==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 02-NOV-06 2NRY . COMPND 2 MOLECULE: INTERLEUKIN-1 RECEPTOR-ASSOCIATED KINASE 4; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR Z.WANG,J.LIU,N.P.C.WALKER . 1138 12 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 53078.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 773 67.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 30 2.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 155 13.6 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 . 7 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 63 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 118 10.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 350 30.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 21 1.8 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 4 2 2 4 1 2 1 3 1 1 5 1 3 2 0 0 4 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 8 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 0 0 0 PARALLEL BRIDGES PER LADDER . 13 4 6 6 5 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 ANTIPARALLEL BRIDGES PER LADDER . 3 0 4 0 0 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 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 1 164 A R 0 0 209 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-115.3 65.0 15.9 86.9 2 165 A F - 0 0 29 83,-0.0 2,-0.5 84,-0.0 83,-0.3 -0.800 360.0-106.3-105.0 157.5 68.1 17.7 85.6 3 166 A H E -a 85 0A 102 81,-2.8 83,-2.0 -2,-0.3 2,-0.8 -0.684 27.1-139.7 -81.2 126.6 71.6 16.4 85.9 4 167 A S E -a 86 0A 86 -2,-0.5 2,-0.2 81,-0.2 83,-0.2 -0.787 26.6-176.5 -87.3 109.1 73.7 18.2 88.5 5 168 A F E -a 87 0A 14 81,-2.8 83,-0.5 -2,-0.8 2,-0.3 -0.677 20.0-134.6 -96.8 159.2 77.2 18.7 87.1 6 169 A S >> - 0 0 39 -2,-0.2 4,-1.3 81,-0.2 3,-1.2 -0.880 27.3-113.2-106.8 151.1 80.1 20.3 88.9 7 170 A F H 3> S+ 0 0 36 -2,-0.3 4,-2.7 1,-0.3 5,-0.2 0.831 114.1 61.5 -48.6 -43.9 82.3 22.8 87.1 8 171 A Y H 3> S+ 0 0 154 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.857 102.3 53.3 -57.4 -34.6 85.4 20.5 87.1 9 172 A E H <> S+ 0 0 56 -3,-1.2 4,-1.6 2,-0.2 -1,-0.2 0.952 110.7 45.4 -62.4 -48.4 83.4 18.0 85.0 10 173 A L H X S+ 0 0 0 -4,-1.3 4,-0.8 1,-0.2 7,-0.4 0.902 109.9 54.2 -68.0 -39.4 82.4 20.6 82.4 11 174 A K H ><>S+ 0 0 80 -4,-2.7 5,-3.2 1,-0.2 3,-0.8 0.924 109.9 47.7 -55.4 -47.6 85.9 21.9 82.2 12 175 A N H ><5S+ 0 0 109 -4,-1.9 3,-0.6 1,-0.2 -1,-0.2 0.831 112.9 47.7 -63.1 -38.0 87.3 18.4 81.5 13 176 A V H 3<5S+ 0 0 35 -4,-1.6 28,-1.3 1,-0.2 -1,-0.2 0.488 111.4 49.1 -87.9 -2.5 84.8 17.6 78.8 14 177 A T T > -b 28 0A 61 0, 0.0 5,-2.2 0, 0.0 3,-1.1 -0.248 33.1-112.0 -57.8 150.5 85.9 28.0 67.0 22 185 A I G > 5S+ 0 0 67 6,-1.5 3,-1.0 1,-0.2 7,-0.1 0.804 116.9 62.4 -51.6 -31.8 85.5 24.3 66.3 23 186 A S G 3 5S+ 0 0 108 1,-0.3 -1,-0.2 2,-0.1 -3,-0.0 0.802 105.7 46.4 -61.7 -34.7 86.8 25.0 62.7 24 187 A V G < 5S- 0 0 92 -3,-1.1 -1,-0.3 0, 0.0 -2,-0.2 0.402 132.1 -90.6 -90.8 -7.3 90.1 26.1 64.2 25 188 A G T < 5S+ 0 0 47 -3,-1.0 -3,-0.2 -4,-0.4 -2,-0.1 0.581 91.6 107.2 107.9 10.1 90.4 23.1 66.6 26 189 A G S + C 0 35A 32 3,-2.8 3,-1.2 -2,-0.3 132,-0.1 -0.876 47.0 67.3 157.7 172.9 74.2 34.1 73.2 33 196 A G T 3 S- 0 0 6 -2,-0.2 3,-0.1 1,-0.2 132,-0.1 0.766 129.2 -59.2 55.2 31.5 71.8 33.6 76.1 34 197 A F T 3 S+ 0 0 62 1,-0.2 19,-3.4 18,-0.1 2,-0.3 0.666 122.7 62.9 68.9 23.2 74.3 35.6 78.2 35 198 A G E < S-CD 32 52A 7 -3,-1.2 -3,-2.8 17,-0.3 2,-0.4 -0.907 83.6 -94.6-154.0-178.8 77.1 33.1 77.6 36 199 A V E -CD 31 51A 18 15,-2.0 15,-2.7 -2,-0.3 2,-0.5 -0.890 37.4-139.6-101.7 140.1 79.5 31.3 75.3 37 200 A V E -CD 30 50A 32 -7,-3.3 -8,-3.3 -2,-0.4 -7,-1.3 -0.916 22.0-176.6-106.1 129.7 78.4 27.9 74.1 38 201 A Y E -CD 28 49A 8 11,-2.7 11,-3.5 -2,-0.5 2,-0.4 -0.886 27.3-116.1-122.8 152.3 80.9 25.0 73.8 39 202 A K E - D 0 48A 61 -12,-2.7 2,-0.3 -2,-0.3 9,-0.2 -0.723 37.3-178.0 -83.9 134.1 80.8 21.5 72.6 40 203 A G E - D 0 47A 1 7,-3.0 7,-2.3 -2,-0.4 2,-0.4 -0.867 22.3-149.3-127.0 167.5 81.4 18.8 75.2 41 204 A Y E + D 0 46A 137 -28,-1.3 2,-0.4 -2,-0.3 5,-0.2 -0.931 29.0 161.2-140.5 107.0 81.6 15.0 75.3 42 205 A V E > - D 0 45A 26 3,-2.6 3,-2.0 -2,-0.4 -2,-0.1 -0.994 63.1 -9.1-132.4 