==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=16-SEP-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/HYDROLASE INHIBITOR 30-AUG-12 4GUY . COMPND 2 MOLECULE: MACROPHAGE METALLOELASTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR V.CALDERONE,M.FRAGAI,C.LUCHINAT,A.MASSARO,A.MORDINI,M.MORI . 158 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8316.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 84 53.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 17 10.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 2.5 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 . 12 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 13 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 33 20.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 1 0.6 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 0 0 1 0 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 1 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 0 0 PARALLEL BRIDGES PER LADDER . 0 0 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 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 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 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 1 106 A G 0 0 107 0, 0.0 2,-0.3 0, 0.0 120,-0.0 0.000 360.0 360.0 360.0-160.6 8.7 13.2 2.7 2 107 A P - 0 0 65 0, 0.0 2,-0.3 0, 0.0 81,-0.0 -0.650 360.0-179.3 -82.7 138.7 7.2 14.4 6.0 3 108 A V - 0 0 31 -2,-0.3 2,-0.4 78,-0.1 117,-0.1 -0.714 38.3 -99.5-108.2 170.0 9.1 13.9 9.3 4 109 A W - 0 0 26 115,-0.3 2,-0.1 -2,-0.3 5,-0.0 -0.789 27.3-148.9 -83.2 140.6 7.9 15.0 12.8 5 110 A R S S+ 0 0 202 -2,-0.4 2,-0.3 2,-0.0 -1,-0.1 -0.183 70.1 58.2-105.1 45.3 9.4 18.3 13.7 6 111 A K S S- 0 0 96 -2,-0.1 -2,-0.1 1,-0.1 36,-0.0 -0.968 70.3-132.7-170.3 149.9 9.5 17.8 17.5 7 112 A H S S+ 0 0 112 -2,-0.3 36,-2.6 35,-0.1 2,-0.7 0.845 86.4 69.8 -87.4 -37.6 11.1 15.4 20.0 8 113 A Y E +a 43 0A 183 34,-0.2 2,-0.4 36,-0.0 36,-0.2 -0.773 66.7 179.8 -86.8 112.9 8.3 14.5 22.4 9 114 A I E -a 44 0A 1 34,-3.1 36,-1.5 -2,-0.7 2,-0.3 -0.930 11.8-149.4-116.7 138.0 