==== 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 11-JUL-01 1JK3 . COMPND 2 MOLECULE: MACROPHAGE METALLOELASTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR R.LANG,A.KOCOUREK,M.BRAUN,H.TSCHESCHE,R.HUBER,W.BODE,K.MASKO . 158 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8359.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 81 51.3 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 . 1 0.6 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 . 8 5.1 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 1 0 0 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 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 0 103 0, 0.0 120,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-147.6 4.9 13.3 22.0 2 107 A P + 0 0 92 0, 0.0 2,-0.3 0, 0.0 81,-0.1 -0.137 360.0 174.3 -58.5 140.0 6.8 14.3 18.9 3 108 A V - 0 0 47 78,-0.1 2,-0.3 79,-0.0 117,-0.1 -0.933 40.8 -92.9-137.6 157.3 5.3 13.8 15.4 4 109 A W - 0 0 24 115,-0.4 5,-0.0 -2,-0.3 115,-0.0 -0.604 30.4-155.7 -69.0 135.3 6.3 14.7 11.9 5 110 A R S S+ 0 0 235 -2,-0.3 2,-0.3 2,-0.0 -1,-0.1 -0.119 70.4 59.9-105.8 33.7 4.7 18.1 11.0 6 111 A K S S- 0 0 97 1,-0.1 -2,-0.1 0, 0.0 3,-0.0 -0.959 72.9-135.0-154.1 160.3 4.7 17.6 7.3 7 112 A H S S+ 0 0 117 -2,-0.3 36,-2.6 1,-0.1 2,-0.7 0.729 84.2 72.5 -98.3 -24.6 3.2 15.0 5.0 8 113 A Y E -a 43 0A 183 34,-0.2 2,-0.4 36,-0.1 36,-0.2 -0.868 64.1-179.6 -97.4 116.6 6.0 14.2 2.6 9 114 A I E -a 44 0A 2 34,-3.0 36,-2.0 -2,-0.7 2,-0.3 -0.903 12.0-150.9-117.5 140.6 8.7 12.1 4.4 10 115 A T E -a 45 0A 38 -2,-0.4 44,-2.3 34,-0.2 43,-0.5 -0.833 9.6-172.0-110.9 151.8 11.9 10.8 2.9 11 116 A Y E -ab 46 54A 8 34,-2.3 36,-2.6 -2,-0.3 2,-0.3 -0.952 3.5-165.0-134.4 158.2 13.9 7.7 3.8 12 117 A R E - b 0 55A 75 42,-2.0 44,-3.1 -2,-0.3 2,-0.8 -0.996 21.0-134.8-141.8 140.6 17.3 6.4 2.7 13 118 A I E - b 0 56A 11 34,-0.4 44,-0.2 -2,-0.3 3,-0.1 -0.883 20.9-167.3 -98.6 106.8 18.9 3.0 3.1 14 119 A N - 0 0 84 42,-3.0 2,-0.3 -2,-0.8 43,-0.2 0.832 65.0 -10.3 -65.6 -41.1 22.3 3.8 4.3 15 120 A N S S- 0 0 51 41,-0.6 2,-0.5 -3,-0.1 -1,-0.2 -0.967 