==== 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 18-AUG-04 1X8G . COMPND 2 MOLECULE: BETA-LACTAMASE; . SOURCE 2 ORGANISM_SCIENTIFIC: AEROMONAS HYDROPHILA; . AUTHOR G.GARAU,O.DIDEBERG . 224 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9767.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 155 69.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 18 8.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 35 15.6 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 3 1.3 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 . 2 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 18 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 18 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 54 24.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.3 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 0 1 0 0 0 1 1 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 1 3 1 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 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 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 41 A A 0 0 118 0, 0.0 3,-0.1 0, 0.0 17,-0.1 0.000 360.0 360.0 360.0 157.7 11.4 37.4 52.3 2 42 A G + 0 0 39 1,-0.2 16,-2.3 15,-0.1 17,-0.3 0.841 360.0 8.2 -57.9 -37.2 10.1 39.8 55.0 3 43 A M E -A 17 0A 13 14,-0.2 2,-0.3 15,-0.1 -1,-0.2 -0.990 69.5-163.3-147.6 139.5 10.4 36.8 57.4 4 44 A S E -A 16 0A 34 12,-2.0 12,-1.9 -2,-0.3 2,-0.4 -0.907 5.8-161.8-121.9 150.5 11.9 33.3 57.1 5 45 A L E +A 15 0A 28 -2,-0.3 2,-0.4 10,-0.2 10,-0.2 -0.972 24.1 170.9-130.3 117.2 11.4 30.3 59.3 6 46 A T E -A 14 0A 80 8,-2.4 8,-3.0 -2,-0.4 2,-0.1 -0.991 34.8-111.0-138.9 135.3 14.2 27.7 58.8 7 47 A Q E +A 13 0A 112 -2,-0.4 6,-0.3 6,-0.2 3,-0.1 -0.410 29.1 173.5 -65.1 131.7 15.2 24.5 60.6 8 48 A V E S- 0 0 42 4,-2.6 2,-0.3 1,-0.2 5,-0.2 0.720 74.3 -11.9 -99.0 -43.6 18.4 24.6 62.5 9 49 A S E > S-A 12 0A 47 3,-1.8 3,-2.5 1,-0.1 -1,-0.2 -0.818 105.2 -52.9-161.3 123.4 18.2 21.1 64.2 10 50 A G T 3 S- 0 0 40 1,-0.3 -1,-0.1 -2,-0.3 -2,-0.1 -0.252 125.6 -5.0 51.1-121.0 15.3 18.7 64.5 11 51 A P T 3 S+ 0 0 34 0, 0.0 18,-2.3 0, 0.0 2,-0.5 0.401 114.0 100.2 -82.1 3.4 12.2 20.5 66.0 12 52 A V E < +AB 9 28A 0 -3,-2.5 -4,-2.6 16,-0.2 -3,-1.8 -0.815 50.1 178.2-102.4 122.3 14.2 23.7 66.5 13 53 A Y E -AB 7 27A 43 14,-3.0 14,-2.1 -2,-0.5 2,-0.4 -0.871 21.7-133.4-124.4 153.8 13.8 26.5 64.0 14 54 A V E -AB 6 26A 7 -8,-3.0 -8,-2.4 -2,-0.3 2,-0.6 -0.927 10.9-149.0-112.2 133.1 15.1 30.0 63.6 15 55 A V E -AB 5 25A 0 10,-2.8 10,-1.9 -2,-0.4 2,-0.7 -0.919 5.0-164.5 -97.4 116.9 13.0 33.0 62.8 16 56 A E