- 0 0 14 -3,-0.7 4,-2.8 -4,-0.3 5,-0.2 -0.963 70.3-153.3-124.6 113.9 18.1 21.0 20.1 98 98 A R H > S+ 0 0 41 42,-2.1 4,-2.2 -2,-0.5 5,-0.2 0.802 96.2 50.8 -57.0 -34.6 21.6 21.8 18.8 99 99 A L H > S+ 0 0 25 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.932 113.6 43.9 -68.8 -44.9 20.3 23.2 15.5 100 100 A L H > S+ 0 0 73 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.891 113.9 52.0 -67.0 -38.0 17.8 25.4 17.2 101 101 A E H X S+ 0 0 5 -4,-2.8 4,-1.6 -7,-0.4 -2,-0.2 0.941 115.0 39.9 -62.9 -50.8 20.4 26.5 19.8 102 102 A K H X S+ 0 0 2 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.860 113.4 54.8 -70.0 -34.3 23.0 27.5 17.2 103 103 A S H X S+ 0 0 31 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.869 105.7 53.8 -66.1 -36.3 20.4 29.0 14.8 104 104 A F H X S+ 0 0 15 -4,-2.0 4,-1.1 2,-0.2 -1,-0.2 0.924 109.5 47.1 -61.5 -46.7 19.2 31.3 17.6 105 105 A X H ><>S+ 0 0 1 -4,-1.6 5,-2.9 1,-0.2 3,-0.9 0.950 113.1 48.5 -60.4 -49.7 22.8 32.5 18.3 106 106 A Q H ><5S+ 0 0 121 -4,-2.5 3,-1.4 1,-0.3 -2,-0.2 0.880 107.1 56.5 -58.5 -40.0 23.3 33.1 14.6 107 107 A D H 3<5S+ 0 0 125 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.737 111.1 43.6 -65.5 -24.7 20.0 35.0 14.3 108 108 A H T <<5S- 0 0 68 -4,-1.1 -1,-0.3 -3,-0.9 -2,-0.2 0.202 120.2-105.3-105.3 13.4 21.1 37.4 17.0 109 109 A G T < 5S+ 0 0 73 -3,-1.4 2,-0.5 1,-0.2 -3,-0.2 0.819 71.7 145.7 71.5 31.8 24.7 37.9 15.7 110 110 A I < - 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L 0 337B 2 -91,-2.3 2,-0.7 -2,-0.4 34,-0.2 -0.576 3.5-144.9 -84.0 142.7 34.4 16.6 39.8 304 305 A C E - L 0 336B 1 32,-2.8 31,-2.5 -2,-0.2 32,-1.0 -0.932 25.7-175.9-106.9 108.9 34.3 13.0 41.1 305 306 A I E - L 0 334B 0 -2,-0.7 58,-2.6 29,-0.2 2,-1.1 -0.921 61.7 -12.5-113.2 128.5 33.6 10.8 38.1 306 307 A G S S+ 0 0 4 27,-3.1 2,-0.3 -2,-0.5 24,-0.2 -0.134 133.9 16.3 82.4 -41.2 33.0 7.1 38.3 307 308 A G - 0 0 11 -2,-1.1 28,-0.2 22,-0.2 56,-0.2 -0.912 68.1-138.9-153.4 172.4 34.2 6.9 41.8 308 309 A X - 0 0 44 -2,-0.3 3,-0.1 -4,-0.1 50,-0.0 -0.997 29.7-102.4-142.4 143.3 35.0 9.1 44.8 309 310 A P - 0 0 10 0, 0.0 49,-0.1 0, 0.0 5,-0.1 -0.267 54.7 -83.7 -63.0 157.0 37.8 9.2 47.4 310 311 A A > - 0 0 51 1,-0.1 4,-1.8 47,-0.1 3,-0.5 -0.307 35.6-127.0 -59.2 141.5 37.0 7.7 50.8 311 312 A T H > S+ 0 0 94 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.853 109.2 57.9 -62.0 -34.9 35.4 10.2 53.0 312 313 A K H > S+ 0 0 118 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.866 