70.9-114.9-156.4 166.2 23.9 0.4 3.8 16 121 A Y - 0 0 45 -2,-0.3 6,-0.1 -3,-0.1 41,-0.0 -0.914 20.5-121.9-120.8 132.9 22.7 -3.0 3.0 17 122 A T > - 0 0 4 -2,-0.5 3,-1.1 1,-0.1 8,-0.1 -0.387 14.4-141.5 -63.6 136.7 22.8 -6.2 4.9 18 123 A P T 3 S+ 0 0 113 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.511 93.1 81.1 -75.5 -2.2 24.8 -9.0 3.2 19 124 A D T 3 S+ 0 0 41 77,-0.1 2,-0.3 2,-0.1 -2,-0.0 0.651 97.1 35.9 -72.9 -21.4 22.1 -11.4 4.5 20 125 A M S < S- 0 0 22 -3,-1.1 2,-0.2 79,-0.1 79,-0.1 -0.889 91.5 -91.0-131.6 160.5 19.7 -10.5 1.7 21 126 A N >> - 0 0 100 -2,-0.3 4,-1.6 1,-0.1 3,-0.8 -0.521 42.1-121.3 -66.4 140.5 19.5 -9.6 -2.0 22 127 A R H 3> S+ 0 0 162 1,-0.3 4,-2.3 2,-0.2 3,-0.3 0.895 112.2 52.2 -51.4 -46.8 19.7 -5.8 -2.4 23 128 A E H 3> S+ 0 0 139 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.810 106.5 54.4 -64.8 -30.0 16.4 -5.7 -4.2 24 129 A D H <> S+ 0 0 44 -3,-0.8 4,-2.4 2,-0.2 -1,-0.2 0.837 106.7 50.4 -73.6 -33.9 14.7 -7.6 -1.4 25 130 A V H X S+ 0 0 0 -4,-1.6 4,-2.3 -3,-0.3 5,-0.3 0.951 111.8 48.8 -62.9 -49.6 16.0 -5.1 1.3 26 131 A D H X S+ 0 0 42 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.922 114.1 45.8 -55.9 -46.8 14.6 -2.3 -0.8 27 132 A Y H X S+ 0 0 141 -4,-2.1 4,-2.9 2,-0.2 5,-0.2 0.915 110.5 51.9 -66.2 -43.2 11.2 -4.1 -1.2 28 133 A A H X S+ 0 0 9 -4,-2.4 4,-1.9 1,-0.2 -1,-0.2 0.919 114.1 43.8 -60.3 -45.5 10.9 -5.0 2.4 29 134 A I H X S+ 0 0 1 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.923 113.8 50.4 -67.3 -46.2 11.5 -1.5 3.6 30 135 A R H X S+ 0 0 141 -4,-2.5 4,-2.1 -5,-0.3 -2,-0.2 0.924 111.8 47.8 -55.4 -47.2 9.2 0.0 0.9 31 136 A K H X S+ 0 0 67 -4,-2.9 4,-1.5 1,-0.2 -1,-0.2 0.856 108.5 54.9 -65.5 -35.7 6.4 -2.3 1.8 32 137 A A H X S+ 0 0 0 -4,-1.9 4,-1.0 -5,-0.2 -1,-0.2 0.914 108.4 48.2 -64.4 -41.5 6.9 -1.5 5.5 33 138 A F H >X S+ 0 0 2 -4,-2.2 4,-2.4 1,-0.2 3,-0.6 0.904 106.7 58.1 -63.4 -40.2 6.5 2.2 4.8 34 139 A Q H 3X S+ 0 0 55 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.854 95.7 63.5 -58.7 -36.2 3.4 1.4 2.8 35 140 A V H 3< S+ 0 0 17 -4,-1.5 4,-0.3 1,-0.2 -1,-0.2 