==== 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 HYDROLASE 26-DEC-06 2E6H . COMPND 2 MOLECULE: 5'-NUCLEOTIDASE SURE; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS THERMOPHILUS; . AUTHOR W.IWASAKI,K.MIKI . 932 11 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 36578.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 557 59.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 142 15.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 94 10.1 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 . 4 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 . 2 0.2 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 . 41 4.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 77 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 176 18.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 0.9 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 4 0 0 0 2 7 3 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 2 14 4 4 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 . 8 5 2 5 5 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 . 4 4 0 0 0 0 0 3 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 M 0 0 81 0, 0.0 27,-2.1 0, 0.0 2,-0.5 0.000 360.0 360.0 360.0 156.7 103.5 61.0 4.7 2 2 A R E -a 28 0A 57 25,-0.2 83,-2.4 81,-0.1 84,-1.8 -0.819 360.0-164.6-101.0 129.4 100.5 59.7 2.7 3 3 A I E -ab 29 86A 1 25,-4.6 27,-2.8 -2,-0.5 2,-0.6 -0.945 10.1-157.9-120.2 124.2 98.0 62.2 1.2 4 4 A L E -ab 30 87A 0 82,-2.9 84,-2.7 -2,-0.5 2,-0.5 -0.879 14.9-163.7 -98.4 123.9 94.5 61.5 -0.2 5 5 A V E +ab 31 88A 0 25,-3.2 27,-1.8 -2,-0.6 2,-0.2 -0.929 19.7 152.8-110.8 131.7 93.4 64.1 -2.7 6 6 A T E - b 0 89A 0 82,-2.6 84,-3.1 -2,-0.5 2,-0.3 -0.812 15.4-173.6-142.9 179.5 89.7 64.5 -3.6 7 7 A N - 0 0 0 25,-0.3 66,-0.1 82,-0.3 4,-0.1 -0.928 31.6-121.5-161.6-172.0 87.3 67.1 -4.8 8 8 A D S S+ 0 0 50 -2,-0.3 3,-0.1 2,-0.1 -1,-0.1 0.532 99.1 67.3-120.3 -15.0 83.6 67.8 -5.6 9 9 A D S S- 0 0 55 1,-0.2 3,-0.2 4,-0.0 2,-0.1 0.535 106.5-108.5 -86.0 -5.9 83.8 68.8 -9.3 10 10 A G > - 0 0 2 26,-0.2 3,-1.9 1,-0.1 6,-0.2 -0.147 36.3 -59.5 103.1 163.3 84.9 65.3 -10.4 11 