5.8 12.4 20.5 10 115 A T E -a 45 0A 34 -2,-0.4 44,-2.9 34,-0.2 2,-0.3 -0.782 11.3-175.6-106.0 151.4 2.5 10.8 21.8 11 116 A Y E -ab 46 54A 7 34,-2.7 36,-2.6 -2,-0.3 2,-0.3 -0.955 4.4-166.8-133.5 164.3 0.5 7.8 21.0 12 117 A R E - b 0 55A 72 42,-1.9 44,-2.8 -2,-0.3 2,-0.6 -0.952 21.7-133.6-149.6 122.3 -2.8 6.4 22.1 13 118 A I E - b 0 56A 13 -2,-0.3 44,-0.2 34,-0.2 3,-0.1 -0.704 21.4-166.3 -77.0 120.5 -4.3 2.9 21.7 14 119 A N - 0 0 84 42,-3.2 2,-0.3 -2,-0.6 43,-0.2 0.865 64.2 -8.1 -81.8 -40.8 -7.8 3.7 20.5 15 120 A N S S- 0 0 55 41,-0.5 2,-0.4 44,-0.0 -1,-0.3 -0.979 70.8-116.3-156.2 157.0 -9.3 0.3 21.0 16 121 A Y - 0 0 57 -2,-0.3 6,-0.1 -3,-0.1 41,-0.0 -0.774 24.4-118.3-106.7 136.6 -8.1 -3.2 21.8 17 122 A T > - 0 0 0 -2,-0.4 3,-0.9 1,-0.1 8,-0.1 -0.451 16.2-137.1 -63.8 140.0 -8.2 -6.3 19.6 18 123 A P T 3 S+ 0 0 102 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.709 95.4 76.5 -66.9 -20.5 -10.3 -9.2 21.2 19 124 A D T 3 S+ 0 0 45 77,-0.1 2,-0.3 75,-0.1 -2,-0.0 0.539 96.6 40.5 -67.8 -19.7 -7.5 -11.6 20.1 20 125 A M S < S- 0 0 17 -3,-0.9 2,-0.2 79,-0.1 79,-0.1 -0.862 88.6 -95.0-131.2 162.1 -5.1 -10.7 22.9 21 126 A N > - 0 0 103 -2,-0.3 4,-1.4 1,-0.1 3,-0.4 -0.552 40.8-119.1 -65.4 142.3 -4.9 -9.9 26.6 22 127 A R H >> S+ 0 0 141 1,-0.2 4,-2.6 -2,-0.2 3,-0.8 0.921 113.3 50.4 -46.7 -54.8 -5.0 -6.1 27.2 23 128 A E H 3> S+ 0 0 149 1,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.802 108.2 56.7 -61.4 -29.6 -1.6 -6.0 28.9 24 129 A D H 3> S+ 0 0 42 -3,-0.4 4,-1.9 2,-0.2 -1,-0.3 0.785 107.2 45.9 -69.3 -37.5 -0.2 -7.9 25.9 25 130 A V H X S+ 0 0 4 -4,-1.8 4,-2.3 1,-0.2 3,-1.0 0.914 104.6 58.9 -62.2 -44.7 8.0 2.1 19.8 34 139 A Q H 3X S+ 0 0 62 -4,-2.1 4,-1.5 1,-0.3 -1,-0.2 0.762 96.0 65.1 -57.6 -30.5 11.1 1.5 21.9 35 140 A V H 3< S+ 0 0 20 -4,-1.0 -1,-0.3 -3,-0.3 4,-0.2 0.881 109.4 37.7 -62.0 -39.5 12.7 -0.1 18.8 36 141 A W H X< S+ 0 0 0 -3,-1.0 3,-1.1 -4,-0.8 4,-0.3 0.842 112.8 54.5 -80.7 -35.1 12.5 3.3 17.1 37 142 A S H >< S+ 0 0 34 -4,-2.3 3,-0.8 1,-0.2 -2,-0.2 0.780 98.9 67.0 -68.0 -19.6 13.4 5.5 20.1 38 143 A N T 3< S+ 0 