0.919 111.7 37.0 -53.2 -43.3 1.8 -0.3 5.8 36 141 A W H X< S+ 0 0 0 -4,-1.0 3,-1.2 -3,-0.6 4,-0.3 0.848 112.1 55.5 -84.1 -34.6 1.8 3.1 7.5 37 142 A S H >< S+ 0 0 32 -4,-2.4 3,-0.7 1,-0.2 -1,-0.2 0.811 99.7 65.5 -65.5 -24.5 1.0 5.3 4.5 38 143 A N T 3< S+ 0 0 132 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.719 111.2 33.4 -64.6 -25.3 -2.1 3.1 4.1 39 144 A V T < S+ 0 0 28 -3,-1.2 -1,-0.2 -4,-0.3 -2,-0.2 0.200 119.7 44.8-121.3 16.2 -3.5 4.4 7.4 40 145 A T S < S- 0 0 19 -3,-0.7 114,-0.1 -4,-0.3 118,-0.0 -0.885 85.1-106.6-144.3 172.2 -2.2 8.0 7.5 41 146 A P S S+ 0 0 65 0, 0.0 -4,-0.1 0, 0.0 -3,-0.1 0.410 79.4 121.6 -79.2 4.0 -1.9 11.0 5.2 42 147 A L - 0 0 3 -6,-0.3 2,-0.4 -34,-0.1 -2,-0.2 -0.324 47.2-159.4 -75.5 148.8 1.8 10.5 5.0 43 148 A K E -a 8 0A 120 -36,-2.6 -34,-3.0 -2,-0.1 2,-0.4 -0.993 8.9-156.2-121.8 135.7 3.7 9.9 1.7 44 149 A F E -a 9 0A 27 -2,-0.4 2,-0.4 -36,-0.2 -34,-0.2 -0.936 9.9-176.0-117.6 136.3 7.2 8.2 1.8 45 150 A S E -a 10 0A 58 -36,-2.0 -34,-2.3 -2,-0.4 2,-0.4 -0.994 21.3-131.7-132.2 134.8 9.9 8.5 -0.8 46 151 A K E -a 11 0A 71 -2,-0.4 2,-0.3 -36,-0.2 -34,-0.2 -0.662 24.5-171.6 -82.4 135.0 13.2 6.8 -1.0 47 152 A I - 0 0 48 -36,-2.6 -34,-0.4 -2,-0.4 5,-0.1 -0.911 17.5-159.9-124.0 157.3 16.2 9.0 -1.8 48 153 A N S S+ 0 0 106 -2,-0.3 2,-0.3 -36,-0.1 -36,-0.1 0.418 72.9 37.2-118.0 -3.5 19.8 7.9 -2.5 49 154 A T S S+ 0 0 112 2,-0.1 -1,-0.1 0, 0.0 2,-0.0 -0.973 97.5 18.0-145.2 158.0 21.8 11.0 -1.7 50 155 A G S S- 0 0 51 -2,-0.3 2,-0.5 -3,-0.1 -3,-0.1 -0.239 100.1 -31.7 76.2-170.7 21.7 13.7 0.9 51 156 A M - 0 0 129 4,-0.0 2,-0.2 -2,-0.0 -2,-0.1 -0.757 55.9-166.5 -92.3 125.2 19.9 13.8 4.2 52 157 A A - 0 0 9 -2,-0.5 3,-0.2 1,-0.1 -41,-0.2 -0.639 29.4-122.6-100.6 162.6 16.6 11.9 4.6 53 158 A D S S+ 0 0 13 -43,-0.5 2,-0.6 1,-0.3 -42,-0.2 0.932 105.1 35.3 -64.4 -49.9 14.2 12.2 7.4 54 159 A I E S-b 11 0A 0 -44,-2.3 -42,-2.0 35,-0.1 2,-0.5 -0.922 74.6-164.4-114.4 108.6 14.4 8.5 8.2 55 160 A L E -b 12 0A 41 -2,-0.6 35,-2.4 -44,-0.2 2,-0.6 -0.837 8.4-152.0 -93.1 123.9 17.8 6.8 7.8 56 161 A V E +bc 13 90A 1 -44,-3.1 -42,-3.0 -2,-0.5 -41,-0.6 -0.889 22.6 179.2 -96.4 122.3 17.7 3.0 7.7 57 162 A V E - c 0 91A 19 33,-2.4 35,-2.9 -2,-0.6 2,-0.5 -0.980 26.5-152.4-131.2 134.9 21.0 1.6 8.9 58 163 A F E + c 0 92A 7 -2,-0.4 2,-0.3 33,-0.2 35,-0.2 -0.939 38.7 148.7-100.9 128.2 22.3 -2.0 9.5 59 164 A A E - c 0 93A 18 33,-2.4 35,-2.7 -2,-0.5 36,-0.4 -0.970 33.2-138.6-153.2 162.8 25.0 -1.9 12.2 60 165 A R - 0 0 136 -2,-0.3 33,-0.0 33,-0.2 8,-0.0 -0.921 58.3 -21.5-129.6 155.9 26.4 -4.1 15.0 61 166 A G S S+ 0 0 25 -2,-0.3 8,-1.8 7,-0.1 2,-0.4 -0.067 121.9 8.5 51.7-140.5 27.5 -3.6 18.5 62 167 A A S S+ 0 0 92 6,-0.2 -2,-0.2 1,-0.1 4,-0.1 -0.591 70.5 163.0 -73.9 121.8 28.3 -0.1 19.5 63 168 A H - 0 0 41 -2,-0.4 -1,-0.1 2,-0.2 3,-0.1 -0.043 66.0 -69.8-138.9 31.5 27.3 2.1 16.6 64 169 A G S S+ 0 0 82 1,-0.3 2,-0.2 2,-0.0 -2,-0.1 0.599 102.9 72.0 96.2 15.3 27.1 5.6 17.8 65 170 A D S S- 0 0 39 0, 0.0 -1,-0.3 0, 0.0 3,-0.3 -0.806 89.1 -94.6-144.1-174.9 24.1 5.8 20.2 66 171 A F S S+ 0 0 205 -2,-0.2 2,-0.1 1,-0.2 -4,-0.0 0.390 108.0 75.9 -82.3 4.2 23.0 4.7 23.7 67 172 A H - 0 0 94 -6,-0.0 -1,-0.2 11,-0.0 -6,-0.0 -0.336 68.2-178.1-118.0 50.6 21.3 1.7 22.2 68 173 A A - 0 0 49 -3,-0.3 -6,-0.2 -2,-0.1 -7,-0.1 -0.127 27.4-116.9 -50.9 141.5 24.2 -0.6 21.5 69 174 A F - 0 0 14 -8,-1.8 3,-0.1 1,-0.1 -1,-0.1 -0.313 14.2-143.2 -81.2 165.4 23.3 -3.9 19.9 70 175 A D - 0 0 78 1,-0.5 -1,-0.1 5,-0.4 2,-0.1 -0.019 39.2-101.2-129.2 23.4 23.9 -7.1 21.7 71 176 A G S S- 0 0 21 4,-0.1 -1,-0.5 3,-0.0 24,-0.1 -0.295 80.4 -7.8 80.7-169.2 25.0 -9.7 19.1 72 177 A K S S+ 0 0 152 23,-0.1 24,-0.1 -3,-0.1 3,-0.1 -0.331 119.3 6.6 -63.1 138.6 22.6 -12.3 17.7 73 178 A G S S+ 0 0 30 1,-0.2 -3,-0.3 2,-0.1 2,-0.1 -0.267 97.1 65.4 85.3-171.2 19.3 -12.5 19.5 74 179 A G S S+ 0 0 70 -2,-0.1 2,-0.3 -5,-0.1 -1,-0.2 -0.377 104.5 28.0 56.8-123.8 17.9 -10.2 22.1 75 180 A I + 0 0 74 1,-0.1 -5,-0.4 -2,-0.1 3,-0.1 -0.479 61.3 179.5 -73.5 126.9 17.4 -6.8 20.6 76 181 A L - 0 0 34 1,-0.4 17,-2.6 -2,-0.3 2,-0.3 0.750 62.2 -20.1 -96.2 -31.6 16.8 -6.9 16.9 77 182 A A E -D 92 0A 25 15,-0.3 -1,-0.4 -19,-0.0 2,-0.3 -0.960 