129.3 80.4 13.5 78.4 43 206 A N T 3 S- 0 0 143 -2,-0.4 -1,-0.1 1,-0.3 3,-0.1 0.886 127.9 -51.8 50.7 49.9 79.3 9.8 79.1 44 207 A N T 3 S+ 0 0 138 1,-0.2 2,-0.4 -3,-0.1 -1,-0.3 0.609 119.3 109.1 65.2 16.0 79.3 8.8 75.4 45 208 A T E < -D 42 0A 65 -3,-2.0 -3,-2.6 53,-0.0 2,-0.5 -0.964 65.4-136.0-126.4 131.7 77.1 11.9 74.6 46 209 A T E +D 41 0A 51 -2,-0.4 53,-0.8 -5,-0.2 2,-0.3 -0.797 35.9 178.7 -81.2 130.3 77.9 15.1 72.7 47 210 A V E -DE 40 98A 2 -7,-2.3 -7,-3.0 -2,-0.5 2,-0.5 -0.845 32.0-123.3-127.9 162.7 76.4 18.1 74.6 48 211 A A E -DE 39 97A 10 49,-1.9 49,-2.6 -2,-0.3 2,-0.6 -0.961 26.2-162.2-105.3 124.0 76.3 21.9 74.3 49 212 A V E -DE 38 96A 0 -11,-3.5 -11,-2.7 -2,-0.5 2,-0.7 -0.933 1.9-161.2-113.7 115.6 77.6 23.6 77.4 50 213 A K E -DE 37 95A 6 45,-3.3 45,-2.3 -2,-0.6 2,-0.6 -0.874 3.7-161.7 -94.9 116.2 76.6 27.3 77.9 51 214 A K E -DE 36 94A 59 -15,-2.7 -15,-2.0 -2,-0.7 43,-0.2 -0.894 21.4-128.9 -99.0 117.1 78.9 29.0 80.3 52 215 A L E -D 35 0A 18 41,-2.7 41,-0.4 -2,-0.6 2,-0.3 -0.419 21.6-160.5 -70.2 133.8 77.2 32.2 81.6 53 216 A A 0 0 55 -19,-3.4 39,-0.0 -2,-0.1 4,-0.0 -0.926 360.0 360.0-112.6 144.7 79.3 35.5 81.3 54 217 A A 0 0 70 -2,-0.3 3,-0.3 6,-0.0 4,-0.1 -0.413 360.0 360.0 -80.9 360.0 78.5 38.7 83.3 55 ! 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 56 221 A I 0 0 92 0, 0.0 2,-0.2 0, 0.0 -22,-0.0 0.000 360.0 360.0 360.0-133.5 75.3 42.6 82.5 57 222 A T - 0 0 81 -3,-0.3 4,-0.5 1,-0.1 3,-0.2 -0.756 360.0 -97.6-117.6 166.4 76.3 42.1 86.2 58 223 A T S S+ 0 0 80 -2,-0.2 2,-0.8 2,-0.2 -1,-0.1 -0.287 101.7 41.0 -72.3 163.7 76.5 39.3 88.7 59 224 A E S > S+ 0 0 155 1,-0.2 4,-0.8 -2,-0.1 -1,-0.2 -0.219 114.2 57.7 82.1 -41.6 73.7 38.5 91.2 60 225 A E H > S+ 0 0 115 -2,-0.8 4,-2.1 -3,-0.2 -2,-0.2 0.698 98.8 62.5 -78.8 -23.4 71.2 39.2 88.5 61 226 A L H > S+ 0 0 12 -4,-0.5 4,-2.3 2,-0.2 5,-0.2 0.884 101.7 48.3 -64.8 -42.6 73.1 36.4 86.6 62 227 A K H > S+ 0 0 78 2,-0.2 4,-3.0 1,-0.2 -1,-0.2 0.886 111.4 51.6 -64.8 -39.7 72.1 33.8 89.2 63 228 A Q H X S+ 0 0 140 -4,-0.8 4,-1.4 2,-0.2 -2,-0.2 0.892 112.4 44.8 -62.7 -44.2 68.5 35.0 89.0 64 229 A Q H X S+ 0 0 35 -4,-2.1 4,-2.7 2,-0.2 -2,-0.2 0.848 114.4 48.6 -66.3 -40.6 68.5 34.7 85.2 65 230 A F H X S+ 0 0 3 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.934 112.3 49.9 -62.5 -48.1 70.2 31.2 85.4 66 231 A D H X S+ 0 0 74 -4,-3.0 4,-1.6 1,-0.2 -2,-0.2 0.797 113.1 47.2 -57.5 -36.8 67.6 30.2 88.0 67 232 A Q H X S+ 0 0 86 -4,-1.4 4,-2.7 2,-0.2 -2,-0.2 0.894 108.0 52.7 -77.5 -45.7 64.9 31.4 85.8 68 233 A E H X S+ 0 0 7 -4,-2.7 4,-2.3 1,-0.2 5,-0.2 0.932 110.9 48.5 -54.4 -48.0 66.1 29.7 82.6 69 234 A I H X S+ 0 0 28 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.937 111.0 51.0 -54.5 -46.5 66.2 26.4 84.6 70 235 A K H X S+ 0 0 146 -4,-1.6 4,-0.9 1,-0.2 -2,-0.2 0.901 111.2 47.9 -61.7 -43.6 62.6 27.0 85.9 71 236 A V H >X S+ 0 0 3 -4,-2.7 4,-0.9 1,-0.2 3,-0.5 0.924 113.2 47.5 -58.4 -47.2 61.4 27.7 82.3 72 237 A M H 3< S+ 0 0 7 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.796 103.7 61.1 -66.2 -32.8 63.1 24.5 80.9 73 238 A A H 3< S+ 0 0 24 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.860 115.7 34.2 -63.6 -30.5 61.7 22.3 83.7 74 239 A K H << S+ 0 0 159 -4,-0.9 2,-0.7 -3,-0.5 -1,-0.2 0.534 107.3 72.1-101.0 -11.9 58.2 23.3 82.5 75 240 A C < + 0 0 5 -4,-0.9 2,-0.6 -5,-0.1 -1,-0.2 -0.635 54.2 152.6-114.4 78.0 58.9 23.5 78.7 76 241 A Q + 0 0 105 -2,-0.7 2,-0.3 -3,-0.1 6,-0.1 -0.913 16.5 135.4-110.5 118.8 59.4 20.0 77.3 77 242 A H > - 0 0 48 -2,-0.6 3,-1.9 3,-0.3 56,-0.0 -0.970 63.2-111.4-162.9 146.4 58.4 19.6 73.7 78 243 A E T 3 S+ 0 0 133 -2,-0.3 4,-0.1 1,-0.3 55,-0.1 0.712 117.1 49.3 -54.4 -27.2 59.8 18.0 70.5 79 244 A N T 3 S+ 0 0 9 53,-0.1 83,-2.5 82,-0.1 2,-0.4 0.139 99.1 80.4-104.0 19.9 60.4 21.5 68.9 80 245 A L B < S-g 162 0B 3 -3,-1.9 -3,-0.3 81,-0.3 83,-0.2 -0.976 89.0-107.6-119.7 138.6 62.2 23.0 71.9 81 246 A V - 0 0 6 81,-2.8 2,-0.4 -2,-0.4 -2,-0.1 -0.412 39.6-129.7 -55.6 136.0 65.9 22.5 72.8 82 247 A E - 0 0 93 -2,-0.1 16,-2.5 -4,-0.1 2,-0.4 -0.768 8.1-137.7 -96.6 131.8 66.1 20.2 75.9 83 248 A L E - F 0 97A 3 -2,-0.4 14,-0.3 14,-0.2 3,-0.1 -0.770 17.7-176.5 -82.2 134.6 68.1 