E -AB 4 24A 57 -12,-1.9 -12,-2.0 -2,-0.6 2,-0.8 -0.921 9.1-169.3 -99.9 109.2 14.7 35.8 60.8 17 57 A D E -AB 3 23A 0 6,-2.6 6,-2.3 -2,-0.7 -14,-0.2 -0.882 7.8-178.1-102.4 98.5 12.3 38.8 61.2 18 58 A N + 0 0 67 -16,-2.3 4,-0.2 -2,-0.8 -15,-0.1 0.411 42.5 116.8 -86.3 1.5 13.6 41.4 58.7 19 59 A Y S S- 0 0 68 -17,-0.3 4,-0.2 2,-0.1 -2,-0.1 -0.415 88.2 -22.4 -65.0 143.0 11.0 44.0 59.7 20 60 A Y S S- 0 0 72 -2,-0.1 2,-0.6 2,-0.1 3,-0.0 -0.271 139.3 -0.5 56.2-126.2 12.4 47.2 61.2 21 67 A V S S- 0 0 82 1,-0.1 -2,-0.1 91,-0.0 -4,-0.1 -0.858 101.4 -98.1 -86.6 129.1 15.9 46.3 62.6 22 68 A Q - 0 0 57 -2,-0.6 183,-0.5 -4,-0.2 2,-0.4 -0.097 48.0-177.3 -49.7 128.2 16.4 42.6 61.9 23 69 A E E -B 17 0A 0 -6,-2.3 -6,-2.6 -4,-0.2 2,-0.4 -0.981 14.8-146.0-126.9 139.8 15.6 40.5 65.0 24 70 A N E +B 16 0A 0 179,-2.0 -8,-0.2 -2,-0.4 2,-0.2 -0.924 23.6 166.2-108.5 134.9 16.0 36.7 65.3 25 71 A S E -B 15 0A 0 -10,-1.9 -10,-2.8 -2,-0.4 2,-0.3 -0.592 23.4-121.0-131.1-174.9 13.6 34.5 67.3 26 72 A M E -BC 14 37A 0 11,-2.4 11,-3.2 -12,-0.3 2,-0.3 -0.943 10.2-158.2-140.0 161.0 13.0 30.8 67.6 27 73 A V E -BC 13 36A 0 -14,-2.1 -14,-3.0 -2,-0.3 2,-0.5 -0.998 3.8-163.2-139.7 136.7 10.3 28.2 67.2 28 74 A Y E -BC 12 35A 20 7,-2.5 7,-2.6 -2,-0.3 2,-0.9 -0.990 11.0-151.6-125.0 115.8 10.1 24.7 68.7 29 75 A F E - C 0 34A 28 -18,-2.3 5,-0.2 -2,-0.5 2,-0.1 -0.822 28.2-177.9 -91.4 99.7 7.6 22.2 67.1 30 76 A G - 0 0 10 3,-2.0 29,-0.1 -2,-0.9 104,-0.0 -0.309 40.6 -97.3 -94.6-179.5 6.7 19.9 69.9 31 77 A A S S+ 0 0 82 1,-0.2 3,-0.1 -2,-0.1 -1,-0.0 0.877 122.5 28.5 -64.1 -41.5 4.5 16.8 70.3 32 78 A K S S- 0 0 143 1,-0.3 2,-0.3 27,-0.1 -1,-0.2 0.659 131.2 -52.1 -97.2 -20.4 1.5 18.7 71.7 33 79 A G - 0 0 0 26,-0.2 -3,-2.0 28,-0.0 2,-0.4 -0.989 66.5 -52.5 168.6-166.3 2.1 22.0 70.0 34 80 A V E -Cd 29 61A 0 26,-2.8 28,-2.3 -2,-0.3 29,-1.1 -0.792 28.6-159.6-109.6 134.8 4.4 24.9 69.2 35 81 A T E -Cd 28 63A 0 -7,-2.6 -7,-2.5 -2,-0.4 2,-0.4 -0.957 10.2-156.2-109.3 129.7 6.5 27.1 71.5 36 82 A V E -Cd 27 64A 0 27,-2.6 29,-2.5 -2,-0.5 2,-0.7 -0.889 3.3-153.9-106.3 133.2 7.6 30.5 70.1 37 83 A V E S+Cd 26 65A 0 -11,-3.2 -11,-2.4 -2,-0.4 29,-0.1 -0.927 75.2 15.1-111.0 100.0 10.7 32.0 71.7 38 84 A G S S- 0 0 0 27,-2.1 28,-0.2 -2,-0.7 -1,-0.2 0.529 73.8-128.3 99.4 122.3 10.4 35.8 71.3 39 85 A A - 0 0 0 34,-2.6 34,-0.2 26,-0.2 35,-0.2 0.576 46.0-127.4 -76.1 -8.6 7.1 37.4 70.3 40 86 A T - 0 0 0 32,-0.6 36,-1.7 1,-0.1 35,-0.4 -0.028 36.4 -62.8 69.0 176.1 8.6 39.4 67.3 41 87 A W S S- 0 0 14 34,-0.2 -1,-0.1 33,-0.1 33,-0.1 0.817 104.2 -0.7 -67.9 -41.3 8.3 43.1 66.7 42 88 A T S > S- 