==== 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-AUG-05 2AU1 . COMPND 2 MOLECULE: IGG-DEGRADING PROTEASE; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOCOCCUS PYOGENES; . AUTHOR J.AGNISWAMY,M.J.NAGIEC,M.LIU,P.SCHUCK,J.M.MUSSER,P.D.SUN . 292 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13423.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 168 57.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 59 20.2 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 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 1.0 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 . 16 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 26 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 53 18.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 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 0 0 1 1 0 2 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 0 2 2 3 2 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 ANTIPARALLEL BRIDGES PER LADDER . 1 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 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 48 A V 0 0 127 0, 0.0 224,-0.2 0, 0.0 225,-0.1 0.000 360.0 360.0 360.0 95.6 22.8 48.2 4.6 2 49 A T - 0 0 90 221,-0.1 222,-3.8 223,-0.1 2,-0.3 -0.169 360.0-161.3 -51.5 145.8 23.6 49.2 8.2 3 50 A S E -A 223 0A 57 220,-0.3 2,-0.4 2,-0.0 220,-0.3 -0.961 12.8-156.0-135.1 154.4 21.0 51.5 9.7 4 51 A V E -A 222 0A 28 218,-2.7 218,-2.6 -2,-0.3 2,-0.3 -0.994 9.6-163.8-134.0 129.3 20.8 53.9 12.5 5 52 A W E -A 221 0A 47 -2,-0.4 216,-0.2 216,-0.3 3,-0.1 -0.739 33.3 -88.2-110.9 160.0 17.7 55.0 14.4 6 53 A T > - 0 0 3 214,-2.6 3,-2.0 -2,-0.3 195,-0.1 -0.299 59.8 -86.0 -61.4 145.6 17.0 57.9 16.7 7 54 A K T 3 S+ 0 0 70 193,-0.4 -1,-0.1 189,-0.3 3,-0.1 -0.289 113.4 10.1 -54.1 131.2 17.7 57.3 20.4 8 55 A G T 3 S+ 0 0 53 1,-0.2 2,-0.5 -3,-0.1 -1,-0.3 0.604 97.0 125.0 75.5 12.4 14.7 55.6 22.0 9 56 A V < - 0 0 11 -3,-2.0 22,-0.2 211,-0.1 -1,-0.2 -0.914 53.1-141.8-113.5 129.5 12.7 55.0 18.9 10 57 A T - 0 0 74 20,-2.6 22,-0.2 -2,-0.5 3,-0.1 -0.771 27.2-118.6 -87.5 115.9 11.5 51.5 17.9 11 58 A P - 0 0 61 0, 0.0 -1,-0.0 0, 0.0 -6,-0.0 -0.317 