21.1 79.0 84 249 A L E - 0 0 51 12,-3.2 -81,-2.8 -2,-0.4 2,-0.3 0.781 57.0 -49.2-100.9 -39.9 70.0 18.1 80.4 85 250 A G E -aF 3 96A 0 11,-1.6 11,-2.7 -83,-0.3 -1,-0.3 -0.939 47.9-126.6-174.6-163.8 71.6 19.7 83.4 86 251 A F E -aF 4 95A 45 -83,-2.0 -81,-2.8 -2,-0.3 2,-0.4 -0.975 7.9-136.8-161.7 164.6 73.5 22.6 85.0 87 252 A S E +aF 5 94A 0 7,-2.8 7,-2.7 -2,-0.3 -81,-0.2 -1.000 25.7 160.3-131.5 130.2 76.5 23.5 87.1 88 253 A S + 0 0 46 -83,-0.5 2,-0.5 -2,-0.4 -82,-0.1 0.453 27.7 127.1-131.6 -1.2 76.3 26.2 89.8 89 254 A D S S- 0 0 74 -84,-0.3 3,-0.4 2,-0.1 2,-0.2 -0.463 75.0 -17.1 -63.8 110.5 79.3 25.6 92.2 90 255 A G S S- 0 0 68 -2,-0.5 0, 0.0 1,-0.2 0, 0.0 -0.658 115.6 -34.0 108.3-152.6 81.2 28.9 92.6 91 256 A D S S+ 0 0 139 -2,-0.2 2,-0.4 -33,-0.0 -1,-0.2 0.404 117.2 94.6 -82.5 1.0 81.3 32.1 90.6 92 257 A D - 0 0 53 -3,-0.4 2,-0.4 -39,-0.0 -85,-0.1 -0.807 53.5-175.2-103.3 129.7 80.7 29.8 87.6 93 258 A L + 0 0 17 -2,-0.4 -41,-2.7 -41,-0.4 2,-0.4 -0.988 7.2 177.6-125.5 123.4 77.3 29.0 86.1 94 259 A C E -EF 51 87A 0 -7,-2.7 -7,-2.8 -2,-0.4 2,-0.4 -0.972 16.2-160.8-127.3 145.4 76.7 26.4 83.3 95 260 A L E -EF 50 86A 0 -45,-2.3 -45,-3.3 -2,-0.4 2,-0.5 -0.954 12.0-155.1-118.9 137.9 73.7 25.0 81.4 96 261 A V E -EF 49 85A 0 -11,-2.7 -12,-3.2 -2,-0.4 -11,-1.6 -0.966 17.0-179.0-119.9 127.1 74.0 21.7 79.5 97 262 A Y E -EF 48 83A 24 -49,-2.6 -49,-1.9 -2,-0.5 -14,-0.2 -0.845 38.0 -84.6-123.2 161.6 71.7 21.0 76.6 98 263 A V E -E 47 0A 46 -16,-2.5 2,-0.3 -2,-0.3 -51,-0.2 -0.401 54.1-113.7 -60.1 134.7 71.0 18.3 74.1 99 264 A Y - 0 0 62 -53,-0.8 -1,-0.1 -2,-0.1 -53,-0.1 -0.617 20.4-153.0 -76.1 134.8 73.4 18.7 71.1 100 265 A M > - 0 0 11 -2,-0.3 3,-1.9 1,-0.1 54,-0.3 -0.865 5.8-165.5-114.2 98.4 71.9 19.6 67.8 101 266 A P T 3 S+ 0 0 46 0, 0.0 54,-0.2 0, 0.0 -1,-0.1 0.714 81.9 57.8 -64.5 -26.2 74.2 18.3 65.0 102 267 A N T 3 S- 0 0 32 52,-1.9 53,-0.2 1,-0.2 6,-0.1 0.335 95.0-148.9 -88.2 12.7 72.8 20.2 62.1 103 268 A G < - 0 0 22 -3,-1.9 51,-1.9 51,-0.3 -1,-0.2 -0.161 43.2 -16.1 64.0-155.3 73.4 23.7 63.7 104 269 A S B > -H 153 0B 7 49,-0.2 4,-1.9 1,-0.1 49,-0.2 -0.529 50.9-124.4 -90.7 153.9 71.1 26.6 63.1 105 270 A L H > S+ 0 0 0 47,-2.9 4,-2.9 44,-1.0 5,-0.2 0.876 113.4 57.9 -56.3 -37.9 68.6 27.3 60.5 106 271 A L H > S+ 0 0 52 43,-1.0 4,-1.3 46,-0.3 -1,-0.2 0.938 108.0 45.2 -56.6 -54.4 70.5 30.5 59.6 107 272 A D H >>S+ 0 0 50 2,-0.2 5,-2.2 1,-0.2 4,-0.6 0.817 114.3 48.8 -57.3 -39.4 73.7 28.6 58.9 108 273 A R H <5S+ 0 0 20 -4,-1.9 3,-0.5 2,-0.2 10,-0.4 0.883 109.9 51.1 -72.9 -36.6 71.8 25.9 56.9 109 274 A L H <5S+ 0 0 7 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.788 115.1 44.4 -65.8 -25.6 70.1 28.6 54.8 110 275 A S H <5S- 0 0 53 -4,-1.3 -1,-0.2 -5,-0.2 -2,-0.2 0.575 106.9-130.1 -94.8 -4.8 73.5 30.1 54.2 111 276 A C T ><5 - 0 0 0 -4,-0.6 3,-1.8 -3,-0.5 -3,-0.2 0.821 36.1-169.1 55.4 34.1 75.2 26.6 53.5 112 277 A L G > < + 0 0 36 -5,-2.2 3,-0.8 1,-0.3 710,-0.3 -0.260 64.6 12.0 -50.4 134.6 77.8 27.5 55.9 113 278 A D G 3 S- 0 0 74 708,-3.0 -1,-0.3 710,-0.4 709,-0.2 0.663 132.5 -66.4 69.3 14.2 80.8 25.1 55.8 114 279 A G G < S+ 0 0 23 -3,-1.8 -1,-0.2 707,-0.2 -2,-0.2 0.687 81.7 158.2 83.5 24.8 79.6 23.5 52.6 115 280 A T < - 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0 0 54 -6,-0.4 -1,-0.2 -5,-0.2 -2,-0.2 -0.857 65.4-112.2-108.0 140.7 25.1 -5.2 18.3 506 385 B P - 0 0 45 0, 0.0 11,-0.1 0, 0.0 -9,-0.0 -0.353 29.5-115.1 -68.3 147.6 21.5 -6.4 18.6 507 386 B A S S+ 0 0 1 1,-0.1 10,-3.1 9,-0.1 11,-0.4 0.780 104.5 25.8 -51.2 -36.2 20.9 -8.9 21.4 508 387 B V B +Y 516 0K 70 8,-0.2 2,-0.3 9,-0.1 8,-0.2 -0.996 63.6 172.9-129.4 143.1 20.0 -11.4 18.7 509 388 B D > - 0 0 58 6,-2.0 3,-1.5 -2,-0.3 -4,-0.0 -0.862 19.1-156.4-151.9 110.4 21.2 -11.6 15.1 510 389 B E T 3 S+ 0 0 135 -2,-0.3 5,-0.1 1,-0.3 -1,-0.1 0.719 94.1 47.6 -55.6 -34.4 20.2 -14.6 13.1 511 390 B H T 3 S+ 0 0 103 4,-0.1 570,-2.5 3,-0.1 2,-0.3 0.113 99.3 89.6-101.6 19.4 23.1 -14.3 10.6 512 391 B R B < S-Z 1080 0L 18 -3,-1.5 568,-0.2 568,-0.2 -3,-0.1 -0.818 77.7-111.2-116.5 154.7 25.7 -13.8 13.2 513 392 B E S S+ 0 0 80 566,-2.4 2,-0.1 -2,-0.3 -3,-0.0 -0.972 109.9 28.7-129.5 117.5 27.9 -16.2 15.1 514 393 B P S S- 