0 121 -4,-1.5 -1,-0.2 1,-0.3 -2,-0.2 0.655 111.4 31.9 -72.3 -20.1 16.6 3.3 20.5 39 144 A V T < S+ 0 0 27 -3,-1.1 -1,-0.3 -4,-0.2 -2,-0.2 0.179 118.5 54.2-122.3 12.3 18.0 4.6 17.3 40 145 A T S < S- 0 0 21 -3,-0.8 114,-0.1 -4,-0.3 118,-0.0 -0.871 81.3-113.0-137.4 171.5 16.6 8.2 17.2 41 146 A P S S+ 0 0 58 0, 0.0 -4,-0.1 0, 0.0 -3,-0.0 0.517 80.1 113.5 -76.6 -7.0 16.4 11.4 19.4 42 147 A L - 0 0 3 -6,-0.2 2,-0.4 -34,-0.1 -2,-0.2 -0.267 52.2-154.6 -76.7 156.0 12.6 10.9 19.8 43 148 A K E -a 8 0A 134 -36,-2.6 -34,-3.1 2,-0.0 2,-0.3 -0.999 11.0-152.8-129.6 128.1 10.7 10.1 23.0 44 149 A F E -a 9 0A 30 -2,-0.4 2,-0.3 -36,-0.2 -34,-0.2 -0.825 10.7-174.1-109.3 145.4 7.3 8.4 23.0 45 150 A S E -a 10 0A 65 -36,-1.5 -34,-2.7 -2,-0.3 2,-0.6 -0.995 21.3-134.9-137.2 138.6 4.5 8.6 25.6 46 151 A K E -a 11 0A 63 -2,-0.3 2,-0.3 -36,-0.2 -34,-0.2 -0.835 24.1-172.6 -92.6 124.1 1.2 6.7 25.9 47 152 A I - 0 0 44 -36,-2.6 -34,-0.2 -2,-0.6 3,-0.1 -0.877 14.4-159.8-117.7 150.9 -1.7 9.1 26.7 48 153 A N S S+ 0 0 116 -2,-0.3 2,-0.4 1,-0.1 -1,-0.1 0.391 71.3 50.3-112.9 0.1 -5.1 7.7 27.5 49 154 A T S S- 0 0 115 2,-0.1 -1,-0.1 0, 0.0 0, 0.0 -1.000 96.9 -10.9-148.5 131.5 -7.1 10.7 26.9 50 155 A G S S- 0 0 39 -2,-0.4 2,-0.3 -3,-0.1 -3,-0.1 -0.158 99.0 -2.7 83.0-164.6 -7.5 13.2 24.1 51 156 A M - 0 0 156 4,-0.0 2,-0.3 1,-0.0 -2,-0.1 -0.450 58.5-177.9 -75.5 129.2 -5.5 13.9 21.0 52 157 A A - 0 0 13 -2,-0.3 3,-0.3 1,-0.2 -41,-0.1 -0.870 33.4-127.2-115.8 152.6 -2.3 11.9 20.4 53 158 A D S S+ 0 0 29 -2,-0.3 2,-0.8 1,-0.2 -42,-0.2 0.997 103.4 35.1 -58.6 -61.1 0.1 12.2 17.5 54 159 A I E S-b 11 0A 0 -44,-2.9 -42,-1.9 35,-0.1 2,-0.5 -0.815 74.3-163.6-103.9 101.9 -0.1 8.5 16.6 55 160 A L E -b 12 0A 44 -2,-0.8 35,-2.4 -3,-0.3 2,-0.6 -0.753 10.3-150.1 -82.4 123.4 -3.5 6.9 17.1 56 161 A V E -bc 13 90A 2 -44,-2.8 -42,-3.2 -2,-0.5 -41,-0.5 -0.855 23.1-175.9 -97.3 122.3 -3.2 3.1 17.1 57 162 A V E - c 0 91A 19 33,-2.8 35,-3.1 -2,-0.6 2,-0.6 -0.983 25.7-152.8-128.6 128.4 -6.5 1.6 15.8 58 163 A F E + c 0 92A 8 -2,-0.4 2,-0.3 33,-0.2 35,-0.2 -0.919 39.0 153.3 -92.5 118.2 -7.8 -1.9 