NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 119 P 4.4019 0.0000 0.0000 62.1832 33.3579 176.4806 120 Q 4.3526 8.0164 116.4751 55.0785 29.0087 173.5631 121 R 4.2681 7.9725 118.2032 55.3560 32.1375 175.9319 122 V 4.6977 8.1824 122.5393 61.6913 32.9441 173.7687 123 A 5.3348 9.0325 127.9137 51.4128 23.4661 174.3836 124 A 4.0830 8.8600 119.1796 51.1319 23.4171 175.7268 125 H 4.7789 7.7841 121.1077 55.0161 33.0656 172.2154 126 I 4.9103 8.5234 120.4231 59.2432 40.8316 174.5238 127 T 5.2733 8.5756 112.7660 60.4804 72.7893 171.6005 128 G 4.5729 8.5843 108.3323 46.1538 0.0000 171.6947 129 T 4.7032 8.2968 113.8808 60.6505 70.4335 174.6670 130 R 3.8993 8.7829 124.3595 55.1689 29.6997 177.5745 131 G 3.9605 8.6117 113.2911 45.1480 0.0000 174.1193 *144 E 4.1644 8.7844 124.9890 55.4608 30.7313 175.5174 145 K 4.3602 8.0336 117.8258 55.8436 32.6902 175.1444 146 A 4.3475 7.3232 119.2544 49.9848 20.7451 177.4981 147 L 4.0002 8.2724 120.6605 55.1157 42.5389 179.6440 148 G 4.0619 8.4534 108.5909 45.7059 0.0000 172.4264 149 R 4.6993 8.5014 117.4647 53.8685 33.7508 175.3564 150 K 4.5852 8.6777 125.1302 56.6097 33.0765 176.0477 151 I 4.0389 8.5976 129.3978 60.6222 37.3288 175.5180 152 N 4.9045 8.5883 123.0351 52.5035 38.2419 174.4185 153 S 4.6030 7.4772 113.6704 58.7323 64.1398 174.0336 154 W 5.0397 7.9562 119.5898 57.7471 29.6955 174.9442 155 E 4.7871 9.2257 121.7533 55.6022 32.7915 174.4739 156 S 4.6364 8.5613 119.3534 57.0043 63.1435 173.9283 157 S 4.5298 8.4890 120.6248 57.4521 66.0244 176.2204 158 R 4.0037 8.8832 125.3457 59.1763 29.9808 178.6002 159 S 4.3171 8.1641 110.6111 59.8353 61.9635 174.7483 160 G 3.8173 8.2555 111.0397 45.1113 0.0000 172.8372 161 H 4.3378 7.8882 113.8336 56.5644 26.9823 174.6942 162 S 5.3470 7.6324 110.8717 56.7617 65.2627 173.1155 163 F 5.1752 8.9239 117.3334 55.3654 42.0971 173.2231 164 L 4.7891 8.5845 117.9461 53.2094 45.2576 176.5163 165 S 4.4125 8.8849 118.2073 56.7495 64.7441 173.1968 166 N 4.2876 10.0520 125.5697 53.5313 35.1844 174.2181 167 L 4.3574 7.4668 114.6489 54.2696 46.0760 173.8624 168 H 5.0093 8.4636 115.7120 54.3063 32.7129 171.4929 169 L 5.1072 8.4385 120.5722 53.5304 44.0263 175.9982 170 R 4.3580 9.1731 126.3459 56.2280 32.4277 174.5334 171 N 4.2145 9.7581 125.2229 54.5708 36.0171 175.2511 172 G 4.1672 8.5026 101.6797 46.0703 0.0000 173.0517 173 E 5.1975 8.0554 119.2198 54.2551 32.6501 175.1943 174 L 4.5644 9.0051 124.6088 54.2433 42.9749 175.8948 175 V 4.5157 8.8260 125.1015 61.5309 33.3970 175.1226 176 I 3.9862 8.5997 128.8532 61.6786 