NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 172 D 4.6307 8.2227 120.1973 53.9305 41.4878 175.4620 173 E 3.8477 8.6112 127.9147 57.9762 29.6934 176.4739 174 L 4.0759 8.1874 120.2310 58.3237 42.6355 177.7043 175 Y 4.0186 8.3072 118.9463 60.6510 38.8611 177.6781 176 R 3.9589 8.1688 119.5975 59.5978 30.2262 178.1613 177 Q 3.8956 8.3161 119.2585 59.3363 29.0077 178.4068 178 S 4.1361 8.3706 116.2243 61.6020 62.8664 176.4878 179 L 3.8457 7.9966 124.7193 57.3034 41.7508 178.6243 180 E 3.8126 8.1002 119.1848 59.3079 29.7710 178.6184 181 I 3.4302 7.3679 119.6190 64.5932 37.1317 178.5253 182 I 3.7547 7.6788 120.4449 64.4185 36.8159 178.8391 183 S 4.0999 8.2639 116.1676 61.7377 62.7007 176.9473 184 R 3.8920 8.0616 120.7620 59.2319 29.2870 178.6099 185 Y 4.2632 7.9491 118.9866 60.8086 38.8334 177.9328 186 L 3.8485 7.9011 119.9096 57.6380 41.6109 179.5587 187 R 3.8173 8.1959 119.0849 59.4118 30.0515 178.4808 188 E 4.1567 8.0290 118.6784 58.7911 29.4033 179.0865 189 Q 3.7925 7.7738 118.3521 58.3638 28.7274 178.1818 190 A 4.0305 7.7492 121.4585 55.3401 18.6537 179.5076 191 T 3.9586 7.8485 107.4114 64.4154 68.9835 175.5505 192 G 4.0236 8.6085 107.3654 44.6158 0.0000 172.8433 193 A 4.6395 7.9294 123.5608 50.6891 22.3592 176.8490 194 K 4.4756 8.4853 124.1595 53.9050 33.0862 177.1066 195 D 4.1602 8.5096 117.4026 56.5910 39.7768 179.4245 *203 G 3.8768 8.2329 105.8280 45.6398 0.0000 174.8287 204 A 3.9869 8.4270 120.4030 54.9421 19.1691 179.8832 205 T 3.8485 7.9120 113.7146 67.0457 68.6130 176.7874 206 S 3.9667 8.0128 116.4243 61.6099 62.8658 176.9148 207 R 3.9331 8.0339 120.7754 59.1952 29.7588 179.2767 208 K 4.0388 8.3973 118.3133 59.2343 32.0115 179.3738 209 A 4.2621 8.4272 121.6129 55.1260 18.2622 179.4237 210 L 3.8959 7.9878 118.8953 58.2458 42.1191 179.1018 211 E 3.9742 8.3473 118.5479 59.7408 29.3828 179.4531 212 T 3.8459 8.2014 115.9599 66.5656 68.4468 176.4949 213 L 3.9071 8.5651 122.6088 58.0770 41.8657 179.2866 214 R 4.1383 8.0798 118.3031 59.1354 29.8847 179.0570 215 R 3.8541 7.9595 118.4696 59.4702 30.1301 178.7967 216 V 3.6275 8.1022 118.5286 65.9331 31.6031 178.2440 217 G 4.0718 8.0518 106.9850 46.9971 0.0000 175.4336 218 D 4.6263 8.2102 121.4797 57.0462 40.8369 179.0820 219 G 3.6110 7.9365 106.5345 47.7329 0.0000 175.9680 220 V 3.6230 8.1109 120.9061 65.8468 31.3341 178.1810 221 Q 3.5602 7.7735 116.6598 58.7527 28.6264 178.4976 222 R 4.0239 7.8722 118.6966 59.6087 30.2680 178.1209 223 N 4.4582 8.0961 114.9996 55.3523 38.8134 175.2141 224 H 4.8486 7.8158 117.7199 54.7973 30.1744 175.7535 225 E 3.7701 8.3335 121.6311 59.6023 29.5169 177.4637 226 T 4.0114 7.8884 114.9861 66.7461 68.5954 176.2533 227 A 4.0279 7.9490 121.9779 55.2400 18.4219 179.4760 228 F 4.0565 8.5430 116.5634 60.7274 38.7747 177.9250 229 Q 4.4247 8.7780 118.1457 59.0433 28.5236 179.1234 230 G 3.6488 8.5265 107.0804 48.0984 0.0000 175.5973 231 M 4.0262 8.4913 121.7403 57.9766 31.8605 178.6460 232 L 4.1307 8.4692 120.7693 58.1844 42.1049 178.9686 233 R 3.8990 8.1863 117.8171 59.5200 30.1358 178.3725 234 K 4.1579 8.0875 117.1596 59.4090 32.0839 179.0953 235 L 4.0429 8.1320 118.7471 55.6203 42.7403 176.8387 236 D 4.2856 8.2306 116.4506 55.2225 39.6870 174.2036 237 I 4.0653 7.5844 121.6217 61.7324 37.8843 177.6761 238 K 4.1677 8.7010 128.5232 57.2425 31.9263 172.8080 239 N 4.9195 7.7170 117.1635 52.0211 40.0101 175.5889 240 E 3.9867 8.7218 114.1483 59.0456 29.6969 175.7173 241 D 4.6438 7.9212 115.8896 55.2252 41.6181 176.7775 242 D 4.6450 7.6760 121.1017 53.0811 39.5498 176.5244 243 V 4.3865 7.4007 111.9127 60.5638 33.3086 177.0322 244 K 4.0362 7.9605 120.0705 59.3928 31.9850 179.0954 245 S 4.1664 8.0300 114.1806 61.4688 63.0256 176.4123 246 L 4.0793 7.9135 122.1497 57.6119 41.4370 179.4781 247 S 4.2035 8.3277 115.2076 61.6887 62.7866 176.9645 248 R 3.9640 7.9751 120.5444 59.1670 29.7804 179.3059 249 V 3.5784 7.9021 118.1034 66.2562 31.3034 178.0859 250 M 4.0248 7.9512 117.4157 58.3254 31.5763 178.4817 251 I 3.9611 7.9345 120.0310 64.7789 37.2334 178.0434 252 H 4.1333 8.3650 119.0485 58.9413 29.4031 177.1769 253 V 3.3543 7.4225 119.5599 65.7868 31.4324 177.1734 254 F 4.6721 