0 0 5 -3,-0.1 4,-2.3 30,-0.1 34,-0.2 -0.929 72.3 -98.6-144.9 164.8 4.5 43.7 66.2 43 89 A P H > S+ 0 0 38 0, 0.0 4,-1.9 0, 0.0 5,-0.1 0.855 125.3 53.5 -54.0 -34.8 1.1 42.0 66.0 44 90 A D H > S+ 0 0 86 2,-0.2 4,-1.7 1,-0.2 5,-0.1 0.888 108.6 46.4 -68.9 -42.0 1.6 42.1 62.2 45 91 A T H > S+ 0 0 0 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.869 111.1 53.4 -67.5 -35.1 5.0 40.4 62.3 46 92 A A H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.917 107.0 51.3 -63.9 -41.3 3.6 37.8 64.7 47 93 A R H X S+ 0 0 128 -4,-1.9 4,-1.8 1,-0.2 -1,-0.2 0.888 108.9 52.1 -61.4 -36.3 0.8 37.1 62.3 48 94 A E H X S+ 0 0 45 -4,-1.7 4,-1.6 1,-0.2 -1,-0.2 0.884 110.3 47.2 -70.0 -36.8 3.4 36.6 59.6 49 95 A L H X S+ 0 0 0 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.918 109.3 54.0 -67.9 -40.5 5.3 34.1 61.7 50 96 A H H X S+ 0 0 22 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.880 105.1 55.4 -61.6 -35.8 2.1 32.3 62.5 51 97 A K H X S+ 0 0 92 -4,-1.8 4,-0.9 1,-0.2 -1,-0.2 0.925 109.6 45.9 -63.6 -43.2 1.5 32.0 58.7 52 98 A L H < S+ 0 0 50 -4,-1.6 3,-0.4 1,-0.2 4,-0.4 0.892 110.2 54.3 -64.5 -39.1 4.9 30.4 58.3 53 99 A I H >X S+ 0 0 2 -4,-2.5 4,-2.5 1,-0.2 3,-1.9 0.915 102.3 56.0 -57.9 -43.6 4.2 28.1 61.3 54 100 A K H 3< S+ 0 0 135 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.742 99.9 60.9 -74.1 -12.9 0.9 26.8 59.8 55 102 A R T 3< S+ 0 0 226 -4,-0.9 -1,-0.3 -3,-0.4 -2,-0.2 0.632 114.5 36.2 -78.9 -13.6 2.8 25.7 56.6 56 103 A V T <4 S+ 0 0 71 -3,-1.9 2,-0.3 -4,-0.4 -2,-0.2 0.772 127.6 9.1-104.1 -41.3 4.9 23.4 58.9 57 104 A S < - 0 0 24 -4,-2.5 -1,-0.3 2,-0.1 -23,-0.0 -0.995 43.8-151.9-146.4 147.9 2.4 22.1 61.5 58 105 A R + 0 0 234 -2,-0.3 -4,-0.1 -3,-0.1 -1,-0.1 0.396 65.5 114.5 -94.5 -4.2 -1.3 22.1 62.3 59 106 A K S S- 0 0 79 1,-0.1 -26,-0.2 -29,-0.1 -2,-0.1 -0.407 76.0 -93.0 -71.0 153.2 -0.7 21.8 66.0 60 108 A P - 0 0 77 0, 0.0 -26,-2.8 0, 0.0 2,-0.8 -0.222 29.6-116.2 -64.3 150.0 -1.7 24.8 68.3 61 109 A V E -d 34 0A 12 -28,-0.2 -26,-0.2 1,-0.2 3,-0.1 -0.783 36.7-173.8 -79.3 111.7 0.8 27.6 69.2 62 110 A L E - 0 0 55 -28,-2.3 24,-2.4 -2,-0.8 2,-0.3 0.856 53.0 -14.6 -81.6 -43.1 0.8 26.8 73.0 63 111 A E E -de 35 86A 18 -29,-1.1 -27,-2.6 22,-0.3 2,-0.4 -0.988 47.5-144.0-161.3 160.5 2.9 29.7 74.3 64 112 A V E -de 36 87A 0 22,-2.0 24,-3.2 -2,-0.3 2,-0.5 -0.998 21.6-139.3-131.4 132.1 5.2 32.5 73.4 65 113 A I E -de 37 88A 0 -29,-2.5 -27,-2.1 -2,-0.4 2,-0.9 -0.828 1.0-149.6 -97.2 124.2 8.1 33.6 75.7 66 114 A N - 0 0 0 22,-2.8 24,-0.4 -2,-0.5 8,-0.1 -0.834 11.8-169.5 -85.6 105.4 9.0 37.2 76.2 67 115 A T S S- 0 0 0 -2,-0.9 85,-2.1 6,-0.3 2,-0.3 0.544 73.2 -2.8 -83.1 -7.3 12.7 36.9 76.8 68 116 A N S S- 0 0 0 83,-0.2 25,-0.0 2,-0.2 -30,-0.0 -0.920 80.4-100.8-157.1-176.9 12.8 40.5 77.9 69 117 A Y S S+ 0 0 7 -2,-0.3 35,-0.1 4,-0.1 5,-0.0 0.414 80.8 115.4 -86.6 -0.8 10.3 43.4 78.2 70 118 A H S >> S- 0 0 7 1,-0.1 4,-1.7 34,-0.0 3,-0.9 -0.198 78.0-109.5 -73.1 159.8 11.4 45.1 75.0 71 119 A T H 3> S+ 0 0 3 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.809 115.7 55.6 -56.0 -40.0 9.4 45.7 71.8 72 120 A D H 34 S+ 0 0 10 1,-0.2 -32,-0.6 2,-0.2 -1,-0.2 0.710 118.3 34.3 -71.2 -17.4 11.4 43.3 69.7 73 121 A R H <4 S+ 0 0 0 -3,-0.9 -34,-2.6 -34,-0.2 -6,-0.3 0.614 133.6 25.3-106.4 -14.8 10.7 40.4 72.2 74 122 A A H >< S+ 0 0 2 -4,-1.7 3,-1.7 -36,-0.2 4,-0.2 0.407 88.2 99.1-130.2 1.4 7.2 41.4 73.3 75 123 A G T 3< S+ 0 0 4 -4,-1.9 3,-0.5 -35,-0.4 -34,-0.2 0.795 82.2 55.5 -68.8 -30.0 5.7 43.4 70.5 76 124 A G T >> S+ 0 0 0 -36,-1.7 4,-1.6 -34,-0.2 3,-1.4 0.541 74.8 105.6 -73.8 -9.8 3.7 40.6 69.0 77 125 A N H <> S+ 0 0 2 -3,-1.7 4,-3.1 1,-0.3 5,-0.3 0.786 70.2 60.9 -46.0 -41.2 1.9 39.8 72.3 78 126 A A H 3> S+ 0 0 45 -3,-0.5 4,-1.9 1,-0.2 -1,-0.3 0.901 110.4 43.9 -52.8 -42.2 -1.5 41.2 71.2 79 127 A Y H <> S+ 0 0 36 -3,-1.4 4,-1.3 2,-0.2 -1,-0.2 0.945 112.4 48.9 -69.4 -48.0 -1.6 38.7 68.4 80 128 A W H ><>S+ 0 0 0 -4,-1.6 5,-2.1 1,-0.2 3,-0.6 0.919 113.0 48.3 -60.6 -40.6 -0.4 35.7 70.4 81 129 A K H ><5S+ 0 0 71 -4,-3.1 3,-1.8 1,-0.2 -1,-0.2 0.912 106.9 58.6 -64.6 -39.6 -3.0 36.5 73.1 82 130 A S H 3<5S+ 0 0 87 -4,-1.9 -1,-0.2 -5,-0.3 -2,-0.2 0.752 106.0 46.6 -63.3 -27.6 -5.7 36.8 70.4 83 131 A I T <<5S- 0 0 61 -4,-1.3 -1,-0.3 -3,-0.6 -2,-0.2 0.371 122.7-104.7 -97.2 3.5 -5.2 33.3 69.1 84 133 A G T < 5S+ 0 0 65 -3,-1.8 2,-0.2 1,-0.3 -3,-0.2 0.622 70.5 145.6 86.2 17.2 -5.2 31.8 72.7 85 134 A A < - 0 0 2 -5,-2.1 -1,-0.3 -6,-0.2 -22,-0.3 -0.602 52.8-115.2 -80.4 146.5 -1.4 31.2 73.1 86 135 A K E -e 63 0A 115 -24,-2.4 -22,-2.0 -2,-0.2 2,-0.5 -0.467 20.0-141.0 -74.1 151.4 -0.0 31.8 76.6 87 136 A V E -e 64 0A 0 -24,-0.2 38,-1.9 -2,-0.1 37,-1.3 -0.991 25.5-163.1-117.0 121.1 2.5 34.7 76.9 88 137 A V E +ef 65 125A 2 -24,-3.2 -22,-2.8 -2,-0.5 2,-0.3 -0.843 20.8 141.5-117.9 138.4 5.2 33.5 79.3 89 138 A S E - f 0 126A 0 36,-2.0 38,-2.5 -2,-0.4 2,-0.1 -0.966 49.0 -89.3-157.2 171.0 7.9 35.6 81.2 90 139 A T E > - f 0 127A 13 -24,-0.4 4,-2.2 -2,-0.3 38,-0.2 -0.442 44.0-111.0 -75.0 164.1 9.8 35.8 84.4 91 140 A R H > S+ 0 0 101 36,-2.3 4,-2.6 1,-0.2 5,-0.2 0.907 119.2 54.5 -64.2 -39.4 8.2 38.0 87.1 92 141 A Q H > S+ 0 0 69 35,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.907 