36.4-111.0 -54.5 127.1 11.7 50.8 14.2 12 59 A P - 0 0 16 0, 0.0 3,-0.1 0, 0.0 14,-0.0 -0.198 26.0-165.5 -58.4 155.4 8.2 50.2 12.8 13 60 A A S S+ 0 0 104 1,-0.1 11,-0.0 -3,-0.1 0, 0.0 0.156 72.7 76.9-127.0 14.0 7.5 46.7 11.7 14 61 A N + 0 0 58 11,-0.1 9,-0.1 2,-0.1 -1,-0.1 -0.111 59.0 151.0-119.0 36.5 4.3 47.4 9.8 15 62 A F - 0 0 49 9,-0.2 2,-0.3 -3,-0.1 9,-0.3 -0.385 18.7-179.1 -68.0 145.2 5.6 48.9 6.6 16 63 A T E -B 23 0A 79 7,-2.7 7,-2.8 -2,-0.1 2,-0.6 -0.991 34.5-111.9-145.0 146.3 3.6 48.4 3.5 17 64 A Q E -B 22 0A 121 -2,-0.3 5,-0.3 5,-0.2 2,-0.1 -0.719 47.9-165.1 -79.9 121.7 4.0 49.4 -0.1 18 65 A G - 0 0 18 3,-3.2 -1,-0.0 -2,-0.6 4,-0.0 -0.291 37.4 -81.3 -99.6-171.6 1.3 51.9 -0.7 19 66 A E S S- 0 0 166 1,-0.2 3,-0.1 -2,-0.1 -2,-0.0 0.877 125.0 -2.1 -54.2 -42.7 -0.3 53.6 -3.6 20 67 A D S S+ 0 0 116 1,-0.2 2,-0.3 244,-0.0 -1,-0.2 0.563 132.9 26.3-127.2 -19.3 2.6 56.1 -3.8 21 68 A V S S- 0 0 14 -5,-0.1 -3,-3.2 228,-0.0 2,-0.6 -0.929 72.6-110.6-146.8 163.9 5.0 55.4 -1.0 22 69 A F E +BC 17 248A 69 226,-0.5 226,-1.7 241,-0.3 2,-0.3 -0.895 56.2 162.0 -97.4 120.7 6.3 52.6 1.3 23 70 A H E -BC 16 247A 24 -7,-2.8 -7,-2.7 -2,-0.6 224,-0.2 -0.908 43.0-136.2-143.2 169.9 5.0 53.4 4.8 24 71 A A E - C 0 246A 0 222,-2.3 222,-2.2 -2,-0.3 -9,-0.2 -0.954 35.4-122.1-128.7 108.5 4.2 52.3 8.3 25 72 A P - 0 0 47 0, 0.0 220,-0.2 0, 0.0 219,-0.1 -0.150 44.0 -86.8 -50.5 139.8 0.9 53.5 9.8 26 73 A Y - 0 0 40 216,-0.4 2,-0.4 8,-0.1 7,-0.0 -0.155 44.6-175.2 -53.6 138.3 1.3 55.4 13.1 27 74 A V > - 0 0 63 -3,-0.1 3,-0.9 5,-0.1 5,-0.3 -0.985 23.5-122.9-137.6 122.4 1.5 53.5 16.3 28 75 A A T 3 S+ 0 0 40 -2,-0.4 5,-0.1 1,-0.2 70,-0.0 -0.176 86.3 20.1 -67.4 157.8 1.6 55.3 19.7 29 76 A N T 3 S+ 0 0 117 3,-0.2 -1,-0.2 1,-0.1 4,-0.1 0.588 83.7 117.6 60.5 16.6 4.3 54.9 22.4 30 77 A Q S < S- 0 0 66 -3,-0.9 -20,-2.6 2,-0.3 -1,-0.1 0.434 93.3-102.8 -87.6 -3.2 6.7 53.5 19.8 31 78 A G S S+ 0 0 7 1,-0.3 2,-0.3 -22,-0.2 30,-0.1 0.098 92.2 88.9 104.0 -22.4 9.0 56.4 20.4 32 79 A W - 0 0 2 -5,-0.3 -2,-0.3 -22,-0.2 2,-0.3 -0.713 58.1-148.6-110.6 162.6 8.2 58.5 17.3 33 80 A Y - 0 0 2 -2,-0.3 185,-0.1 -3,-0.1 2,-0.1 -0.937 13.4-168.0-132.8 152.9 5.6 61.1 16.5 34 81 