0 0 24 0, 0.0 -1,-0.2 0, 0.0 -3,-0.1 0.596 85.9-157.2 -72.4 157.7 27.2 -16.3 18.0 515 394 B Q S S+ 0 0 78 -2,-0.1 -6,-2.0 -7,-0.1 2,-0.4 0.828 73.5 59.5 -74.1 -30.2 23.6 -15.5 17.4 516 395 B L B > S-Y 508 0K 61 -8,-0.2 3,-1.1 1,-0.1 4,-0.3 -0.864 70.4-145.6-110.4 128.1 22.9 -14.2 21.0 517 396 B L T >> S+ 0 0 0 -10,-3.1 3,-1.9 -2,-0.4 4,-0.7 0.826 98.0 69.5 -57.1 -38.5 24.8 -11.3 22.6 518 397 B L H >> S+ 0 0 33 -11,-0.4 3,-1.4 -44,-0.3 4,-0.8 0.885 89.1 62.6 -41.6 -46.2 24.5 -13.1 25.9 519 398 B D H <> S+ 0 0 66 -3,-1.1 4,-1.7 1,-0.3 -1,-0.3 0.674 93.4 66.2 -58.4 -18.9 27.0 -15.8 24.7 520 399 B I H <> S+ 0 0 4 -3,-1.9 4,-1.8 -4,-0.3 -1,-0.3 0.832 93.4 56.6 -74.0 -32.1 29.6 -12.9 24.3 521 400 B K H < S+ 0 0 20 -4,-1.8 3,-0.9 4,-0.2 -1,-0.2 0.835 113.4 48.8 -73.0 -36.0 34.9 -12.7 27.9 525 404 B E H 3< S+ 0 0 107 -4,-1.9 -2,-0.2 1,-0.2 -3,-0.2 0.932 105.9 57.0 -65.6 -45.4 34.6 -14.7 31.2 526 405 B D T 3< S- 0 0 110 -4,-3.4 -1,-0.2 1,-0.1 -2,-0.2 0.243 113.6-120.0 -75.1 17.0 36.3 -17.7 29.7 527 406 B E S < S+ 0 0 169 -3,-0.9 -3,-0.1 2,-0.2 -1,-0.1 0.253 85.2 118.5 62.8 -12.6 39.3 -15.4 28.9 528 407 B E S S- 0 0 133 -5,-0.5 2,-0.2 -6,-0.2 -4,-0.2 0.904 85.9 -3.7 -43.3 -51.6 38.7 -16.2 25.2 529 408 B K - 0 0 52 -6,-1.8 2,-0.3 -9,-0.1 -2,-0.2 -0.732 69.4-131.6-132.4-179.5 38.0 -12.5 24.5 530 409 B T - 0 0 77 -2,-0.2 4,-0.4 1,-0.1 3,-0.2 -0.844 31.8-104.5-128.7 175.6 37.7 -9.1 26.3 531 410 B I S >> S+ 0 0 7 -2,-0.3 3,-2.6 1,-0.2 4,-1.2 0.939 118.2 60.0 -66.9 -39.7 35.3 -6.3 26.3 532 411 B E T 34 S+ 0 0 76 1,-0.3 3,-0.3 2,-0.2 -1,-0.2 0.835 98.1 59.6 -54.5 -35.3 37.7 -4.1 24.3 533 412 B D T 34 S+ 0 0 91 -3,-0.2 -1,-0.3 1,-0.2 -2,-0.2 0.686 112.9 38.7 -68.3 -15.4 37.5 -6.7 21.5 534 413 B Y T <4 S+ 0 0 34 -3,-2.6 -2,-0.2 -4,-0.4 -1,-0.2 0.570 80.9 127.7-112.6 -8.3 33.8 -6.1 21.3 535 414 B I S < S- 0 0 26 -4,-1.2 -32,-0.3 -3,-0.3 -33,-0.1 -0.182 77.7 -93.4 -51.0 133.0 33.5 -2.3 21.8 536 415 B D > - 0 0 8 -34,-2.8 3,-0.9 1,-0.2 -32,-0.1 -0.322 30.1-151.6 -50.2 123.6 31.4 -0.8 19.0 537 416 B K T 3 S+ 0 0 133 -34,-0.3 434,-3.3 1,-0.2 435,-0.2 0.634 89.1 75.7 -72.0 -18.1 34.0 0.3 16.3 538 417 B K T 3 S+ 0 0 38 432,-0.3 2,-0.3 433,-0.2 -1,-0.2 0.296 83.9 81.7 -76.9 9.5 31.5 3.0 15.2 539 418 B M < - 0 0 13 -3,-0.9 432,-0.4 432,-0.1 433,-0.2 -0.831 50.6-178.4-107.3 158.3 32.4 5.0 18.3 540 419 B N S S+ 0 0 103 -2,-0.3 -1,-0.1 431,-0.2 -131,-0.1 0.513 73.3 56.3-125.8 -9.1 35.4 7.2 18.5 541 420 B D + 0 0 57 2,-0.1 2,-1.0 346,-0.0 -132,-0.0 -0.049 64.5 125.9-114.8 33.9 35.2 8.6 22.1 542 421 B A - 0 0 30 -132,-0.1 2,-0.2 4,-0.0 -3,-0.0 -0.759 42.3-158.7-100.8 100.2 35.1 5.6 24.4 543 422 B D > - 0 0 88 -2,-1.0 4,-1.8 1,-0.1 3,-0.2 -0.569 24.5-125.5 -71.7 143.6 37.9 5.7 27.1 544 423 B S H > S+ 0 0 54 1,-0.2 4,-2.6 -2,-0.2 5,-0.2 0.781 102.6 62.9 -67.5 -28.4 38.4 2.2 28.4 545 424 B T H > S+ 0 0 106 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.960 109.6 38.6 -63.3 -52.5 37.9 3.0 32.1 546 425 B S H > S+ 0 0 15 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.883 115.0 54.5 -64.9 -35.0 34.2 4.1 31.6 547 426 B V H X S+ 0 0 0 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.917 112.0 43.9 -61.8 -46.6 33.6 1.3 29.1 548 427 B E H X S+ 0 0 96 -4,-2.6 4,-2.1 2,-0.2 -2,-0.2 0.841 111.6 54.9 -63.3 -37.6 34.9 -1.2 31.6 549 428 B A H X S+ 0 0 35 -4,-2.4 4,-1.6 -5,-0.2 -2,-0.2 0.886 111.0 44.4 -62.9 -40.1 32.8 0.6 34.3 550 429 B M H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.884 112.4 51.4 -71.1 -40.5 29.7 0.1 32.2 551 430 B Y H X S+ 0 0 27 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.847 106.8 54.9 -63.1 -33.9 30.6 -3.5 31.3 552 431 B S H X S+ 0 0 56 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.923 108.2 48.5 -64.7 -43.2 31.0 -4.2 35.1 553 432 B V H X S+ 0 0 3 -4,-1.6 4,-2.0 1,-0.2 -2,-0.2 0.948 111.5 50.5 -60.1 -47.1 27.5 -2.9 35.7 554 433 B A H X S+ 0 0 0 -4,-2.3 4,-1.2 1,-0.2 -2,-0.2 0.887 108.6 50.9 -55.2 -47.9 26.2 -5.1 32.8 555 434 B S H < S+ 0 0 28 -4,-2.6 3,-0.2 1,-0.2 -1,-0.2 0.888 109.1 51.7 -60.9 -40.0 27.9 -8.3 34.2 556 435 B Q H >< S+ 0 0 55 -4,-2.1 3,-1.2 1,-0.2 -1,-0.2 0.899 110.8 47.3 -59.9 -40.6 26.4 -7.7 37.7 557 436 