15.4 59 164 A A E - c 0 93A 16 33,-2.4 35,-2.9 -2,-0.6 36,-0.4 -0.934 30.9-147.6-140.0 165.8 -10.4 -2.0 12.5 60 165 A R - 0 0 139 -2,-0.3 33,-0.0 33,-0.2 10,-0.0 -0.899 58.8 -19.0-131.4 162.9 -11.9 -4.2 9.7 61 166 A G S S+ 0 0 27 -2,-0.3 8,-3.2 7,-0.1 2,-0.5 -0.075 123.3 3.0 43.6-131.6 -13.2 -3.6 6.2 62 167 A A S S+ 0 0 94 6,-0.3 -2,-0.2 1,-0.1 6,-0.1 -0.719 71.0 167.4 -82.1 120.1 -14.0 -0.0 5.4 63 168 A H - 0 0 40 -2,-0.5 -1,-0.1 -4,-0.1 3,-0.1 -0.042 61.4 -72.6-136.6 34.4 -13.1 2.0 8.4 64 169 A G S S+ 0 0 82 1,-0.3 2,-0.1 2,-0.0 -2,-0.1 0.458 105.7 66.9 100.1 2.3 -13.1 5.6 7.4 65 170 A D S S- 0 0 43 21,-0.0 -1,-0.3 0, 0.0 3,-0.1 -0.140 93.2 -94.6-121.5-133.4 -10.1 6.3 5.2 66 171 A D S S+ 0 0 155 -2,-0.1 2,-0.1 -3,-0.1 -4,-0.0 0.074 102.2 85.3-137.5 20.3 -9.3 5.0 1.7 67 172 A H - 0 0 98 -6,-0.0 -1,-0.1 11,-0.0 11,-0.0 -0.412 66.8-172.3-120.5 56.1 -7.2 2.0 2.7 68 173 A A - 0 0 61 -3,-0.1 -6,-0.3 1,-0.1 2,-0.1 -0.114 22.7-116.8 -48.5 141.9 -10.1 -0.4 3.2 69 174 A F - 0 0 14 -8,-3.2 -1,-0.1 1,-0.1 3,-0.1 -0.435 14.4-142.0 -85.2 162.8 -9.1 -3.8 4.8 70 175 A D - 0 0 76 1,-0.4 -1,-0.1 5,-0.4 2,-0.0 -0.274 39.8 -98.8-126.5 40.1 -9.5 -7.1 2.9 71 176 A G S S- 0 0 27 3,-0.1 -1,-0.4 25,-0.0 2,-0.2 -0.324 80.4 -14.9 69.1-155.4 -10.6 -9.8 5.3 72 177 A K S S+ 0 0 147 -3,-0.1 24,-0.2 22,-0.1 2,-0.1 -0.582 120.7 12.1 -87.6 147.2 -8.1 -12.3 6.7 73 178 A G S S+ 0 0 31 -2,-0.2 -3,-0.3 1,-0.1 2,-0.2 -0.396 100.8 63.7 78.5-169.7 -4.6 -12.5 5.0 74 179 A G S S+ 0 0 66 -2,-0.1 2,-0.9 -5,-0.1 -1,-0.1 -0.380 102.1 32.6 61.5-124.1 -3.5 -9.8 2.5 75 180 A I + 0 0 82 -2,-0.2 -5,-0.4 1,-0.2 3,-0.1 -0.596 62.9 178.8 -65.0 103.3 -3.3 -6.3 4.1 76 181 A L - 0 0 32 -2,-0.9 17,-2.3 1,-0.3 2,-0.3 0.919 63.7 -29.8 -68.8 -50.0 -2.1 -7.0 7.7 77 182 A A E -D 92 0A 14 15,-0.2 2,-0.3 33,-0.0 -1,-0.3 -0.986 55.4-152.7-157.0 165.6 -2.0 -3.2 8.6 78 183 A H E -D 91 0A 22 13,-2.5 13,-3.1 -2,-0.3 2,-0.3 -0.981 6.4-167.6-142.0 165.1 -1.4 0.2 7.3 79 184 A A E -D 90 0A 20 -2,-0.3 2,-0.3 11,-0.2 11,-0.2 -0.993 16.6-129.3-146.7 156.9 -0.1 3.6 8.5 80 185 A F - 0 0 33 9,-2.0 