7.4261 114.1986 57.5684 38.8487 177.5892 255 S 4.2070 7.9632 115.3802 60.4777 62.8416 175.1013 256 D 4.5821 7.8924 121.0783 53.6727 39.7427 176.9594 257 G 3.8357 8.1503 109.0030 45.4839 0.0000 173.1660 258 V 4.2092 7.8615 119.4425 61.2027 32.6959 175.2924 259 T 4.3624 8.0469 123.0609 61.0523 71.4812 173.3091 260 N 4.8360 7.7852 122.0277 50.4277 41.3888 175.5345 261 W 4.6935 8.4798 121.2041 59.7675 29.1719 178.8193 262 G 4.1125 8.4081 105.4307 48.3291 0.0000 175.7632 263 R 4.0276 9.0944 121.1588 58.7572 30.0382 179.2305 264 I 3.9324 7.8638 119.7597 64.5838 37.1349 178.9634 265 V 3.9541 8.7778 120.3450 65.0946 31.2052 178.5934 266 T 4.0929 8.1490 116.3571 66.2703 68.2592 176.6770 267 L 4.0656 8.2969 121.1703 58.1224 41.7327 179.7397 268 I 3.9099 7.9838 119.6185 64.4067 37.0262 178.6887 269 S 4.4745 8.6699 116.4266 61.8732 62.7049 176.6179 270 F 4.3490 8.9026 123.5571 61.0568 39.0093 177.3500 271 G 3.6047 8.4794 105.5209 47.7383 0.0000 175.5728 272 A 4.0139 8.2134 123.1423 54.6905 18.2739 179.4460 273 F 4.1036 8.3629 119.3287 61.5483 39.5121 177.6118 274 V 3.4073 7.8624 117.7830 65.7616 30.9074 177.8526 275 A 3.9637 7.8923 120.6265 54.8723 18.1233 179.8493 276 K 3.8140 7.9118 117.0827 59.8778 32.0637 179.0522 277 H 3.9941 7.6742 118.5818 59.1307 29.7370 177.0595 278 L 3.8969 7.9250 120.7858 57.9443 41.2206 179.7441 279 K 4.8065 7.2898 118.1962 59.1444 31.9832 179.1249 280 T 3.9413 7.4274 115.3051 66.8000 68.4536 176.3643 281 I 3.8853 7.6483 122.9239 63.8449 37.7931 176.9720 282 N 5.0071 8.2919 117.7337 51.3072 41.6734 178.0504 283 Q 4.0294 8.8548 122.0363 57.9327 28.4751 177.5047 284 E 4.6104 7.8797 110.8670 55.5510 30.0625 179.0495 285 S 4.2366 7.7856 115.9301 59.6225 63.1900 173.7806 286 C 4.3152 8.5890 123.2820 59.4097 28.2982 174.1995 287 I 4.1300 8.3182 118.1731 61.6460 37.4144 177.4651 288 E 3.9182 7.7590 120.6826 59.4921 29.4185 177.1040 289 P 4.3069 0.0000 0.0000 65.6307 31.4309 178.4049 290 L 3.9563 7.8825 118.2550 58.0744 42.1173 178.7467 291 A 4.0223 7.9685 120.7514 55.3231 18.2874 179.5444 292 E 3.9827 8.8348 117.4979 59.3055 29.0221 179.4859 293 S 4.1332 8.1958 113.3805 61.5400 62.5071 176.3965 294 I 3.8335 7.7581 122.2846 64.7622 36.7728 178.6307 295 T 3.9378 8.1438 116.6546 66.5697 68.1103 176.5117 296 D 4.7055 8.4817 121.0524 57.3808 40.9179 178.9537 297 V 3.6148 7.5488 117.9609 66.0421 31.5814 177.8152 298 L 3.8676 7.8519 118.5055 58.0247 41.3278 179.8932 299 V 3.6649 8.0951 117.0817 65.9826 31.6261 178.1529 300 R 4.1036 8.2287 117.3221 59.5151 30.1414 178.7386 301 T 4.2568 7.7926 107.3129 62.8480 69.2891 175.3558 302 K 4.4863 7.7351 120.7272 55.5114 33.6299 178.0265 303 R 3.9036 8.3855 120.6637 60.1030 29.9973 177.9211 304 D 4.4195 8.0566 117.5868 56.5853 40.8490 178.5213 305 W 3.9064 8.0546 128.9286 60.2651 30.8323 177.8043 306 L 3.8196 8.3520 119.3715 57.8207 41.0697 179.7430 307 V 3.5818 7.8249 118.0936 65.8911 31.2512 178.0244 308 K 3.9089 7.5796 118.0047 59.1582 32.2753 177.8739 309 Q 4.0207 7.4375 116.3271 55.3488 28.5331 176.5154 310 R 4.0369 8.0318 118.8304 56.8926 29.0028 177.4729 311 G 3.7267 8.2949 109.0294 46.8967 0.0000 177.7573 312 W 4.3575 8.7508 121.3022 58.9920 29.0350 177.7391 313 D 4.5883 8.3428 119.3859 57.2137 40.3503 178.6467 314 G 4.1937 8.1756 107.7219 47.0764 0.0000 175.4793 315 F 2.4429 7.5391 122.9325 60.5884 39.0874 177.4135 316 V 3.5044 7.6709 116.2913 65.9702 31.7732 177.2393 317 E 4.0048 8.1479 119.0763 59.1781 29.2373 178.5298 318 F 3.9599 7.8509 119.7430 60.7338 39.4251 176.1626 319 F 4.5175 7.1276 114.7305 56.4198 39.2037 175.7832 320 H 4.3457 7.1702 114.4629 55.8031 28.9106 175.9220 321 V 3.8325 8.0422 112.9312 61.6352 32.1112 175.7035 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 172 D 8.22 4.63 0.00 2.77 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 E 8.61 3.85 0.00 2.25 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.56 0.00 174 L 8.19 4.08 0.00 1.90 1.77 1.08 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 175 Y 8.31 4.02 0.00 3.36 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 R 8.17 3.96 0.00 2.17 2.15 0.00 3.18 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.71 