B C H 3< S+ 0 0 0 -4,-2.0 -1,-0.2 1,-0.3 -62,-0.2 0.742 106.4 61.4 -67.3 -29.5 22.9 -7.3 36.1 558 437 B L T 3< + 0 0 0 -4,-1.2 -1,-0.3 -3,-0.2 2,-0.2 0.132 69.4 138.9 -91.9 11.2 23.6 -10.5 34.1 559 438 B H < - 0 0 53 -3,-1.2 6,-0.1 1,-0.1 -67,-0.1 -0.456 53.1-140.3 -51.5 124.2 24.0 -12.8 37.2 560 439 B E S S+ 0 0 119 -2,-0.2 2,-0.7 1,-0.1 -81,-0.3 0.842 89.5 72.6 -59.5 -37.2 22.2 -16.0 36.3 561 440 B K S >> S- 0 0 120 1,-0.1 3,-3.0 -83,-0.1 4,-0.5 -0.741 79.9-145.9 -84.8 112.0 20.9 -16.2 39.9 562 441 B K G >4 S+ 0 0 48 -2,-0.7 3,-0.9 1,-0.3 -1,-0.1 0.782 96.8 58.6 -52.0 -30.3 18.2 -13.5 40.3 563 442 B N G 34 S+ 0 0 103 1,-0.2 -1,-0.3 -3,-0.0 -3,-0.0 0.645 97.2 57.8 -79.5 -14.7 19.3 -13.0 43.8 564 443 B K G <4 S+ 0 0 124 -3,-3.0 -1,-0.2 -5,-0.1 -2,-0.2 0.539 87.2 99.8 -90.5 -0.4 22.9 -12.0 43.1 565 444 B R S << S- 0 0 18 -3,-0.9 -8,-0.2 -4,-0.5 -9,-0.1 -0.521 78.4-111.5 -79.4 147.7 21.8 -9.1 40.8 566 445 B P - 0 0 20 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.283 32.1-114.9 -65.1 161.2 21.8 -5.5 42.0 567 446 B D > - 0 0 102 1,-0.1 4,-2.0 -76,-0.0 5,-0.1 -0.401 36.8 -97.4 -87.0 177.1 18.5 -3.7 42.4 568 447 B I H > S+ 0 0 8 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.858 123.0 58.5 -74.1 -32.4 17.7 -0.8 40.1 569 448 B K H > S+ 0 0 97 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.902 108.7 45.3 -56.9 -46.5 18.8 1.8 42.7 570 449 B K H > S+ 0 0 81 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.912 112.6 50.6 -64.3 -45.5 22.2 0.2 42.9 571 450 B V H X S+ 0 0 0 -4,-2.0 4,-2.2 1,-0.2 5,-0.2 0.957 109.6 52.5 -52.0 -49.0 22.4 0.0 39.0 572 451 B Q H X S+ 0 0 35 -4,-3.1 4,-1.6 1,-0.2 -1,-0.2 0.890 109.6 48.9 -58.3 -37.2 21.5 3.7 38.9 573 452 B Q H X S+ 0 0 91 -4,-1.7 4,-2.5 2,-0.2 -1,-0.2 0.906 109.2 50.4 -72.8 -44.5 24.3 4.6 41.4 574 453 B L H X S+ 0 0 29 -4,-2.2 4,-1.7 2,-0.2 -1,-0.2 0.864 109.7 51.4 -58.5 -41.2 27.0 2.7 39.5 575 454 B L H X S+ 0 0 1 -4,-2.2 4,-1.0 -5,-0.2 -1,-0.2 0.860 111.0 49.0 -66.8 -34.6 26.1 4.4 36.2 576 455 B Q H < S+ 0 0 107 -4,-1.6 3,-0.5 -5,-0.2 -2,-0.2 0.917 110.1 49.3 -68.0 -44.5 26.3 7.8 38.0 577 456 B E H < S+ 0 0 146 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.817 102.1 66.9 -61.2 -32.8 29.7 6.9 39.5 578 457 B M H < 0 0 21 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.880 360.0 360.0 -55.8 -44.0 30.8 5.9 36.0 579 458 B T < 0 0 106 -4,-1.0 -2,-0.2 -3,-0.5 -1,-0.2 0.912 360.0 360.0 -83.5 360.0 30.5 9.5 34.6 580 !* 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 0.0 581 164 C R 0 0 230 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -59.8 87.2 16.0 10.0 582 165 C F - 0 0 37 1,-0.1 76,-0.2 76,-0.0 2,-0.1 -0.680 360.0-107.3 -85.0 147.5 83.9 16.7 12.0 583 166 C H E -a 658 0M 111 74,-0.9 76,-1.6 -2,-0.3 2,-0.4 -0.381 29.2-131.4 -64.7 139.4 80.8 14.4 11.8 584 167 C S E -a 659 0M 62 74,-0.2 2,-0.4 -2,-0.1 76,-0.2 -0.843 20.3-160.1 -98.9 132.9 77.8 15.8 9.9 585 168 C F - 0 0 16 74,-2.6 2,-0.4 -2,-0.4 76,-0.3 -0.881 22.1-115.1-109.9 144.9 74.3 15.6 11.6 586 169 C S > - 0 0 21 -2,-0.4 4,-1.9 1,-0.1 3,-0.4 -0.636 19.2-137.1 -68.6 131.4 70.9 15.8 9.9 587 170 C F H > S+ 0 0 3 75,-1.1 4,-2.4 -2,-0.4 5,-0.1 0.846 106.1 52.1 -54.1 -38.8 69.1 18.9 11.1 588 171 C Y H > S+ 0 0 40 74,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.725 105.4 55.1 -75.1 -24.1 65.9 16.8 11.4 589 172 C E H > S+ 0 0 30 -3,-0.4 4,-1.8 2,-0.2 -1,-0.2 0.909 109.6 46.6 -68.1 -43.1 67.7 14.3 13.6 590 173 C L H X S+ 0 0 0 -4,-1.9 4,-1.1 1,-0.2 7,-0.3 0.937 111.6 50.1 -64.3 -50.3 68.8 17.1 15.9 591 174 C K H <>S+ 0 0 53 -4,-2.4 5,-2.5 1,-0.2 6,-0.5 0.822 111.6 51.3 -54.0 -36.6 65.2 18.5 16.0 592 175 C N H ><5S+ 0 0 23 -4,-1.3 3,-0.8 1,-0.2 -1,-0.2 0.861 110.1 46.2 -69.0 -39.2 64.0 15.0 16.8 593 176 C V H 3<5S+ 0 0 32 -4,-1.8 28,-0.6 1,-0.2 -2,-0.2 0.576 108.7 55.5 -88.9 -7.7 66.4 14.3 19.7 594 177 C T T 3X5S- 0 0 0 -4,-1.1 4,-1.9 26,-0.2 -1,-0.2 -0.122 121.9 -99.0-111.1 31.9 65.8 17.7 21.4 595 178 C N T <45S- 0 0 88 -3,-0.8 -3,-0.2 1,-0.2 -2,-0.1 0.892 85.3 -48.6 47.9 48.3 62.0 17.3 21.7 596 179 C N T 4> -b 608 0M 61 0, 0.0 5,-2.4 0, 0.0 4,-1.6 -0.196 30.7-115.9 -50.8 156.8 63.8 25.3 30.5 602 185 C I T 