3,-0.1 6,-0.3 8,-0.1 -0.766 31.9-109.6 -99.4 147.4 0.0 7.2 7.4 81 186 A G - 0 0 32 -2,-0.3 7,-1.8 1,-0.2 8,-0.2 -0.147 55.8 -59.6 -69.3 168.2 3.2 9.4 7.5 82 187 A P S S+ 0 0 9 0, 0.0 2,-0.2 0, 0.0 -1,-0.2 -0.129 85.3 99.6 -51.2 143.8 3.8 12.3 9.9 83 188 A G S S- 0 0 34 4,-0.2 -3,-0.1 2,-0.1 -79,-0.0 -0.812 71.5 -67.8 154.7 172.9 1.3 15.2 9.8 84 189 A S S > S+ 0 0 116 -2,-0.2 3,-2.3 2,-0.1 2,-0.1 -0.182 97.2 11.4 -86.7 175.8 -1.7 16.3 11.8 85 190 A G T 3 S+ 0 0 41 1,-0.3 -2,-0.1 3,-0.1 4,-0.1 -0.404 142.6 2.0 60.3-132.0 -5.1 14.6 12.1 86 191 A I T > S+ 0 0 100 2,-0.1 3,-2.7 -2,-0.1 -6,-0.3 0.639 105.1 119.5 -56.2 -19.4 -4.8 11.1 10.6 87 192 A G T < S+ 0 0 9 -3,-2.3 -4,-0.2 1,-0.3 -6,-0.1 -0.213 82.4 12.9 -47.5 138.3 -1.1 11.8 9.9 88 193 A G T 3 S+ 0 0 0 -7,-1.8 -1,-0.3 1,-0.2 30,-0.1 0.339 94.0 141.6 73.9 -5.9 0.9 9.2 11.8 89 194 A D < - 0 0 15 -3,-2.7 -9,-2.0 -8,-0.2 2,-0.5 -0.390 36.9-154.9 -79.2 143.1 -2.0 7.0 12.5 90 195 A A E -cD 56 79A 1 -35,-2.4 -33,-2.8 -11,-0.2 2,-0.4 -0.988 6.3-165.2-124.5 129.7 -1.6 3.2 12.4 91 196 A H E -cD 57 78A 15 -13,-3.1 -13,-2.5 -2,-0.5 2,-0.5 -0.930 4.1-156.5-119.8 133.3 -4.5 0.9 11.7 92 197 A F E -cD 58 77A 1 -35,-3.1 -33,-2.4 -2,-0.4 2,-0.6 -0.934 24.6-117.4-119.1 126.8 -4.4 -2.9 12.3 93 198 A D E > -c 59 0A 0 -17,-2.3 3,-2.1 -2,-0.5 -33,-0.2 -0.493 18.7-161.7 -70.8 109.2 -6.7 -5.3 10.4 94 199 A E T 3 S+ 0 0 14 -35,-2.9 -34,-0.2 -2,-0.6 -1,-0.2 0.617 85.5 75.3 -68.8 -15.2 -9.0 -6.9 13.1 95 200 A D T 3 S+ 0 0 47 -36,-0.4 -1,-0.3 -24,-0.2 2,-0.2 0.534 87.0 79.4 -72.2 -8.1 -9.7 -9.6 10.5 96 201 A E S < S- 0 0 9 -3,-2.1 2,-0.7 -20,-0.2 -77,-0.1 -0.521 91.1-116.1 -86.6 167.7 -6.2 -10.9 11.3 97 202 A F - 0 0 95 -2,-0.2 8,-3.5 -80,-0.0 2,-0.2 -0.891 30.4-149.1-109.5 107.7 -5.5 -12.9 14.4 98 203 A W E +e 105 0B 1 -2,-0.7 2,-0.3 6,-0.2 8,-0.2 -0.504 23.8 169.5 -80.2 135.4 -3.1 -10.9 16.7 99 204 A T E -e 106 0B 6 6,-1.9 8,-2.0 -2,-0.2 9,-0.5 -0.926 45.7-133.2-139.4 165.8 -0.7 -12.8 18.8 100 205 A T S S+ 0 0 62 -2,-0.3 40,-0.2 6,-0.2 6,-0.1 0.682 98.9 27.0 -85.0 -22.4 2.3 -12.5 21.1 101 206 A H