11 A I T 3 S+ 0 0 1 23,-2.0 -1,-0.1 1,-0.3 24,-0.1 0.574 125.8 54.7 -59.7 -17.4 87.8 63.3 -11.7 12 12 A Y T 3 S+ 0 0 72 -3,-0.2 -1,-0.3 23,-0.1 -2,-0.1 0.431 76.4 120.6 -99.4 0.0 88.3 65.5 -14.9 13 13 A S X> - 0 0 2 -3,-1.9 4,-1.2 1,-0.2 3,-1.1 -0.462 58.6-147.1 -68.4 124.8 88.6 68.9 -13.0 14 14 A P H 3> S+ 0 0 49 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.815 99.4 65.3 -61.2 -24.1 91.9 70.6 -13.7 15 15 A G H 3> S+ 0 0 0 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.876 96.8 55.5 -64.3 -33.6 91.6 71.9 -10.2 16 16 A L H <> S+ 0 0 0 -3,-1.1 4,-2.1 -6,-0.2 -1,-0.2 0.928 109.2 43.6 -63.8 -47.1 91.9 68.4 -8.8 17 17 A W H X S+ 0 0 19 -4,-1.2 4,-2.7 2,-0.2 5,-0.2 0.833 108.5 58.9 -72.3 -27.1 95.2 67.6 -10.6 18 18 A A H X S+ 0 0 18 -4,-1.7 4,-2.2 1,-0.2 -1,-0.2 0.917 110.6 43.6 -65.1 -40.0 96.7 71.0 -9.7 19 19 A L H X S+ 0 0 0 -4,-1.7 4,-2.7 2,-0.2 -2,-0.2 0.875 112.4 51.4 -72.9 -39.0 96.1 70.1 -6.0 20 20 A A H X S+ 0 0 0 -4,-2.1 4,-1.6 2,-0.2 -2,-0.2 0.912 112.4 46.6 -64.2 -41.8 97.4 66.5 -6.4 21 21 A E H X S+ 0 0 37 -4,-2.7 4,-0.6 2,-0.2 -2,-0.2 0.939 113.4 48.0 -68.5 -42.3 100.6 67.8 -8.1 22 22 A A H >< S+ 0 0 0 -4,-2.2 3,-1.6 1,-0.2 -2,-0.2 0.961 112.4 50.1 -61.8 -47.1 101.2 70.5 -5.5 23 23 A A H >X S+ 0 0 1 -4,-2.7 3,-2.2 1,-0.3 4,-0.6 0.789 96.5 70.0 -61.7 -28.2 100.6 68.0 -2.7 24 24 A S H 3< S+ 0 0 36 -4,-1.6 3,-0.4 1,-0.3 -1,-0.3 0.727 86.1 67.6 -64.6 -20.5 103.1 65.5 -4.3 25 25 A Q T << S+ 0 0 104 -3,-1.6 -1,-0.3 -4,-0.6 -2,-0.2 0.569 107.3 41.3 -73.0 -6.7 105.9 67.9 -3.3 26 26 A F T <4 S- 0 0 58 -3,-2.2 2,-0.3 1,-0.3 -1,-0.2 0.472 125.6 -45.1-118.9 -6.7 105.1 67.0 0.3 27 27 A G S < S- 0 0 22 -4,-0.6 2,-0.4 -3,-0.4 -1,-0.3 -0.988 83.5 -30.3 166.3-173.1 104.4 63.3 0.3 28 28 A E E -a 2 0A 113 -27,-2.1 -25,-4.6 -2,-0.3 2,-0.4 -0.599 57.7-156.6 -74.5 126.5 102.8 60.3 -1.4 29 29 A V E -a 3 0A 9 -2,-0.4 2,-0.4 -27,-0.2 -25,-0.2 -0.882 14.6-178.7-111.4 134.1 99.5 61.3 -3.1 30 30 A F E -a 4 0A 17 -27,-2.8 -25,-3.2 -2,-0.4 2,-0.4 -0.971 16.9-143.4-127.9 140.2 96.5 59.1 -4.0 31 31 A V E +ac 5 63A 0 31,-2.5 33,-1.9 -2,-0.4 2,-0.3 -0.898 24.5 165.8-113.9 138.6 93.4 