45S+ 0 0 83 6,-1.0 7,-0.1 3,-0.2 -2,-0.0 0.589 113.5 65.3 -79.6 -11.1 64.5 21.7 31.5 603 186 C S T 45S+ 0 0 106 1,-0.1 -1,-0.2 2,-0.1 -3,-0.0 0.970 106.8 39.7 -65.7 -56.8 63.1 22.5 35.0 604 187 C V T 45S- 0 0 98 1,-0.1 -2,-0.2 0, 0.0 -1,-0.1 0.875 135.9 -87.3 -60.4 -38.5 59.6 23.1 33.6 605 188 C G T <5S+ 0 0 41 -4,-1.6 -3,-0.2 -7,-0.1 -1,-0.1 0.289 91.6 104.0 150.6 -8.3 60.0 20.2 31.2 606 189 C G S + C 0 615M 34 3,-2.7 3,-1.1 -2,-0.3 125,-0.1 -0.927 45.7 74.7 165.1 177.3 75.0 32.4 23.7 613 196 C G T 3 S- 0 0 9 -2,-0.3 3,-0.1 1,-0.3 125,-0.1 0.549 130.3 -59.5 67.0 8.9 77.6 31.9 21.0 614 197 C F T 3 S+ 0 0 84 1,-0.3 -1,-0.3 18,-0.1 2,-0.2 0.656 123.2 56.1 87.0 28.8 74.9 33.6 18.8 615 198 C G E < S-C 612 0M 14 -3,-1.1 -3,-2.7 17,-0.2 2,-0.4 -0.914 84.5 -86.4-162.8-175.6 72.3 30.9 19.5 616 199 C V E -CD 611 631M 20 15,-1.8 15,-2.4 -5,-0.3 2,-0.5 -0.909 36.6-137.2-110.4 138.9 70.2 28.8 22.0 617 200 C V E -CD 610 630M 32 -7,-3.1 -8,-3.0 -2,-0.4 -7,-1.0 -0.871 21.7-175.0-105.9 127.1 71.5 25.6 23.5 618 201 C Y E -CD 608 629M 0 11,-2.7 11,-3.4 -2,-0.5 2,-0.3 -0.849 26.2-116.1-117.0 151.6 69.3 22.5 23.8 619 202 C K E - 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0 0 81 -2,-0.6 2,-0.3 -3,-0.2 12,-0.1 -0.289 30.5-173.8 -62.9 138.4 82.7 46.0 21.3 754 349 C V + 0 0 34 10,-0.2 2,-0.3 2,-0.1 13,-0.1 -0.919 30.6 65.6-134.1 166.4 81.8 42.6 22.7 755 350 C G S S- 0 0 27 -2,-0.3 2,-0.5 -36,-0.1 -36,-0.1 -0.852 86.3 -49.9 122.8-162.1 82.2 40.4 25.8 756 351 C T >> - 0 0 41 -2,-0.3 3,-1.9 -38,-0.2 4,-1.1 -0.964 39.9-145.8-122.7 120.0 80.9 40.8 29.4 757 352 C T G >4 S+ 0 0 101 -2,-0.5 3,-0.6 1,-0.3 -1,-0.1 0.816 95.2 57.4 -50.6 -47.6 81.4 44.2 31.1 758 353 C A G 34 S+ 0 0 6 1,-0.2 -1,-0.3 34,-0.0 44,-0.3 0.683 116.7 36.3 -61.2 -20.1 81.8 42.9 34.7 759 354 C Y G <4 S+ 0 0 16 -3,-1.9 -1,-0.2 2,-0.1 21,-0.2 0.564 93.0 117.9-106.6 -15.7 84.8 40.7 33.5 760 355 C M << - 0 0 20 -4,-1.1 14,-0.1 -3,-0.6 -5,-0.0 -0.322 61.7-125.4 -71.9 129.9 86.4 43.1 30.8 761 356 C A > - 0 0 0 12,-0.3 4,-1.8 -2,-0.1 5,-0.2 -0.289 32.0-111.1 -55.4 151.3 89.8 44.6 30.9 762 357 C P H > S+ 0 0 30 0, 0.0 4,-0.6 0, 0.0 3,-0.5 0.961 120.2 48.0 -56.2 -47.7 89.9 48.4 30.6 763 358 C E H >4>S+ 0 0 12 81,-0.3 5,-1.9 1,-0.2 3,-1.1 0.882 107.9 56.9 -63.3 -37.0 91.5 48.2 27.1 764 359 C A H >45S+ 0 0 17 1,-0.3 3,-1.3 2,-0.2 -1,-0.2 0.854 101.4 54.4 -58.5 -41.3 88.9 45.6 26.0 765 360 C L H 3<5S+ 0 0 77 -4,-1.8 -1,-0.3 -3,-0.5 -2,-0.2 0.635 104.1 57.5 -71.2 -11.0 86.0 47.9 26.8 766 361 C R T <<5S- 0 0 183 -3,-1.1 -1,-0.2 -4,-0.6 -2,-0.2 0.384 128.1 -95.5 -96.6 -0.3 87.6 50.5 24.5 767 362 C G T < 5S+ 0 0 2 -3,-1.3 -17,-0.5 1,-0.3 -3,-0.2 0.344 76.6 145.3 104.4 -2.4 87.6 48.0 21.5 768 363 C E B < -J 749 0O 35 -5,-1.9 2,-0.5 -19,-0.2 -1,-0.3 -0.382 37.1-151.5 -68.5 140.6 91.1 46.7 21.9 769 364 C I + 0 0 6 -21,-2.0 -21,-0.0 -23,-0.4 -1,-0.0 -0.976 37.2 131.2-120.1 115.3 91.6 43.0 21.0 770 365 C T > - 0 0 2 -2,-0.5 3,-1.4 -23,-0.1 4,-0.4 -0.961 61.2-122.2-164.8 144.5 94.5 41.3 22.8 771 366 C P T >> S+ 0 0 48 0, 0.0 4,-1.4 0, 0.0 3,-0.9 0.711 107.6 71.4 -66.5 -23.9 95.2 38.1 24.8 772 367 C K H 3> S+ 0 0 50 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.747 91.0 61.5 -57.9 -27.3 96.2 40.1 27.9 773 368 C S H <> S+ 0 0 11 -3,-1.4 4,-1.9 2,-0.2 -12,-0.3 0.803 99.2 53.3 -68.9 -30.9 92.5 40.9 28.1 774 369 C D H <> S+ 0 0 2 -3,-0.9 4,-1.9 -4,-0.4 -2,-0.2 0.857 106.0 54.0 -70.3 -38.8 91.8 37.2 28.6 775 370 C I H X S+ 0 0 4 -4,-1.4 4,-1.4 2,-0.2 -2,-0.2 0.932 108.0 50.3 -57.3 -45.0 94.3 37.2 31.5 776 371 C Y H X S+ 0 0 8 -4,-1.7 4,-1.3 1,-0.2 3,-0.4 0.926 110.5 47.5 -59.0 -50.8 92.4 40.1 33.1 777 372 C S H X S+ 0 0 11 -4,-1.9 4,-1.9 1,-0.2 -1,-0.2 0.818 108.1 56.7 -62.7 -33.4 89.0 38.3 32.8 778 373 C F H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.808 100.4 58.5 -65.2 -35.0 90.5 35.2 34.3 779 374 C G H X S+ 0 0 0 -4,-1.4 4,-1.4 -3,-0.4 -2,-0.2 0.888 105.4 50.3 -58.9 -39.6 91.6 37.3 37.3 780 375 C V H X S+ 0 0 0 -4,-1.3 4,-2.0 -21,-0.2 3,-0.3 0.921 108.3 50.9 -66.5 -47.1 87.9 38.1 37.8 781 376 C V H X S+ 0 0 0 -4,-1.9 4,-2.0 1,-0.2 -2,-0.2 0.888 106.8 56.6 -52.6 -46.3 86.9 34.3 37.6 782 377 C L H X S+ 