52.9-160.1-170.7 160.6 16.4 -3.2 15.9 78 183 A H E -D 91 0A 25 13,-2.3 13,-2.9 -2,-0.3 2,-0.3 -0.968 7.5-164.2-150.0 159.7 15.6 0.1 17.5 79 184 A A E -D 90 0A 21 -2,-0.3 2,-0.3 11,-0.2 11,-0.2 -0.995 16.2-124.6-150.0 154.0 14.4 3.5 16.1 80 185 A F - 0 0 48 9,-2.4 8,-0.4 6,-0.3 3,-0.1 -0.735 29.5-113.6 -99.9 143.3 14.1 7.1 17.2 81 186 A G - 0 0 38 -2,-0.3 7,-1.4 1,-0.2 8,-0.2 -0.150 56.6 -58.2 -67.1 169.1 11.0 9.1 17.3 82 187 A P S S+ 0 0 13 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 -0.106 84.8 98.9 -54.6 141.7 10.4 12.1 15.0 83 188 A G S S- 0 0 34 4,-0.2 -3,-0.0 -3,-0.1 2,-0.0 -0.904 70.4 -58.4 161.3 176.7 12.9 14.9 15.2 84 189 A S S > S- 0 0 114 -2,-0.3 3,-2.2 2,-0.1 2,-0.2 -0.274 99.1 -1.1 -76.9 164.2 16.0 16.4 13.5 85 190 A G T 3 S+ 0 0 47 1,-0.3 -2,-0.1 3,-0.1 4,-0.1 -0.341 141.9 9.1 62.5-119.1 19.2 14.5 12.9 86 191 A I T > S+ 0 0 95 -2,-0.2 3,-2.4 2,-0.1 -6,-0.3 0.703 103.4 116.4 -70.1 -16.8 19.0 11.0 14.4 87 192 A G T < S+ 0 0 13 -3,-2.2 -32,-0.2 1,-0.3 -4,-0.2 -0.243 81.0 15.0 -49.7 137.7 15.3 11.6 15.0 88 193 A G T 3 S+ 0 0 0 -7,-1.4 -1,-0.3 -8,-0.4 30,-0.1 0.169 92.5 139.2 83.2 -18.9 13.3 9.1 12.9 89 194 A D < - 0 0 10 -3,-2.4 -9,-2.4 -8,-0.2 2,-0.5 -0.299 39.5-152.1 -72.5 150.5 16.2 6.9 12.2 90 195 A A E -cD 56 79A 0 -35,-2.4 -33,-2.4 -11,-0.2 2,-0.4 -0.981 8.6-165.3-125.5 121.2 15.8 3.1 12.2 91 196 A H E -cD 57 78A 15 -13,-2.9 -13,-2.3 -2,-0.5 2,-0.4 -0.924 2.4-161.7-114.5 135.1 18.7 0.8 13.1 92 197 A F E -cD 58 77A 1 -35,-2.9 -33,-2.4 -2,-0.4 2,-0.6 -0.948 26.0-117.6-120.0 131.4 18.8 -3.0 12.4 93 198 A D E > -c 59 0A 0 -17,-2.6 3,-2.0 -2,-0.4 -33,-0.2 -0.543 16.2-156.9 -75.6 115.4 21.3 -5.3 14.2 94 199 A E T 3 S+ 0 0 16 -35,-2.7 -34,-0.2 -2,-0.6 -1,-0.2 0.687 87.0 75.7 -67.0 -16.4 23.5 -6.9 11.6 95 200 A D T 3 S+ 0 0 48 -36,-0.4 -1,-0.3 -24,-0.1 2,-0.2 0.618 84.9 80.6 -72.8 -7.6 24.2 -9.7 14.0 96 201 A E S < S- 0 0 8 -3,-2.0 2,-0.7 -20,-0.2 -77,-0.1 -0.503 89.6-119.5 -82.3 165.4 20.7 -11.0 13.2 97 202 A F - 0 0 95 -2,-0.2 8,-2.7 -78,-0.0 2,-0.2 -0.912 33.0-152.9-108.5 102.6 20.1 -13.0 10.0 98 203 A W E +e 