A D - 0 0 2 -2,-0.3 2,-0.2 64,-0.2 211,-0.1 -0.503 9.9-169.6-137.6 66.8 3.6 62.4 13.6 35 82 A I - 0 0 1 15,-0.3 2,-0.4 -2,-0.1 66,-0.2 -0.433 19.7-154.6 -58.2 122.3 1.9 65.7 14.3 36 83 A T - 0 0 5 64,-2.7 203,-0.2 -2,-0.2 2,-0.1 -0.872 8.1-124.7-108.9 137.4 -0.5 66.1 11.3 37 84 A K - 0 0 10 201,-2.8 205,-0.1 -2,-0.4 7,-0.0 -0.470 10.1-162.7 -77.9 148.3 -1.8 69.4 9.9 38 85 A T - 0 0 67 -2,-0.1 -1,-0.1 63,-0.1 6,-0.1 0.374 33.4-132.3-108.2 0.1 -5.5 70.0 9.5 39 86 A F + 0 0 96 1,-0.2 -2,-0.0 4,-0.1 200,-0.0 0.909 48.8 157.5 46.6 50.2 -4.9 73.0 7.2 40 87 A N - 0 0 71 1,-0.0 -1,-0.2 0, 0.0 -3,-0.0 0.081 69.3 -94.4 -89.9 22.2 -7.4 75.1 9.2 41 88 A G S S+ 0 0 29 1,-0.1 4,-0.1 77,-0.1 -1,-0.0 0.110 119.9 65.5 89.3 -22.7 -5.8 78.3 7.9 42 89 A K S S+ 0 0 74 76,-0.1 76,-0.7 75,-0.1 75,-0.3 0.708 108.5 31.8-103.5 -25.0 -3.4 78.7 10.9 43 90 A D S > S+ 0 0 0 1,-0.1 3,-2.2 75,-0.1 7,-0.1 0.380 81.3 111.5-112.9 -0.4 -1.1 75.7 10.4 44 91 A D T 3 S+ 0 0 47 1,-0.3 3,-0.1 2,-0.1 -1,-0.1 0.764 95.9 22.3 -44.5 -36.4 -1.1 75.4 6.6 45 92 A L T 3 S+ 0 0 40 -3,-0.1 3,-0.4 1,-0.1 79,-0.3 0.018 94.4 103.4-124.2 26.7 2.5 76.4 6.4 46 93 A L <> + 0 0 0 -3,-2.2 4,-2.3 1,-0.2 3,-0.3 0.016 30.1 128.3 -97.8 26.9 3.7 75.6 9.9 47 94 A C H > S+ 0 0 1 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.802 73.3 61.0 -52.1 -25.9 5.6 72.4 9.0 48 95 A G H > S+ 0 0 1 -3,-0.4 4,-2.6 2,-0.2 -1,-0.2 0.976 106.6 40.7 -64.1 -56.1 8.4 74.0 10.9 49 96 A A H > S+ 0 0 0 -3,-0.3 4,-1.9 1,-0.2 -2,-0.2 0.795 113.8 55.8 -62.9 -29.7 6.5 74.2 14.2 50 97 A A H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -15,-0.3 0.929 108.9 45.2 -69.5 -44.2 5.1 70.7 13.6 51 98 A T H X S+ 0 0 1 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.940 114.4 50.2 -61.4 -46.1 8.6 69.2 13.2 52 99 A A H X S+ 0 0 0 -4,-2.6 4,-1.8 1,-0.2 -1,-0.2 0.857 109.1 52.6 -59.6 -36.3 9.6 71.1 16.3 53 100 A G H X S+ 0 0 0 -4,-1.9 4,-1.5 1,-0.2 -1,-0.2 0.913 109.1 48.4 -66.9 -42.6 6.5 69.7 18.0 54 101 A N H X S+ 0 0 0 -4,-2.5 4,-1.6 1,-0.2 -2,-0.2 0.871 109.6 52.2 -65.3 -38.3 7.5 66.2 17.1 55 102 A M H X S+ 0 0 2 -4,-2.4 4,-1.6 1,-0.2 -1,-0.2 0.885 109.6 50.6 -66.4 -35.4 11.1 66.7 18.3 56 103 