0 0 0 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.857 106.4 48.6 -52.7 -39.6 89.6 33.7 40.2 783 378 C L H X S+ 0 0 6 -4,-1.4 4,-2.0 -3,-0.3 6,-0.4 0.842 109.6 52.7 -68.7 -39.5 87.9 36.1 42.6 784 379 C E H X S+ 0 0 1 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.867 109.3 49.9 -57.6 -42.1 84.6 34.5 42.0 785 380 C I H < S+ 0 0 0 -4,-2.0 -2,-0.2 2,-0.2 -1,-0.2 0.908 115.0 42.3 -63.1 -47.3 86.2 31.1 42.9 786 381 C I H < S+ 0 0 0 -4,-2.0 34,-2.9 1,-0.2 -2,-0.2 0.892 128.6 28.0 -63.4 -40.7 87.7 32.4 46.2 787 382 C T H < S- 0 0 7 -4,-2.0 34,-0.3 32,-0.3 -2,-0.2 0.658 90.1-134.4-105.9 -22.9 84.7 34.4 47.3 788 383 C G < + 0 0 11 -4,-2.5 -4,-0.1 -5,-0.3 -3,-0.1 0.517 65.0 128.2 72.9 6.2 81.7 32.6 45.7 789 384 C L - 0 0 50 -6,-0.4 -1,-0.3 29,-0.1 -2,-0.2 -0.764 63.2-115.4 -95.4 136.2 80.4 36.0 44.6 790 385 C P - 0 0 54 0, 0.0 11,-0.1 0, 0.0 3,-0.1 -0.346 27.1-112.6 -68.0 151.7 79.4 36.8 41.1 791 386 C A S S+ 0 0 1 1,-0.2 10,-3.7 9,-0.1 11,-0.4 0.835 105.2 25.7 -47.1 -45.1 81.4 39.5 39.2 792 387 C V B +K 800 0P 59 8,-0.2 2,-0.3 9,-0.1 8,-0.2 -0.991 61.3 172.5-126.5 136.5 78.3 41.7 39.2 793 388 C D > - 0 0 53 6,-2.4 3,-1.8 -2,-0.4 -4,-0.0 -0.907 20.6-155.3-142.1 112.9 75.4 41.8 41.6 794 389 C E T 3 S+ 0 0 122 -2,-0.3 5,-0.1 1,-0.3 -1,-0.1 0.691 96.7 47.2 -57.7 -26.2 72.9 44.6 41.2 795 390 C H T 3 S+ 0 0 86 4,-0.1 -572,-2.1 3,-0.1 2,-0.3 0.158 96.2 90.8-107.2 18.0 71.9 44.3 44.9 796 391 C R B < S-M 222 0F 15 -3,-1.8 -574,-0.2 -574,-0.2 -3,-0.1 -0.772 79.9-109.8-108.9 156.5 75.3 44.2 46.3 797 392 C E S S+ 0 0 107 -576,-2.3 2,-0.1 1,-0.3 -3,-0.0 -0.983 112.8 27.8-125.2 111.4 77.5 47.0 47.6 798 393 C P S S- 0 0 9 0, 0.0 -1,-0.3 0, 0.0 -3,-0.1 0.626 85.2-154.4 -77.1 158.3 79.7 47.3 45.6 799 394 C Q S S+ 0 0 95 -5,-0.1 -6,-2.4 -2,-0.1 2,-0.5 0.812 76.5 62.3 -68.8 -27.4 78.0 45.9 42.5 800 395 C L B >> S-K 792 0P 61 -8,-0.2 3,-1.1 1,-0.1 4,-0.7 -0.861 70.1-146.6-111.7 128.8 81.2 44.8 40.9 801 396 C L H >> S+ 0 0 2 -10,-3.7 4,-0.9 -2,-0.5 3,-0.6 0.797 99.9 66.1 -59.2 -33.4 83.6 42.2 42.3 802 397 C L H >> S+ 0 0 21 -11,-0.4 3,-0.8 -44,-0.3 4,-0.8 0.866 96.4 53.7 -50.2 -45.2 86.5 44.2 40.8 803 398 C D H <> S+ 0 0 80 -3,-1.1 4,-1.2 1,-0.2 3,-0.3 0.765 99.7 63.3 -66.8 -23.0 85.8 47.1 43.2 804 399 C I H S+ 0 0 41 -4,-1.2 6,-1.2 1,-0.2 5,-0.9 0.870 108.7 44.4 -57.8 -38.4 89.1 47.6 49.1 808 403 C I H ><5S+ 0 0 22 -4,-1.1 3,-0.5 4,-0.2 -2,-0.2 0.852 113.1 51.0 -72.4 -37.7 91.7 44.9 49.9 809 404 C E H 3<5S+ 0 0 112 -4,-1.8 2,-1.6 1,-0.3 -2,-0.2 0.940 104.7 57.5 -67.7 -44.2 94.5 46.8 48.2 810 405 C D T 3<5S- 0 0 110 -4,-3.0 2,-2.6 1,-0.1 -1,-0.3 -0.455 115.9-109.2 -89.5 61.3 93.7 50.0 50.2 811 406 C E T < 5S+ 0 0 184 -2,-1.6 -3,-0.1 -3,-0.5 -1,-0.1 0.339 94.0 110.9 37.0 -1.2 94.1 48.3 53.6 812 407 C E S - 0 0 72 -2,-0.3 3,-0.6 1,-0.1 4,-0.3 -0.852 32.0-114.8-120.4 165.4 91.8 41.3 53.6 815 410 C I G >> S+ 0 0 11 -2,-0.3 3,-2.9 1,-0.2 4,-1.3 0.933 114.1 68.0 -66.5 -38.9 91.0 38.4 51.2 816 411 C E G 34 S+ 0 0 75 1,-0.3 -1,-0.2 2,-0.2 3,-0.0 0.778 94.3 58.7 -45.3 -33.8 90.2 36.2 54.3 817 412 C D G <4 S+ 0 0 101 -3,-0.6 -1,-0.3 1,-0.2 -2,-0.2 0.637 111.1 39.5 -70.2 -23.6 87.2 38.5 54.9 818 413 C Y T <4 S+ 0 0 27 -3,-2.9 -2,-0.2 -4,-0.3 -1,-0.2 0.573 82.1 128.6-104.7 -9.5 85.7 37.7 51.4 819 414 C I S < S- 0 0 32 -4,-1.3 -32,-0.3 1,-0.1 -33,-0.1 -0.147 75.0 -97.4 -46.6 128.8 86.6 33.9 51.4 820 415 C D > - 0 0 10 -34,-2.9 3,-0.7 -35,-0.2 -32,-0.1 -0.339 28.3-151.9 -53.2 128.3 83.4 31.9 50.5 821 416 C K T 3 S+ 0 0 147 -34,-0.3 -708,-3.0 1,-0.2 -707,-0.2 0.575 84.5 80.6 -83.1 -10.5 81.9 30.7 53.8 822 417 C K T 3 S+ 0 0 35 -710,-0.3 2,-0.3 -709,-0.2 -1,-0.2 0.165 80.5 77.5 -81.9 16.6 80.3 27.7 52.0 823 418 C M < - 0 0 11 -3,-0.7 -710,-0.4 -131,-0.1 -709,-0.2 -0.897 52.8-171.7-114.5 155.3 83.7 25.7 52.0 824 419 C N S S+ 0 0 124 -2,-0.3 -1,-0.1 -711,-0.2 -132,-0.1 0.376 80.7 53.8-117.9 1.9 85.1 23.9 55.0 825 420 C D + 0 0 59 2,-0.1 2,-0.2 0, 0.0 -133,-0.0 0.214 69.4 124.9-125.7 11.6 88.6 23.0 53.6 826 421 C A - 0 0 39 -6,-0.1 2,-0.4 -133,-0.1 3,-0.1 -0.483 43.4-156.5 -73.3 136.6 90.1 26.2 52.4 827 422 C D > - 0 0 77 -2,-0.2 4,-2.0 1,-0.1 5,-0.2 -0.946 20.7-127.7-111.9 