0.00 177 Q 8.32 3.90 0.00 2.28 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.58 0.00 0.00 0.00 0.00 0.00 2.09 2.31 0.00 178 S 8.37 4.14 0.00 4.08 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 L 8.00 3.85 0.00 1.28 1.69 0.86 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 180 E 8.10 3.81 0.00 2.11 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.29 0.00 181 I 7.37 3.43 1.04 0.00 0.00 -0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.62 0.23 0.00 0.00 182 I 7.68 3.75 1.91 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.92 0.98 0.00 0.00 183 S 8.26 4.10 0.00 3.99 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 R 8.06 3.89 0.00 1.84 1.97 0.00 3.07 0.00 0.00 3.03 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.89 0.00 185 Y 7.95 4.26 0.00 3.04 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 L 7.90 3.85 0.00 1.92 1.66 1.15 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 187 R 8.20 3.82 0.00 1.92 1.88 0.00 3.07 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 188 E 8.03 4.16 0.00 2.34 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.10 0.00 189 Q 7.77 3.79 0.00 1.90 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 7.01 0.00 0.00 0.00 0.00 0.00 1.61 1.29 0.00 190 A 7.75 4.03 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 T 7.85 3.96 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 192 G 8.61 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 193 A 7.93 4.64 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 K 8.49 4.48 0.00 1.79 1.60 0.00 1.83 0.00 0.00 1.74 0.00 0.00 2.76 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.33 1.00 7.81 195 D 8.51 4.16 0.00 2.69 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *203 G 8.23 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 A 8.43 3.99 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 205 T 7.91 3.85 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 206 S 8.01 3.97 0.00 3.97 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 R 8.03 3.93 0.00 2.01 1.97 0.00 3.12 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.90 0.00 208 K 8.40 4.04 0.00 1.98 1.90 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.64 7.81 209 A 8.43 4.26 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 210 L 7.99 3.90 0.00 1.84 1.82 0.98 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 211 E 8.35 3.97 0.00 2.25 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.62 0.00 212 T 8.20 3.85 4.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 213 L 8.57 3.91 0.00 1.86 1.41 0.90 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 214 R 8.08 4.14 0.00 2.13 2.06 0.00 3.24 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.02 0.00 215 R 7.96 3.85 0.00 1.90 2.02 0.00 3.08 0.00 0.00 3.09 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 216 V 8.10 3.63 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.70 0.00 0.00 217 G 8.05 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 D 8.21 4.63 0.00 2.91 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 219 G 7.94 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 V 8.11 3.62 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.99 0.00 0.00 221 Q 7.77 3.56 0.00 2.33 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.73 0.00 0.00 0.00 0.00 0.00 2.67 2.74 0.00 222 R 7.87 4.02 0.00 1.95 1.94 0.00 3.27 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 223 N 8.10 4.46 0.00 2.68 2.65 0.00 0.00 6.88 7.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 224 H 7.82 4.85 0.00 2.73 3.11 0.00 5.62 0.00 0.00 0.00 0.00 7.