105 0B 0 -2,-0.7 2,-0.3 6,-0.2 8,-0.2 -0.542 21.5 167.2 -80.6 140.0 17.6 -10.9 8.0 99 204 A T E -e 106 0B 5 6,-2.1 8,-2.2 -2,-0.2 9,-0.4 -0.921 47.2-124.9-145.1 170.6 15.3 -12.6 5.5 100 205 A T S S+ 0 0 72 -2,-0.3 2,-0.1 6,-0.2 6,-0.1 0.348 94.8 35.8 -89.5 1.3 12.2 -12.3 3.3 101 206 A H S S- 0 0 99 2,-0.3 -2,-0.2 4,-0.1 6,-0.0 -0.355 108.0 -64.3-137.5-155.1 10.6 -15.3 4.9 102 207 A S S S+ 0 0 77 -2,-0.1 4,-0.1 3,-0.1 35,-0.1 0.653 99.6 92.2 -81.8 -19.5 10.1 -17.2 8.2 103 208 A G S S- 0 0 27 2,-0.1 -2,-0.3 -5,-0.0 -4,-0.2 -0.342 95.7 -10.8 -70.0 156.9 13.7 -18.1 8.6 104 209 A G S S- 0 0 45 -6,-0.1 2,-0.5 1,-0.1 -6,-0.2 -0.255 121.0 -33.6 56.9-140.0 16.0 -15.9 10.6 105 210 A T E -e 98 0B 15 -8,-2.7 -6,-2.1 -29,-0.0 2,-0.4 -0.986 65.1-123.0-117.0 125.8 14.4 -12.5 11.4 106 211 A N E > -e 99 0B 2 -2,-0.5 4,-1.9 -8,-0.2 -6,-0.2 -0.569 15.6-156.0 -74.0 122.6 11.9 -11.1 8.8 107 212 A L H > S+ 0 0 0 -8,-2.2 4,-2.9 -2,-0.4 5,-0.2 0.911 89.0 53.3 -65.3 -46.1 13.1 -7.7 7.8 108 213 A F H > S+ 0 0 23 -9,-0.4 4,-2.2 1,-0.2 -1,-0.2 0.930 110.8 45.8 -54.9 -51.6 9.7 -6.4 6.7 109 214 A L H > S+ 0 0 15 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.898 114.8 47.5 -63.6 -40.1 8.0 -7.3 9.9 110 215 A T H X S+ 0 0 11 -4,-1.9 4,-2.7 1,-0.2 -1,-0.2 0.905 111.1 51.8 -65.7 -40.5 10.8 -5.8 12.0 111 216 A A H X S+ 0 0 0 -4,-2.9 4,-3.1 2,-0.2 5,-0.3 0.839 102.9 58.1 -67.0 -34.0 10.7 -2.6 9.8 112 217 A V H X S+ 0 0 0 -4,-2.2 4,-1.7 -5,-0.2 -1,-0.2 0.952 111.6 42.7 -59.0 -47.2 7.0 -2.2 10.3 113 218 A H H X S+ 0 0 41 -4,-1.5 4,-1.5 2,-0.2 -2,-0.2 0.947 115.2 48.7 -61.6 -51.2 7.6 -2.0 14.1 114 219 A A H X S+ 0 0 2 -4,-2.7 4,-2.1 1,-0.2 3,-0.3 0.922 110.1 50.7 -56.8 -47.1 10.7 0.2 13.8 115 220 A I H X S+ 0 0 2 -4,-3.1 4,-1.6 1,-0.2 -1,-0.2 0.850 101.0 63.7 -64.4 -32.8 9.0 2.6 11.5 116 221 A G H X>S+ 0 0 0 -4,-1.7 5,-2.6 -5,-0.3 4,-0.5 0.944 107.3 43.1 -52.1 -47.1 6.1 2.8 13.9 117 222 A H H ><5S+ 0 0 30 -4,-1.5 3,-1.4 -3,-0.3 -2,-0.2 0.906 107.9 58.8 -62.2 -43.7 8.6 4.3 16.4 118 223 A S H 3<5S+ 0 0 0 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.749 