A L H X S+ 0 0 0 -4,-1.8 4,-1.8 2,-0.2 -1,-0.2 0.788 104.4 56.5 -72.0 -29.5 9.7 68.0 21.6 57 104 A H H X S+ 0 0 0 -4,-1.5 4,-1.5 2,-0.2 -1,-0.2 0.927 108.9 46.8 -67.1 -42.1 7.4 65.0 22.1 58 105 A W H X S+ 0 0 0 -4,-1.6 4,-2.0 1,-0.2 -2,-0.2 0.881 110.1 55.3 -62.4 -38.8 10.4 62.7 21.8 59 106 A W H X S+ 0 0 0 -4,-1.6 4,-0.9 1,-0.2 -1,-0.2 0.844 101.4 57.3 -63.5 -37.7 12.1 65.1 24.3 60 107 A F H >< S+ 0 0 5 -4,-1.8 3,-0.6 2,-0.2 4,-0.4 0.919 107.6 47.4 -59.7 -45.9 9.3 64.6 26.8 61 108 A D H >< S+ 0 0 51 -4,-1.5 3,-1.0 1,-0.2 4,-0.2 0.931 110.7 51.8 -59.9 -49.0 9.9 60.8 26.8 62 109 A Q H 3< S+ 0 0 37 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.607 123.1 29.1 -65.1 -17.7 13.6 61.2 27.2 63 110 A N T S+ 0 0 151 -3,-1.0 4,-1.5 -4,-0.4 -2,-0.1 0.861 80.4 40.1 -37.7 -55.9 9.9 62.3 31.7 65 112 A D H > S+ 0 0 85 -4,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.898 116.2 48.4 -67.2 -43.1 11.3 62.1 35.2 66 113 A Q H > S+ 0 0 43 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.883 109.9 52.9 -66.4 -38.3 13.3 65.3 35.2 67 114 A I H X S+ 0 0 4 -4,-3.2 4,-2.3 2,-0.2 -1,-0.2 0.872 108.3 51.5 -64.5 -36.6 10.4 67.3 33.8 68 115 A K H X S+ 0 0 138 -4,-1.5 4,-0.7 -5,-0.3 -2,-0.2 0.947 112.2 44.2 -65.1 -49.2 8.2 66.0 36.6 69 116 A R H X S+ 0 0 130 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.813 111.2 57.4 -65.8 -29.9 10.8 67.0 39.3 70 117 A Y H X S+ 0 0 2 -4,-2.0 4,-3.0 1,-0.2 -2,-0.2 0.939 106.0 46.3 -66.4 -48.4 11.2 70.3 37.5 71 118 A L H < S+ 0 0 14 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.643 109.6 58.4 -68.9 -12.0 7.5 71.2 37.7 72 119 A E H < S+ 0 0 124 -4,-0.7 -1,-0.2 -5,-0.2 -2,-0.2 0.880 111.4 39.3 -79.8 -42.6 7.8 70.2 41.3 73 120 A E H < S+ 0 0 110 -4,-1.8 -2,-0.2 1,-0.2 -3,-0.1 0.907 129.9 29.6 -71.5 -45.9 10.5 72.8 41.9 74 121 A H >< + 0 0 35 -4,-3.0 3,-1.9 1,-0.1 4,-0.3 -0.648 65.9 171.0-121.9 75.1 8.9 75.5 39.7 75 122 A P G > S+ 0 0 75 0, 0.0 3,-1.3 0, 0.0 4,-0.4 0.772 75.1 61.8 -50.9 -37.6 5.1 75.1 39.7 76 123 A E G 3 S+ 0 0 131 1,-0.3 3,-0.3 2,-0.2 -5,-0.1 0.601 91.1 66.5 -71.2 -11.9 4.5 78.4 37.9 77 124 A K G < S+ 0 0 31 -3,-1.9 -1,-0.3 1,-0.2 13,-0.2 0.624 84.5 77.4 -83.1 -11.0 6.4 77.3 34.8 78 125 A Q S < S+ 0 0 32 -3,-1.3 12,-2.7 -4,-0.3 2,-0.3 0.884 98.8 35.6 -64.4 -42.5 3.7 74.6 34.2 79 126 A K E -K 89 0B 88 -4,-0.4 2,-0.5 -3,-0.3 10,-0.2 -0.847 67.0-148.9-118.4 153.2 1.1 77.1 32.8 80 127 A I E -K 88 0B 23 8,-2.5 7,-3.6 -2,-0.3 8,-1.1 -0.974 19.5-171.7-120.2 115.0 1.4 80.2 30.6 81 128 A N E -K 86 0B 103 -2,-0.5 2,-0.4 5,-0.3 5,-0.2 -0.758 14.7-156.2-107.9 155.2 -1.1 82.9 31.1 82 129 A F E > S-K 85 0B 139 3,-2.9 3,-1.6 -2,-0.3 -2,-0.0 -0.885 74.6 -41.3-131.2 98.9 -1.8 86.0 29.1 83 130 A N T 3 S- 0 0 155 -2,-0.4 3,-0.1 1,-0.3 -1,-0.0 0.926 126.7 -31.0 47.6 60.4 -3.5 88.7 31.1 84 131 A G T 3 S+ 0 0 83 1,-0.1 2,-0.4 0, 0.0 -1,-0.3 0.085 119.9 93.2 93.9 -27.5 -5.9 86.5 32.9 85 132 A E E < S-K 82 0B 99 -3,-1.6 -3,-2.9 2,-0.0 2,-0.2 -0.891 75.5-119.7-109.7 135.9 -6.5 83.8 30.4 86 133 A Q E -K 81 0B 83 -2,-0.4 -5,-0.3 -5,-0.2 3,-0.1 -0.496 26.7-179.5 -68.0 128.9 -4.5 80.5 30.2 87 134 A M E - 0 0 28 -7,-3.6 2,-0.3 1,-0.4 -6,-0.2 0.657 65.1 -3.5-102.7 -21.0 -2.6 80.1 26.9 88 135 A F E -K 80 0B 6 -8,-1.1 -8,-2.5 24,-0.1 2,-0.5 -0.942 46.3-156.5-172.3 143.9 -1.0 76.7 27.6 89 136 A D E >> -K 79 0B 12 -2,-0.3 4,-1.6 -10,-0.2 3,-0.9 -0.979 14.1-153.6-127.8 114.1 -0.6 74.0 30.2 90 137 A V H 3> S+ 0 0 0 -12,-2.7 4,-2.0 -2,-0.5 -11,-0.1 0.770 95.0 60.2 -60.7 -25.1 2.6 71.9 29.6 91 138 A K H 3> S+ 0 0 104 -13,-0.3 4,-2.1 2,-0.2 -1,-0.3 0.839 101.6 51.9 -72.5 -32.1 0.9 68.9 31.3 92 139 A E H <> S+ 0 0 75 -3,-0.9 4,-1.7 2,-0.2 12,-0.4 0.905 108.3 52.9 -67.4 -39.2 -1.9 68.9 28.8 93 140 A A H X S+ 0 0 0 -4,-1.6 4,-0.5 1,-0.2 12,-0.3 0.921 109.8 47.7 -59.8 -45.0 0.8 68.8 26.1 94 141 A I H >< S+ 0 0 44 -4,-2.0 3,-0.6 1,-0.2 -1,-0.2 0.868 110.4 50.7 -66.4 -37.6 2.4 65.8 27.8 95 142 A D H 3< S+ 0 0 127 -4,-2.1 3,-0.2 1,-0.2 -1,-0.2 0.794 119.1 37.9 -70.4 -27.3 -0.9 63.9 28.2 96 143 A T H >< S+ 0 0 25 -4,-1.7 3,-2.3 1,-0.1 -1,-0.2 0.320 78.6 113.2-107.3 8.4 -1.8 64.4 24.5 97 144 A K T << S+ 0 0 29 -3,-0.6 -1,-0.1 -4,-0.5 6,-0.1 0.784 74.3 58.9 -51.6 -31.0 1.7 64.0 22.9 98 145 A N T 3 S+ 0 0 34 -3,-0.2 2,-0.4 -4,-0.2 -1,-0.3 0.673 82.2 104.6 -74.9 -15.5 0.6 60.8 21.2 99 146 A H < - 0 0 79 -3,-2.3 4,-0.5 