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 225 E 8.33 3.77 0.00 2.18 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.67 0.00 226 T 7.89 4.01 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 227 A 7.95 4.03 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 228 F 8.54 4.06 0.00 2.69 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 Q 8.78 4.42 0.00 2.41 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.77 2.91 0.00 230 G 8.53 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 231 M 8.49 4.03 0.00 1.70 2.10 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.34 0.00 232 L 8.47 4.13 0.00 2.23 2.09 0.92 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 233 R 8.19 3.90 0.00 1.95 2.14 0.00 3.34 0.00 0.00 3.26 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.70 0.00 234 K 8.09 4.16 0.00 1.77 1.86 0.00 1.75 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.48 1.65 7.81 235 L 8.13 4.04 0.00 1.85 1.80 1.11 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 236 D 8.23 4.29 0.00 2.88 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 237 I 7.58 4.07 1.89 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.93 1.00 0.00 0.00 238 K 8.70 4.17 0.00 1.76 1.72 0.00 1.83 0.00 0.00 1.75 0.00 0.00 2.96 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.39 1.25 7.81 239 N 7.72 4.92 0.00 2.81 2.92 0.00 0.00 6.36 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 240 E 8.72 3.99 0.00 2.01 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 1.91 0.00 241 D 7.92 4.64 0.00 2.66 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 242 D 7.68 4.65 0.00 2.91 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 243 V 7.40 4.39 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.95 0.00 0.00 244 K 7.96 4.04 0.00 1.81 1.87 0.00 1.68 0.00 0.00 1.88 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.55 1.51 7.81 245 S 8.03 4.17 0.00 4.06 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 246 L 7.91 4.08 0.00 1.94 1.83 0.93 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 247 S 8.33 4.20 0.00 4.06 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 248 R 7.98 3.96 0.00 2.07 1.97 0.00 3.13 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.84 0.00 249 V 7.90 3.58 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.97 0.00 0.00 250 M 7.95 4.02 0.00 2.14 2.17 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.88 2.62 0.00 251 I 7.93 3.96 2.06 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.34 0.95 0.00 0.00 252 H 8.36 4.13 0.00 3.39 3.37 0.00 5.80 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 253 V 7.42 3.35 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.11 0.00 0.00 0.73 0.00 0.00 254 F 7.43 4.67 0.00 3.06 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 255 S 7.96 4.21 0.00 3.93 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 256 D 7.89 4.58 0.00 2.82 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 257 G 8.15 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 258 V 7.86 4.21 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.95 0.00 0.00 259 T 8.05 4.36 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 260 N 7.79 4.84 0.00 2.92 2.85 0.00 0.00 6.27 8.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 261 W 8.48 4.69 0.00 2.42 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 262 G 8.41 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 263 R 9.09 4.03 0.00 2.02 1.84 0.00 3.13 0.00 0.00 2.94 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.93 0.00 264 I 7.86 3.93 2.44 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.76 1.16 0.00 0.00 265 V 8.78 3.95 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.89 0.00 0.00 266 T 8.15 4.09 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 267 L 8.30 4.07 0.00 2.03 1.83 0.96 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 268 I 7.98 3.91 2.02 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.93 1.06 0.00 0.00 269 S 8.67 4.47 0.00 4.38 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 270 F 8.90 4.35 0.00 2.51 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 271 G 8.48 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 272 A 8.21 4.01 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 273 F 8.36 4.10 0.00 3.48 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 274 V 7.86 3.41 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.26 0.00 0.00 275 A 7.89 3.96 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 276 K 7.91 3.81 0.00 1.72 1.69 0.00 1.54 0.00 0.00 1.46 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.53 1.55 7.81 277 H 7.67 3.99 0.00 