60.3 -5.8 32 32 A A E + c 0 64A 0 -27,-1.8 -25,-0.3 -2,-0.4 33,-0.2 -0.898 20.5 162.3-147.3 109.2 89.7 59.3 -5.2 33 33 A A E - c 0 65A 0 31,-2.2 33,-3.2 -2,-0.3 -22,-0.1 -0.937 40.9 -93.2-133.6 156.1 87.3 61.7 -6.9 34 34 A P E - c 0 66A 4 0, 0.0 -23,-2.0 0, 0.0 33,-0.2 -0.292 25.2-131.5 -66.4 149.4 83.6 61.6 -7.9 35 35 A D 0 0 55 31,-1.9 32,-0.1 -25,-0.2 -23,-0.1 0.694 360.0 360.0 -75.2 -17.8 82.7 60.5 -11.4 36 36 A T 0 0 128 30,-0.4 -26,-0.2 32,-0.3 32,-0.1 -0.970 360.0 360.0-133.8 360.0 80.4 63.6 -11.6 37 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 38 42 A G 0 0 97 0, 0.0 4,-0.1 0, 0.0 30,-0.0 0.000 360.0 360.0 360.0 148.4 74.4 64.7 -1.0 39 43 A H + 0 0 44 30,-0.1 2,-0.2 299,-0.1 299,-0.0 0.177 360.0 93.6-127.7 12.7 77.6 65.2 1.0 40 44 A A S S- 0 0 41 298,-0.1 2,-0.3 1,-0.1 32,-0.3 -0.645 87.6 -84.3-104.2 165.8 77.4 62.4 3.5 41 45 A I - 0 0 22 -2,-0.2 2,-0.4 30,-0.2 -2,-0.1 -0.534 43.9-121.0 -69.5 127.8 78.8 58.9 3.3 42 46 A T + 0 0 31 -2,-0.3 389,-0.3 1,-0.2 5,-0.1 -0.569 47.6 154.0 -69.9 119.9 76.5 56.5 1.4 43 47 A I + 0 0 94 -2,-0.4 -1,-0.2 387,-0.1 388,-0.1 0.573 53.7 75.1-123.0 -18.8 75.6 53.7 3.7 44 48 A A S S+ 0 0 52 615,-0.1 617,-0.1 1,-0.1 -2,-0.1 0.704 108.9 8.2 -70.7 -20.0 72.2 52.3 2.4 45 49 A H S S- 0 0 57 614,-0.1 386,-0.2 384,-0.1 -1,-0.1 -0.989 89.0 -79.2-156.9 161.1 73.8 50.6 -0.5 46 50 A P - 0 0 2 0, 0.0 2,-0.4 0, 0.0 384,-0.2 -0.238 41.4-141.1 -62.7 150.8 77.1 49.6 -2.2 47 51 A V B -I 429 0B 3 382,-2.6 382,-2.0 -5,-0.1 2,-0.3 -0.914 8.5-130.0-116.6 144.1 79.1 52.2 -4.1 48 52 A R E +D 67 0A 5 19,-0.5 19,-3.1 -2,-0.4 2,-0.3 -0.686 27.4 172.7 -91.7 145.8 81.0 51.6 -7.4 49 53 A A E -D 66 0A 3 -2,-0.3 17,-0.2 378,-0.3 -2,-0.0 -0.960 9.6-164.6-151.1 132.6 84.6 52.8 -7.7 50 54 A Y E -D 65 0A 47 15,-2.4 15,-2.5 -2,-0.3 -2,-0.0 -0.960 30.8-103.2-128.0 142.9 87.0 52.1 -10.6 51 55 A P E -D 64 0A 93 0, 0.0 13,-0.3 0, 0.0 -2,-0.0 -0.297 45.8-158.6 -54.3 138.4 90.8 52.4 -11.1 52 56 A H - 0 0 16 11,-3.7 2,-0.4 550,-0.0 11,-0.4 -0.987 16.0-124.6-130.6 135.3 91.3 55.6 -13.1 53 57 A P - 0 0 62 0, 0.0 3,-0.1 0, 0.0 11,-0.0 -0.643 31.2-128.0 -77.2 124.7 94.2 