108.2 48.2 -59.5 -45.8 10.9 40.5 86.7 93 142 A T H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.917 112.9 49.3 -64.3 -42.4 10.3 40.9 83.0 94 143 A R H X S+ 0 0 58 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.895 111.5 47.7 -62.0 -45.4 6.6 41.2 83.6 95 144 A D H X S+ 0 0 72 -4,-2.6 4,-1.9 2,-0.2 -2,-0.2 0.894 113.1 48.0 -63.5 -40.6 7.1 43.9 86.3 96 145 A L H X S+ 0 0 39 -4,-2.4 4,-2.8 1,-0.2 5,-0.2 0.870 109.9 53.8 -67.9 -32.9 9.5 45.9 84.1 97 146 A M H X S+ 0 0 1 -4,-2.3 4,-1.8 -5,-0.2 5,-0.2 0.925 108.1 49.5 -68.6 -40.7 7.1 45.6 81.2 98 147 A K H < S+ 0 0 124 -4,-1.9 4,-0.2 1,-0.2 -1,-0.2 0.926 121.0 34.6 -63.3 -42.8 4.2 47.1 83.3 99 148 A S H < S+ 0 0 81 -4,-1.9 -2,-0.2 1,-0.1 -1,-0.2 0.847 130.6 27.9 -81.2 -30.8 6.3 50.0 84.5 100 149 A D H X S+ 0 0 39 -4,-2.8 4,-2.3 -5,-0.2 5,-0.3 0.334 82.8 102.6-121.3 -0.3 8.5 50.7 81.4 101 150 A W H X S+ 0 0 14 -4,-1.8 4,-2.8 1,-0.2 5,-0.2 0.933 86.1 50.0 -53.8 -49.6 6.5 49.6 78.3 102 151 A A H > S+ 0 0 80 -4,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.916 110.6 50.6 -59.4 -39.9 5.5 53.1 77.4 103 152 A E H > S+ 0 0 110 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.883 112.0 46.0 -60.4 -47.5 9.2 54.2 77.7 104 153 A I H X S+ 0 0 4 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.867 111.5 52.3 -69.2 -35.7 10.5 51.4 75.4 105 154 A V H X S+ 0 0 2 -4,-2.8 4,-2.0 -5,-0.3 -2,-0.2 0.947 111.9 46.3 -62.4 -45.1 7.8 52.0 72.9 106 155 A A H X S+ 0 0 51 -4,-2.5 4,-1.2 -5,-0.2 -2,-0.2 0.903 113.3 49.9 -61.7 -39.6 8.8 55.7 72.8 107 156 A F H X S+ 0 0 89 -4,-2.3 4,-1.1 1,-0.2 3,-0.5 0.922 109.2 51.4 -65.5 -43.8 12.4 54.8 72.6 108 157 A T H X S+ 0 0 10 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.902 108.3 52.1 -59.4 -39.6 11.7 52.4 69.7 109 158 A R H < S+ 0 0 94 -4,-2.0 -1,-0.2 2,-0.2 -2,-0.2 0.701 96.6 66.6 -78.3 -17.5 9.9 55.1 67.8 110 159 A K H < S+ 0 0 168 -4,-1.2 -1,-0.2 -3,-0.5 -2,-0.2 0.965 115.8 28.9 -59.3 -50.2 12.7 57.6 68.1 111 160 A G H < S+ 0 0 64 -4,-1.1 -2,-0.2 1,-0.2 -1,-0.2 0.766 135.4 33.5 -78.7 -27.9 14.8 55.3 65.9 112 161 A L >< + 0 0 23 -4,-1.9 3,-2.3 -5,-0.2 -1,-0.2 -0.715 62.0 174.1-132.8 74.1 11.8 53.8 64.0 113 162 A P T 3 S+ 0 0 88 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.802 80.8 63.5 -57.4 -28.9 9.1 56.5 63.6 114 163 A E T 3 S+ 0 0 126 -3,-0.1 -5,-0.1 2,-0.1 -2,-0.0 0.599 79.7 106.8 -64.5 -17.3 7.2 54.0 61.4 115 164 A Y S < S- 0 0 0 -3,-2.3 -3,-0.0 -7,-0.2 -73,-0.0 -0.429 79.2-107.9 -70.3 136.5 6.9 51.6 64.4 116 165 A P - 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