107.6 47.6 -65.3 -32.4 37.9 9.7 55.8 313 314 A D H 4 S+ 0 0 79 -3,-0.5 4,-0.3 2,-0.2 -1,-0.2 0.844 113.9 47.3 -74.8 -36.0 40.7 10.6 53.3 314 315 A L H >< S+ 0 0 1 -4,-1.8 3,-1.4 1,-0.2 6,-0.3 0.887 107.4 55.7 -70.0 -40.1 38.8 13.7 52.2 315 316 A A H 3< S+ 0 0 61 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.777 95.5 67.2 -65.5 -27.4 38.0 14.8 55.7 316 317 A A T 3< S+ 0 0 79 -4,-0.9 2,-1.1 1,-0.2 -1,-0.3 0.697 88.1 68.8 -66.0 -21.9 41.7 14.8 56.6 317 318 A L S X S- 0 0 13 -3,-1.4 3,-1.9 -4,-0.3 -1,-0.2 -0.796 82.7-165.8 -96.6 89.3 42.1 17.7 54.2 318 319 A D T 3 S+ 0 0 123 -2,-1.1 -1,-0.1 1,-0.3 -2,-0.1 0.520 74.3 50.9 -75.1 -6.0 40.3 19.9 56.5 319 320 A R T 3 S+ 0 0 97 2,-0.1 22,-0.4 -3,-0.1 -1,-0.3 0.544 84.1 104.5 -98.7 -9.1 39.5 22.9 54.3 320 321 A V < - 0 0 9 -3,-1.9 2,-0.6 -6,-0.3 20,-0.2 -0.549 67.4-138.9 -73.0 132.7 38.0 20.9 51.4 321 322 A K E -M 339 0B 100 18,-3.6 18,-2.4 -2,-0.3 2,-0.4 -0.861 18.6-142.5 -96.9 121.1 34.2 21.0 51.3 322 323 A I E +M 338 0B 59 -2,-0.6 2,-0.3 16,-0.2 16,-0.2 -0.659 21.7 179.1 -91.9 130.2 32.8 17.6 50.5 323 324 A H E +M 337 0B 40 14,-2.0 14,-2.2 -2,-0.4 2,-0.4 -0.660 8.3 172.8-130.8 78.6 29.8 17.2 48.2 324 325 A S E -M 336 0B 55 -2,-0.3 12,-0.2 12,-0.2 -2,-0.0 -0.692 22.2-156.9 -81.8 134.9 29.0 13.5 47.9 325 326 A Y - 0 0 2 10,-2.4 11,-0.2 -2,-0.4 -1,-0.1 0.489 33.8-124.8 -90.8 -2.6 25.7 12.9 46.0 326 327 A N + 0 0 101 9,-0.4 2,-0.2 1,-0.2 10,-0.1 0.925 61.5 146.7 57.3 48.1 25.3 9.5 47.6 327 328 A K - 0 0 63 8,-0.5 -1,-0.2 6,-0.0 8,-0.1 -0.641 55.8 -90.7-109.6 168.5 25.0 7.9 44.2 328 329 A E - 0 0 148 -2,-0.2 2,-0.1 -3,-0.1 -22,-0.1 -0.680 42.4-115.9 -83.3 127.2 26.1 4.5 42.8 329 330 A P + 0 0 100 0, 0.0 2,-0.3 0, 0.0 -22,-0.2 -0.374 48.0 155.7 -62.1 130.6 29.7 4.4 41.4 330 331 A R > - 0 0 147 3,-0.2 3,-2.4 -24,-0.2 -24,-0.4 -0.935 53.0 -86.9-157.7 134.1 29.6 3.6 37.7 331 332 A K T 3 S+ 0 0 147 -2,-0.3 33,-0.2 1,-0.3 -25,-0.1 -0.186 113.7 9.4 -44.6 125.3 32.2 4.5 35.1 332 333 A G T 3 S+ 0 0 32 31,-2.8 2,-0.3 1,-0.2 -1,-0.3 0.377 97.6 129.3 85.8 -3.7 31.6 7.9 33.7 333 334 A R < - 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0 0 44 -4,-2.5 2,-0.3 -5,-0.1 -56,-0.2 -0.299 38.7-180.0 -65.3 137.7 38.3 8.4 39.1 363 364 A E 0 0 112 -58,-2.6 -31,-2.8 -56,-0.2 -30,-0.2 -0.865 360.0 360.0-134.1 103.8 36.8 6.1 36.5 364 365 A I 0 0 63 -2,-0.3 -33,-0.1 -33,-0.2 -58,-0.0 -0.778 360.0 360.0-106.3 360.0 35.9 7.9 33.2