56.7 -15.3 54 58 A S - 0 0 17 -2,-0.4 4,-0.1 7,-0.4 6,-0.1 -0.262 43.7 -72.0 -67.2 161.7 95.5 60.1 -14.3 55 59 A P > - 0 0 48 0, 0.0 3,-0.9 0, 0.0 -1,-0.1 -0.140 35.2-124.4 -55.4 147.2 95.9 62.8 -17.0 56 60 A L T 3 S+ 0 0 158 1,-0.3 2,-0.6 -3,-0.1 -2,-0.1 0.878 108.5 50.7 -60.8 -41.0 98.6 62.6 -19.6 57 61 A H T 3 S+ 0 0 128 2,-0.0 -1,-0.3 472,-0.0 472,-0.0 -0.273 103.3 69.6 -98.4 52.2 100.0 66.0 -18.8 58 62 A A S < S- 0 0 29 -3,-0.9 3,-0.1 -2,-0.6 -40,-0.0 -0.970 94.3 -88.4-157.5 151.3 100.3 65.5 -15.1 59 63 A P - 0 0 65 0, 0.0 2,-0.2 0, 0.0 -2,-0.0 -0.233 60.4 -89.6 -58.9 159.4 102.6 63.3 -12.9 60 64 A H + 0 0 140 -6,-0.1 -4,-0.0 -4,-0.0 -3,-0.0 -0.465 48.2 178.7 -73.3 143.5 101.2 59.8 -12.4 61 65 A F - 0 0 10 -2,-0.2 -7,-0.4 -3,-0.1 -31,-0.1 -0.988 35.0-117.3-142.8 131.4 98.9 59.3 -9.4 62 66 A P + 0 0 51 0, 0.0 -31,-2.5 0, 0.0 2,-0.3 -0.534 53.2 178.2 -64.5 140.1 97.2 56.1 -8.5 63 67 A A E -c 31 0A 7 -11,-0.4 -11,-3.7 -33,-0.2 2,-0.4 -0.999 31.2-162.7-151.9 152.5 93.5 57.1 -8.8 64 68 A Y E -cD 32 51A 52 -33,-1.9 -31,-2.2 -2,-0.3 2,-0.6 -0.986 15.7-144.1-132.3 139.8 89.9 55.9 -8.5 65 69 A R E -cD 33 50A 51 -15,-2.5 -15,-2.4 -2,-0.4 2,-0.4 -0.913 26.3-154.6-101.3 126.5 86.7 57.5 -9.9 66 70 A V E -cD 34 49A 0 -33,-3.2 -31,-1.9 -2,-0.6 2,-1.8 -0.875 18.7-144.0-109.1 131.6 83.9 57.0 -7.3 67 71 A R E S+ D 0 48A 113 -19,-3.1 -19,-0.5 -2,-0.4 2,-0.3 -0.559 79.9 63.2 -89.5 71.9 80.2 56.9 -8.1 68 72 A G S S- 0 0 24 -2,-1.8 -32,-0.3 -21,-0.1 -33,-0.2 -0.899 93.0 -53.1-167.1-167.3 79.4 58.5 -4.8 69 73 A T > - 0 0 23 -29,-0.3 4,-1.9 -2,-0.3 3,-0.3 -0.305 51.1-104.4 -83.3 168.7 79.8 61.7 -2.8 70 74 A P H > S+ 0 0 6 0, 0.0 4,-1.4 0, 0.0 5,-0.1 0.883 126.2 54.0 -60.1 -36.1 83.1 63.5 -2.0 71 75 A A H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 -30,-0.2 0.861 103.9 54.8 -67.2 -32.7 82.7 62.0 1.5 72 76 A D H > S+ 0 0 0 -3,-0.3 4,-3.4 -32,-0.3 5,-0.2 0.893 103.3 56.5 -64.6 -39.3 82.4 58.6 -0.0 73 77 A C H X S+ 0 0 0 -4,-1.9 4,-3.2 2,-0.2 -1,-0.2 0.867 107.5 48.7 -59.7 -36.0 85.7 59.2 -1.8 74 78 A V H X S+ 0 0 0 -4,-1.4 4,-2.2 2,-0.2 -2,-0.2 0.955 112.4 46.3 -70.2 -48.8 87.3 59.8 