108.1 47.9 -56.9 -25.1 10.1 6.5 13.6 119 224 A L H 3<5S- 0 0 0 -4,-1.6 -115,-0.4 -3,-0.5 -1,-0.3 0.505 132.2 -90.1 -93.5 -9.1 6.6 8.0 13.2 120 225 A G T <<5S+ 0 0 25 -3,-1.4 -3,-0.2 -4,-0.5 2,-0.2 0.447 77.1 138.2 117.1 4.5 6.1 8.5 17.0 121 226 A L < - 0 0 19 -5,-2.6 -1,-0.3 -6,-0.2 2,-0.1 -0.496 33.4-156.8 -79.8 149.0 4.5 5.4 18.4 122 227 A G - 0 0 50 1,-0.2 2,-0.1 -2,-0.2 -1,-0.1 -0.340 38.9 -62.8-100.6-169.7 5.6 3.8 21.6 123 228 A H - 0 0 111 -2,-0.1 2,-0.4 10,-0.0 9,-0.2 -0.415 40.9-140.5 -78.4 152.6 5.1 0.2 22.7 124 229 A S - 0 0 14 7,-1.4 -1,-0.0 2,-0.1 25,-0.0 -0.866 7.7-148.0-106.6 144.1 1.9 -1.6 23.2 125 230 A S S S+ 0 0 116 -2,-0.4 -1,-0.1 7,-0.1 7,-0.1 0.481 73.8 100.5 -83.5 -5.3 1.2 -4.1 26.0 126 231 A D > - 0 0 59 1,-0.1 3,-2.2 2,-0.0 6,-0.2 -0.740 66.8-150.0 -86.1 115.5 -1.1 -6.1 23.8 127 232 A P T 3 S+ 0 0 72 0, 0.0 -1,-0.1 0, 0.0 5,-0.1 0.699 96.3 60.8 -56.9 -17.6 0.6 -9.2 22.4 128 233 A K T 3 S+ 0 0 136 3,-0.0 2,-0.2 17,-0.0 -2,-0.0 0.620 87.5 94.1 -84.4 -11.7 -1.6 -8.9 19.2 129 234 A A S X S- 0 0 5 -3,-2.2 3,-1.5 1,-0.1 -5,-0.1 -0.525 76.2-134.2 -84.1 147.2 -0.3 -5.4 18.3 130 235 A V T 3 S+ 0 0 26 1,-0.3 -1,-0.1 -2,-0.2 6,-0.1 0.804 108.1 60.2 -65.9 -28.8 2.6 -4.8 15.9 131 236 A M T 3 S+ 0 0 2 -5,-0.1 -7,-1.4 -8,-0.1 -1,-0.3 0.379 74.4 118.5 -81.7 6.3 4.0 -2.4 18.5 132 237 A F S < S- 0 0 54 -3,-1.5 -7,-0.1 -9,-0.2 -19,-0.0 -0.508 74.9-122.7 -65.4 139.1 4.3 -5.1 21.1 133 238 A P S S+ 0 0 73 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 0.300 85.8 79.9 -80.6 14.6 8.0 -5.4 22.0 134 239 A T S S- 0 0 98 -7,-0.1 2,-0.2 2,-0.0 -2,-0.1 -0.968 82.5-119.1-117.4 131.3 8.6 -9.0 21.1 135 240 A Y - 0 0 73 -2,-0.4 2,-0.4 2,-0.0 -25,-0.0 -0.487 30.3-176.3 -67.7 135.0 9.0 -10.2 17.5 136 241 A K - 0 0 115 -2,-0.2 2,-0.4 -6,-0.1 -2,-0.0 -0.992 21.5-133.6-131.3 122.5 6.4 -12.6 16.2 137 242 A Y + 0 0 85 -2,-0.4 2,-0.3 -35,-0.1 -35,-0.1 -0.628 32.1 166.9 -74.9 131.3 6.7 -14.1 12.7 138 243 A V - 0 0 28 -2,-0.4 -29,-0.1 5,-0.0 -2,-0.0 -0.981 34.9-113.6-138.1 147.3 3.4 -14.0 10.8 139 244 A D >> - 0 0 65 -2,-0.3 4,-2.2 