2.95 3.31 0.00 5.80 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 278 L 7.93 3.90 0.00 1.83 1.67 0.89 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 279 K 7.29 4.81 0.00 1.90 1.81 0.00 1.85 0.00 0.00 1.50 0.00 0.00 3.17 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.55 1.43 7.81 280 T 7.43 3.94 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 281 I 7.65 3.89 1.93 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.67 0.88 0.00 0.00 282 N 8.29 5.01 0.00 2.54 2.60 0.00 0.00 7.19 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 283 Q 8.85 4.03 0.00 2.07 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.89 7.20 0.00 0.00 0.00 0.00 0.00 2.28 1.92 0.00 284 E 7.88 4.61 0.00 1.97 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 1.88 0.00 285 S 7.79 4.24 0.00 3.82 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 286 C 8.59 4.32 0.00 2.98 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 287 I 8.32 4.13 1.84 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.55 0.87 0.00 0.00 288 E 7.76 3.92 0.00 2.09 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.36 0.00 289 P 0.00 4.31 0.00 2.32 2.13 0.00 3.75 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.16 0.00 290 L 7.88 3.96 0.00 1.75 1.84 0.92 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 291 A 7.97 4.02 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 292 E 8.83 3.98 0.00 2.03 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.55 0.00 293 S 8.20 4.13 0.00 4.03 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 294 I 7.76 3.83 2.07 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.91 1.02 0.00 0.00 295 T 8.14 3.94 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 296 D 8.48 4.71 0.00 3.06 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 297 V 7.55 3.61 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 1.00 0.00 0.00 298 L 7.85 3.87 0.00 1.95 1.70 1.04 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 299 V 8.10 3.66 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 1.05 0.00 0.00 300 R 8.23 4.10 0.00 1.97 1.99 0.00 3.22 0.00 0.00 3.30 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.84 0.00 301 T 7.79 4.26 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 302 K 7.74 4.49 0.00 1.69 1.50 0.00 0.97 0.00 0.00 1.21 0.00 0.00 2.39 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.88 0.60 7.81 303 R 8.39 3.90 0.00 2.24 1.95 0.00 3.20 0.00 0.00 3.36 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.78 0.00 304 D 8.06 4.42 0.00 2.73 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 305 W 8.05 3.91 0.00 3.22 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 306 L 8.35 3.82 0.00 1.89 1.67 0.97 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 307 V 7.82 3.58 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.99 0.00 0.00 308 K 7.58 3.91 0.00 1.89 1.57 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.35 1.50 7.81 309 Q 7.44 4.02 0.00 1.74 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 5.75 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 310 R 8.03 4.04 0.00 2.15 2.10 0.00 3.29 0.00 0.00 3.14 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.61 0.00 311 G 8.29 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 312 W 8.75 4.36 0.00 3.48 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 313 D 8.34 4.59 0.00 2.94 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 314 G 8.18 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 315 F 7.54 2.44 0.00 1.79 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 316 V 7.67 3.50 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 1.20 0.00 0.00 317 E 8.15 4.00 0.00 2.16 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.42 0.00 318 F 7.85 3.96 0.00 2.79 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 319 F 7.13 4.52 0.00 2.70 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 320 H 7.17 4.35 0.00 3.27 3.40 0.00 5.50 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 321 V 8.04 3.83 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.91 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.