1.6 75 79 A A H X S+ 0 0 5 -4,-2.3 4,-0.8 1,-0.2 -2,-0.2 0.939 119.0 42.8 -58.6 -44.8 85.9 56.7 3.1 76 80 A L H >X S+ 0 0 0 -4,-3.4 4,-2.5 1,-0.2 3,-0.9 0.934 111.4 54.1 -66.8 -46.1 86.9 54.7 0.1 77 81 A G H 3X S+ 0 0 0 -4,-3.2 4,-2.4 1,-0.3 -1,-0.2 0.829 104.1 54.7 -57.4 -36.4 90.4 56.4 -0.2 78 82 A L H 3< S+ 0 0 41 -4,-2.2 -1,-0.3 2,-0.2 4,-0.3 0.758 112.4 45.7 -70.5 -23.3 91.3 55.5 3.4 79 83 A H H << S+ 0 0 81 -3,-0.9 3,-0.3 -4,-0.8 -2,-0.2 0.925 118.9 37.3 -82.5 -51.0 90.5 51.9 2.6 80 84 A L H < S+ 0 0 48 -4,-2.5 -2,-0.2 1,-0.2 -3,-0.2 0.847 131.7 27.5 -71.5 -36.4 92.4 51.6 -0.7 81 85 A F S < S- 0 0 15 -4,-2.4 -1,-0.2 -5,-0.3 -3,-0.2 0.192 98.3-171.7-113.5 16.9 95.3 53.8 0.2 82 86 A G + 0 0 38 -3,-0.3 2,-0.1 -4,-0.3 -3,-0.1 -0.216 54.5 47.8 -62.1 149.1 95.5 53.4 3.9 83 87 A P S S+ 0 0 96 0, 0.0 2,-0.4 0, 0.0 -81,-0.1 0.531 71.8 177.7 -85.1 153.9 97.0 54.6 6.1 84 88 A V - 0 0 8 1,-0.1 -81,-0.2 -2,-0.1 3,-0.1 -0.950 19.2-174.6-119.8 140.8 96.5 58.2 5.2 85 89 A D S S+ 0 0 70 -83,-2.4 34,-1.6 -2,-0.4 2,-0.4 0.753 71.1 31.1-100.3 -32.8 97.8 61.1 7.2 86 90 A L E -be 3 119A 4 -84,-1.8 -82,-2.9 32,-0.2 2,-0.5 -0.984 56.3-158.0-137.0 140.1 96.2 64.0 5.3 87 91 A V E -be 4 120A 0 32,-2.3 34,-2.0 -2,-0.4 2,-0.4 -0.965 13.3-175.2-117.1 120.4 93.0 64.7 3.2 88 92 A L E -be 5 121A 1 -84,-2.7 -82,-2.6 -2,-0.5 2,-0.5 -0.960 5.1-165.1-115.5 133.0 93.1 67.6 0.8 89 93 A S E -be 6 122A 0 32,-2.5 34,-2.6 -2,-0.4 2,-0.3 -0.979 37.2 -30.2-123.2 127.2 89.9 68.4 -1.1 90 94 A G E - 0 0 0 -84,-3.1 34,-0.1 -2,-0.5 -71,-0.1 -0.945 20.7-137.8 132.9-159.5 89.9 70.7 -4.2 91 95 A V E - 0 0 0 32,-0.3 33,-0.3 -2,-0.3 -1,-0.3 0.386 54.3-156.4 -81.3 124.2 90.9 72.8 -5.8 92 96 A N E - e 0 124A 14 31,-3.2 33,-2.2 -3,-0.3 2,-1.6 -0.407 17.4-130.0 -69.1 137.2 87.2 73.7 -6.3 93 97 A L E S+ e 0 125A 28 31,-0.2 2,-0.1 -2,-0.1 -1,-0.1 -0.679 87.6 36.5 -84.6 87.2 86.2 75.8 -9.3 94 98 A G S S- 0 0 12 31,-1.6 31,-0.5 -2,-1.6 -2,-0.1 -0.392 96.9 -76.8 139.0 144.6 84.2 78.3 -7.4 95 99 A S - 0 0 33 29,-0.2 2,-0.2 -2,-0.1 30,-0.1 -0.196 22.7-164.0 -67.4 156.2 84.5 80.1 -4.0 96 100 A N + 0 0 12 28,-0.1 2,-0.3 -4,-0.1 