S S- 0 0 96 2,-0.2 -2,-0.2 38,-0.1 37,-0.1 0.119 109.1 -67.4-116.2-134.9 4.0 -15.4 19.3 102 207 A S S S+ 0 0 69 3,-0.1 4,-0.2 4,-0.1 2,-0.1 0.671 92.5 97.5-111.8 -25.5 3.8 -17.0 15.9 103 208 A G S S- 0 0 39 2,-0.1 -2,-0.2 -5,-0.0 0, 0.0 -0.489 102.0 -10.5 -54.9 136.3 0.4 -18.6 15.6 104 209 A G S S- 0 0 36 -2,-0.1 2,-0.6 2,-0.1 -6,-0.2 -0.266 122.9 -26.6 64.7-149.3 -1.6 -15.9 13.7 105 210 A T E -e 98 0B 14 -8,-3.5 -6,-1.9 -29,-0.0 2,-0.4 -0.901 62.1-127.0-108.2 117.2 -0.0 -12.4 13.1 106 211 A N E > -e 99 0B 0 -2,-0.6 4,-1.8 -8,-0.2 -6,-0.2 -0.470 15.2-158.2 -63.9 116.3 2.6 -11.2 15.6 107 212 A L H > S+ 0 0 0 -8,-2.0 4,-3.4 -2,-0.4 5,-0.2 0.888 87.3 57.8 -61.5 -45.9 1.4 -7.7 16.7 108 213 A F H > S+ 0 0 14 -9,-0.5 4,-1.7 2,-0.2 -1,-0.2 0.891 109.8 41.7 -50.7 -53.4 4.9 -6.6 17.9 109 214 A L H > S+ 0 0 13 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.889 116.4 49.7 -70.3 -41.2 6.6 -7.1 14.4 110 215 A T H X S+ 0 0 7 -4,-1.8 4,-2.6 1,-0.2 5,-0.2 0.957 110.3 49.9 -58.8 -49.5 3.7 -5.6 12.6 111 216 A A H X S+ 0 0 0 -4,-3.4 4,-2.7 1,-0.2 5,-0.2 0.851 107.4 54.7 -60.6 -30.8 3.6 -2.5 14.9 112 217 A V H X S+ 0 0 0 -4,-1.7 4,-2.0 -5,-0.2 -1,-0.2 0.952 111.4 45.7 -65.5 -45.3 7.4 -2.0 14.4 113 218 A H H X S+ 0 0 26 -4,-1.9 4,-1.4 1,-0.2 -2,-0.2 0.947 114.6 46.7 -57.9 -50.7 6.8 -2.0 10.6 114 219 A E H X S+ 0 0 7 -4,-2.6 4,-3.2 1,-0.2 -1,-0.2 0.835 109.3 52.8 -65.2 -40.2 3.8 0.4 10.9 115 220 A I H X S+ 0 0 3 -4,-2.7 4,-1.4 2,-0.2 -1,-0.2 0.894 102.0 61.7 -65.5 -34.4 5.5 2.8 13.2 116 221 A G H ><>S+ 0 0 0 -4,-2.0 5,-2.2 -5,-0.2 3,-0.7 0.955 109.5 40.7 -49.9 -51.1 8.3 2.9 10.7 117 222 A H H ><5S+ 0 0 33 -4,-1.4 3,-2.6 1,-0.2 -2,-0.2 0.956 109.6 59.9 -61.9 -48.8 5.7 4.3 8.3 118 223 A S H 3<5S+ 0 0 0 -4,-3.2 -1,-0.2 1,-0.3 -2,-0.2 0.660 107.9 46.8 -50.6 -22.8 4.2 6.5 11.1 119 224 A L T <<5S- 0 0 0 -4,-1.4 -115,-0.3 -3,-0.7 -1,-0.3 0.460 130.8 -87.9-103.4 -7.6 7.5 8.2 11.4 120 225 A G T < 5S+ 0 0 25 -3,-2.6 2,-0.3 -4,-0.4 -3,-0.2 0.466 78.1 134.2 117.7 1.9 8.2 8.7 7.6 121 226 A L < - 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