147.8 93.5 27.1 53.9 828 423 C S H > S+ 0 0 59 -2,-0.4 4,-2.3 1,-0.2 5,-0.2 0.862 103.8 58.8 -61.5 -35.1 94.8 30.6 54.1 829 424 C T H > S+ 0 0 112 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.925 113.1 35.9 -57.5 -51.9 98.2 29.8 52.4 830 425 C S H > S+ 0 0 11 2,-0.2 4,-2.1 -3,-0.2 -2,-0.2 0.843 115.5 54.9 -74.1 -34.1 96.6 28.5 49.1 831 426 C V H X S+ 0 0 0 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.951 111.8 46.0 -60.2 -44.8 93.7 31.0 49.1 832 427 C E H X S+ 0 0 89 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.838 109.5 53.4 -67.7 -33.9 96.4 33.8 49.4 833 428 C A H X S+ 0 0 34 -4,-1.5 4,-1.7 -5,-0.2 -1,-0.2 0.872 112.3 45.4 -64.6 -39.1 98.5 32.2 46.6 834 429 C M H X S+ 0 0 0 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.880 112.6 50.3 -70.6 -42.1 95.4 32.2 44.4 835 430 C Y H X S+ 0 0 31 -4,-2.6 4,-2.9 2,-0.2 -2,-0.2 0.881 107.7 54.4 -57.1 -41.9 94.5 35.8 45.4 836 431 C S H X S+ 0 0 60 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.924 109.9 47.3 -62.2 -43.5 98.1 36.8 44.6 837 432 C V H X S+ 0 0 2 -4,-1.7 4,-1.8 2,-0.2 -2,-0.2 0.926 112.1 49.1 -58.8 -51.0 97.6 35.3 41.1 838 433 C A H X S+ 0 0 0 -4,-2.6 4,-1.6 2,-0.2 -2,-0.2 0.907 110.4 52.0 -54.2 -44.5 94.3 37.1 40.6 839 434 C S H < S+ 0 0 22 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.898 108.6 49.2 -62.7 -43.1 95.9 40.4 41.7 840 435 C Q H >< S+ 0 0 61 -4,-2.1 3,-0.9 1,-0.2 -1,-0.2 0.855 111.7 50.8 -59.5 -36.4 98.7 40.0 39.2 841 436 C C H 3< S+ 0 0 0 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.765 105.9 56.5 -72.8 -31.2 96.0 39.3 36.5 842 437 C L T 3< + 0 0 2 -4,-1.6 -1,-0.2 -3,-0.2 -2,-0.2 0.231 69.9 138.5 -90.7 6.2 94.0 42.3 37.4 843 438 C H < - 0 0 77 -3,-0.9 6,-0.1 -4,-0.2 -3,-0.1 -0.358 55.5-136.8 -44.7 121.7 96.8 44.9 36.9 844 439 C E S S+ 0 0 105 1,-0.1 2,-0.8 -83,-0.1 -81,-0.3 0.845 89.9 75.9 -53.7 -34.6 95.2 47.8 35.2 845 440 C K S >> S- 0 0 142 1,-0.2 3,-2.4 -83,-0.1 4,-0.6 -0.722 78.2-147.5 -90.8 112.3 98.2 48.1 32.8 846 441 C K T 34 S+ 0 0 27 -2,-0.8 3,-0.2 1,-0.3 -1,-0.2 0.669 96.0 54.5 -53.7 -21.6 97.9 45.3 30.3 847 442 C N T 34 S+ 0 0 115 1,-0.2 -1,-0.3 -3,-0.0 -3,-0.0 0.673 100.4 58.1 -88.3 -17.4 101.7 45.0 30.1 848 443 C K T <4 S+ 0 0 141 -3,-2.4 -1,-0.2 2,-0.1 -2,-0.2 0.560 87.0 100.5 -84.6 -11.1 102.2 44.5 33.8 849 444 C R S < S- 0 0 17 -4,-0.6 -8,-0.2 -3,-0.2 2,-0.1 -0.389 80.6-107.5 -69.5 150.6 99.9 41.3 33.8 850 445 C P - 0 0 17 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.406 32.0-112.4 -70.2 155.5 101.4 37.8 33.8 851 446 C D >> - 0 0 105 1,-0.1 4,-2.2 -2,-0.1 3,-0.6 -0.453 36.2-102.4 -79.9 168.8 101.3 35.7 30.6 852 447 C I H 3> S+ 0 0 9 1,-0.3 4,-2.9 2,-0.2 -144,-0.2 0.816 122.4 61.0 -66.6 -23.6 99.1 32.6 30.8 853 448 C K H 3> S+ 0 0 87 2,-0.2 4,-2.2 1,-0.2 -1,-0.3 0.852 105.5 43.9 -66.5 -43.5 102.2 30.6 31.2 854 449 C K H <> S+ 0 0 74 -3,-0.6 4,-2.9 2,-0.2 -2,-0.2 0.922 114.9 51.4 -65.6 -47.9 103.3 32.3 34.5 855 450 C V H X S+ 0 0 0 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.905 110.8 47.3 -52.0 -49.6 99.7 32.1 35.7 856 451 C Q H X S+ 0 0 30 -4,-2.9 4,-2.0 1,-0.2 -1,-0.2 0.918 112.9 50.3 -63.0 -41.5 99.6 28.4 34.9 857 452 C Q H X S+ 0 0 85 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.918 112.0 47.0 -57.6 -48.7 103.0 28.1 36.7 858 453 C L H X S+ 0 0 33 -4,-2.9 4,-1.2 2,-0.2 -2,-0.2 0.860 110.6 50.0 -67.0 -39.0 101.7 30.0 39.8 859 454 C L H X S+ 0 0 0 -4,-2.5 4,-0.8 2,-0.2 -1,-0.2 0.896 112.3 49.6 -66.6 -36.9 98.4 28.0 40.1 860 455 C Q H >< S+ 0 0 107 -4,-2.0 3,-0.9 -5,-0.2 -2,-0.2 0.930 110.7 49.2 -63.8 -45.5 100.5 24.8 39.9 861 456 C E H 3< S+ 0 0 135 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.699 100.8 66.0 -64.1 -24.6 102.9 26.1 42.6 862 457 C M H 3< 0 0 21 -4,-1.2 -1,-0.2 1,-0.2 -2,-0.2 0.833 360.0 360.0 -66.4 -32.1 99.8 26.9 44.7 863 458 C T << 0 0 113 -3,-0.9 -2,-0.2 -4,-0.8 -1,-0.2 0.779 360.0 360.0 -94.1 360.0 99.1 23.2 45.0 864 !* 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 0.0 865 164 D R 0 0 221 0, 0.0 2,-0.9 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -61.4 56.9 19.1 -7.2 866 165 D F - 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