1,-0.1 -63,-0.1 -0.535 52.0-166.2 -75.1 123.7 -2.2 62.5 19.3 100 147 A Q S S+ 0 0 41 -2,-0.4 -64,-2.7 -65,-0.1 3,-0.2 0.927 85.1 25.9 -70.7 -49.1 -1.5 63.2 15.6 101 148 A L S S+ 0 0 90 -66,-0.2 -1,-0.1 1,-0.1 -63,-0.1 0.714 132.4 26.3 -92.6 -25.4 -4.4 65.7 14.9 102 149 A D S S+ 0 0 101 -6,-0.1 -1,-0.1 4,-0.0 -2,-0.1 -0.099 70.2 152.8-135.3 41.1 -5.2 67.3 18.2 103 150 A S > - 0 0 2 -4,-0.5 4,-1.5 -3,-0.2 5,-0.1 -0.385 49.5-127.0 -66.4 149.3 -2.1 67.3 20.4 104 151 A K H > S+ 0 0 64 -12,-0.4 4,-1.5 -11,-0.2 -11,-0.2 0.821 104.4 57.2 -69.0 -28.8 -2.2 70.1 22.9 105 152 A L H > S+ 0 0 0 -12,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.934 108.5 41.4 -68.8 -49.1 1.3 71.3 21.9 106 153 A F H > S+ 0 0 4 1,-0.2 4,-3.1 2,-0.2 5,-0.3 0.878 111.4 57.9 -68.2 -35.0 0.7 71.8 18.2 107 154 A E H X S+ 0 0 80 -4,-1.5 4,-2.3 1,-0.2 5,-0.4 0.900 106.7 49.8 -59.0 -39.8 -2.7 73.4 19.0 108 155 A Y H X>S+ 0 0 12 -4,-1.5 5,-2.6 2,-0.2 4,-2.1 0.912 112.0 47.3 -64.0 -43.8 -0.7 75.9 21.1 109 156 A F H <>S+ 0 0 0 -4,-1.9 5,-2.9 3,-0.2 -2,-0.2 0.938 118.9 38.2 -63.9 -49.3 1.7 76.6 18.2 110 157 A K H <5S+ 0 0 13 -4,-3.1 -2,-0.2 3,-0.2 -1,-0.2 0.796 126.3 35.7 -74.9 -29.6 -1.0 77.0 15.5 111 158 A E H <5S+ 0 0 52 -4,-2.3 -3,-0.2 -5,-0.3 -2,-0.2 0.892 134.5 6.4 -93.4 -42.8 -3.5 78.9 17.7 112 159 A K T <5S+ 0 0 93 -4,-2.1 -3,-0.2 -5,-0.4 -4,-0.1 0.788 126.0 43.1-112.3 -40.4 -1.5 81.1 20.1 113 160 A A T + 0 0 19 0, 0.0 3,-1.0 0, 0.0 2,-0.3 0.990 68.9 46.5 -59.8 -68.8 -1.2 81.9 14.4 116 163 A Y G 3 S+ 0 0 184 1,-0.2 -73,-0.1 2,-0.1 -74,-0.1 0.206 91.0 87.2 -65.5 16.7 -0.9 84.6 11.7 117 164 A L G X >S+ 0 0 14 -3,-0.8 3,-1.3 -2,-0.3 5,-0.9 0.900 84.2 49.6 -84.6 -40.4 2.0 82.9 9.9 118 165 A S T < 5S+ 0 0 12 -3,-1.0 -1,-0.2 -76,-0.7 3,-0.1 0.581 108.2 53.7 -74.9 -10.2 0.2 80.5 7.6 119 166 A T T 3 5S+ 0 0 114 -4,-0.3 -1,-0.3 -77,-0.1 -2,-0.1 0.294 108.6 53.3-102.0 7.4 -2.2 83.3 6.3 120 167 A K T < 5S- 0 0 116 -3,-1.3 -2,-0.2 2,-0.2 -1,-0.1 0.323 105.3-122.9-123.2 2.5 1.0 85.3 5.4 121 168 A H T 5S+ 0 0 118 -4,-0.2 2,-0.2 -3,-0.1 -3,-0.1 0.741 80.3 82.5 42.1 55.2 2.9 82.8 3.3 122 169 A L < - 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