1,-0.1 3,-1.2 -0.239 30.5-104.9 -80.4 168.0 3.1 -14.6 7.1 140 245 A I T 34 S+ 0 0 112 1,-0.2 -1,-0.1 2,-0.2 0, 0.0 0.011 120.4 64.3 -87.2 46.1 2.1 -11.9 4.5 141 246 A N T 34 S+ 0 0 144 -2,-0.8 -1,-0.2 3,-0.0 -2,-0.0 0.497 113.7 26.7-127.5 -36.2 -1.1 -13.7 4.5 142 247 A T T <4 S+ 0 0 83 -3,-1.2 -2,-0.2 2,-0.0 2,-0.1 0.571 92.1 116.6-108.9 -15.9 -2.0 -13.0 8.1 143 248 A F < + 0 0 30 -4,-2.2 2,-0.3 -5,-0.0 -6,-0.0 -0.336 32.3 137.3 -65.5 132.0 -0.1 -9.8 8.7 144 249 A R - 0 0 220 -2,-0.1 2,-0.1 0, 0.0 -14,-0.1 -0.971 56.5 -94.6-163.0 153.6 -2.1 -6.7 9.5 145 250 A L - 0 0 29 -2,-0.3 2,-0.1 -110,-0.1 -16,-0.1 -0.498 46.0-127.1 -64.0 144.0 -2.0 -3.8 11.9 146 251 A S > - 0 0 21 -2,-0.1 4,-2.4 1,-0.1 5,-0.2 -0.425 24.2-102.3 -87.3 169.5 -4.1 -4.4 15.0 147 252 A A H > S+ 0 0 67 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.891 124.5 55.7 -57.1 -42.1 -6.8 -2.1 16.4 148 253 A D H > S+ 0 0 44 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.926 109.4 45.6 -56.2 -46.6 -4.4 -0.9 19.0 149 254 A D H > S+ 0 0 2 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.909 112.8 49.9 -65.0 -41.6 -1.9 0.1 16.3 150 255 A I H X S+ 0 0 48 -4,-2.4 4,-2.6 2,-0.2 5,-0.2 0.918 112.3 46.6 -63.3 -45.8 -4.5 1.8 14.2 151 256 A R H X S+ 0 0 155 -4,-2.7 4,-1.5 1,-0.2 -1,-0.2 0.902 112.4 53.1 -62.2 -41.2 -5.8 3.8 17.1 152 257 A G H < S+ 0 0 19 -4,-2.3 4,-0.5 -5,-0.2 3,-0.2 0.946 113.3 40.3 -59.0 -52.5 -2.2 4.6 18.1 153 258 A I H >X S+ 0 0 0 -4,-2.6 4,-2.1 1,-0.2 3,-1.1 0.885 113.6 51.7 -71.4 -37.3 -1.3 6.0 14.6 154 259 A Q H 3< S+ 0 0 96 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.750 101.6 62.9 -74.4 -16.1 -4.5 7.8 13.9 155 260 A S T 3< S+ 0 0 96 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.691 114.4 35.3 -74.5 -16.0 -4.1 9.5 17.4 156 261 A L T <4 S+ 0 0 47 -3,-1.1 2,-0.3 -4,-0.5 -2,-0.2 0.753 128.4 20.9-101.1 -34.1 -0.9 11.0 15.9 157 262 A Y < 0 0 18 -4,-2.1 -1,-0.3 -118,-0.1 0, 0.0 -0.964 360.0 360.0-137.6 154.1 -1.9 11.6 12.2 158 263 A G 0 0 113 -2,-0.3 -118,-0.1 -3,-0.1 -119,-0.0 -0.036 360.0 360.0 68.0 360.0 -5.0 11.9 10.1