28,-0.1 -0.686 38.8 146.3-139.2 77.2 83.6 78.5 -0.6 97 101 A L > - 0 0 7 -2,-0.2 3,-2.1 75,-0.1 4,-0.1 -0.880 54.3 -33.2-119.8 148.3 83.4 81.7 1.5 98 102 A G G > S+ 0 0 0 -2,-0.3 3,-1.8 1,-0.3 4,-0.3 -0.156 131.5 9.2 49.2-126.0 81.3 82.7 4.5 99 103 A H G > S+ 0 0 65 1,-0.3 3,-1.0 2,-0.2 4,-0.4 0.761 121.0 73.4 -57.1 -26.8 77.7 81.2 4.5 100 104 A E G X> S+ 0 0 42 -3,-2.1 3,-0.8 1,-0.2 4,-0.7 0.730 77.8 74.6 -58.7 -27.4 78.8 79.0 1.5 101 105 A I G X4 S+ 0 0 1 -3,-1.8 3,-0.8 1,-0.2 -1,-0.2 0.854 87.0 62.6 -57.8 -36.9 81.0 76.7 3.7 102 106 A W G <4 S+ 0 0 13 -3,-1.0 -1,-0.2 -4,-0.3 -2,-0.2 0.852 112.5 33.7 -54.5 -42.2 77.9 75.1 5.1 103 107 A H G <4 S+ 0 0 45 -3,-0.8 2,-0.4 -4,-0.4 -1,-0.2 0.338 87.3 123.6 -99.5 2.1 76.8 73.7 1.7 104 108 A S S+ 0 0 4 -2,-0.4 4,-1.9 2,-0.2 -1,-0.2 0.832 93.7 59.4 -71.8 -31.0 80.9 69.5 -1.0 106 110 A T H > S+ 0 0 1 1,-0.2 4,-1.5 2,-0.2 3,-0.2 0.953 109.7 41.7 -61.1 -48.4 84.6 70.4 -1.2 107 111 A V H > S+ 0 0 2 1,-0.2 4,-3.5 2,-0.2 5,-0.2 0.882 107.5 61.6 -65.8 -38.1 84.5 71.2 2.5 108 112 A A H X S+ 0 0 3 -4,-2.0 4,-2.2 1,-0.2 -1,-0.2 0.876 103.3 51.3 -58.8 -36.2 82.4 68.2 3.3 109 113 A A H X S+ 0 0 0 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.955 112.2 44.8 -65.8 -48.6 85.2 66.0 2.0 110 114 A A H X S+ 0 0 1 -4,-1.5 4,-2.2 1,-0.2 -2,-0.2 0.937 112.5 52.5 -59.6 -46.0 87.8 67.7 4.2 111 115 A K H X S+ 0 0 4 -4,-3.5 4,-2.4 1,-0.2 -1,-0.2 0.893 105.5 55.0 -58.1 -38.8 85.5 67.6 7.2 112 116 A Q H X S+ 0 0 17 -4,-2.2 4,-1.0 -5,-0.2 -1,-0.2 0.921 106.1 50.9 -62.6 -42.1 85.0 63.8 6.6 113 117 A G H ><>S+ 0 0 0 -4,-1.9 5,-2.1 1,-0.2 3,-0.9 0.943 111.1 49.5 -59.5 -42.5 88.7 63.2 6.8 114 118 A Y H ><5S+ 0 0 56 -4,-2.2 3,-2.1 1,-0.3 -2,-0.2 0.879 104.3 57.2 -64.9 -36.9 88.8 65.2 10.1 115 119 A L H 3<5S+ 0 0 14 -4,-2.4 298,-3.4 1,-0.3 -1,-0.3 0.733 104.7 54.5 -65.6 -19.2 85.9 63.2 11.5 116 120 A F T <<5S- 0 0 26 -4,-1.0 -1,-0.3 -3,-0.9 -2,-0.2 0.318 127.9-101.1 -93.9 4.8 88.1 60.2 10.9 117 121 A G T < 5S+ 0 0 47 -3,-2.1 -3,-0.2 1,-0.3 2,-0.2 0.611 82.0 121.0 89.4 14.1 90.9 61.8 12.9 118 122 A L < - 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