38.0104 175.8577 177 H 4.7215 8.9945 121.5647 56.7051 30.9986 174.2708 178 E 4.8549 8.1802 118.2769 53.7785 31.2428 175.9309 179 K 4.4953 8.9971 126.5501 56.4087 33.8857 177.3822 180 G 3.6996 7.9142 108.7484 45.5628 0.0000 170.3950 181 F 5.3536 7.6717 118.3782 57.2694 40.2838 174.6973 182 Y 5.0702 9.2918 121.6881 56.2368 41.4751 174.1690 183 Y 4.6251 8.6098 126.1054 56.9885 39.9425 173.9769 184 I 4.9859 8.2922 128.5672 59.8937 40.0957 174.4882 185 Y 5.1024 8.2394 122.6884 56.4174 42.1401 173.3188 186 S 5.0589 8.1977 111.8605 57.5362 66.7263 173.2756 187 Q 5.1677 8.7952 126.8884 54.3704 32.1367 173.9508 188 T 4.7577 8.9340 116.2678 60.0395 71.8824 172.3078 189 Y 5.0604 8.7215 128.8398 56.4469 39.8846 174.0122 190 F 4.8397 9.3143 127.3198 56.7967 40.5092 175.2674 191 R 5.0125 9.1221 124.7629 54.6889 32.8672 174.0127 192 F 4.9412 8.6791 120.1574 55.7675 41.7326 173.0533 193 Q 5.1434 8.6911 122.2317 54.2509 28.0372 174.3255 194 E 4.4280 8.8833 120.4126 55.6535 31.1948 176.7427 195 E 4.5957 8.4920 121.3183 54.1716 32.3480 175.7498 196 I 3.8644 8.3810 126.8673 61.2093 35.4920 175.8298 197 K 4.0294 8.2073 124.3468 56.1089 32.4185 175.9168 198 E 3.9632 8.0832 121.5220 58.3881 29.7559 176.2838 199 N 4.7173 8.1046 119.8990 52.9787 39.4393 174.4037 200 T 4.4732 7.1364 111.4245 62.6018 72.7177 173.9958 201 K 4.3295 8.3597 122.8435 56.3569 32.8656 176.6778 202 N 4.7718 8.3363 116.9439 52.9284 40.3655 174.4158 203 D 3.7857 7.9288 117.4635 54.0219 39.8623 175.5497 204 K 4.3571 8.0549 122.5639 54.4134 35.2870 175.2642 205 Q 4.4693 8.4082 123.0501 54.5508 30.4528 174.9662 206 M 3.7528 8.4347 125.9751 53.5749 33.4030 175.8146 207 V 4.5840 8.2167 123.5356 60.8695 35.4132 173.7353 208 Q 5.0269 8.6363 128.3913 54.4946 31.5596 173.5876 209 Y 5.1081 9.3566 123.6536 56.1503 41.7338 174.5990 210 I 4.6502 8.6391 124.4372 59.8906 39.8869 174.4908 211 Y 4.8671 8.1724 125.0395 55.7332 41.2551 174.9656 212 K 5.0800 8.5710 119.1865 55.4619 36.3970 174.6636 213 Y 4.9149 9.3100 121.0370 57.0342 39.9650 174.8334 214 T 5.4559 8.7144 120.5563 59.5946 70.3632 173.1711 215 S 4.6182 8.5389 112.1045 58.7432 62.8707 173.4126 216 Y 4.8200 7.6554 119.6120 56.0438 42.0295 172.4853 217 P 4.3094 0.0000 0.0000 65.3084 31.6215 176.3889 218 D 5.0069 7.4118 116.1216 51.8158 42.3948 174.4211 219 P 4.1676 0.0000 0.0000 62.9644 32.3068 175.3998 220 I 4.5211 8.5314 123.3517 59.2397 39.6583 174.7327 221 L 3.5512 8.6026 129.7872 55.2887 42.0372 175.9372 222 L 4.0916 8.2384 126.5826 56.3881 42.8009 176.8855 223 M 4.9881 7.2436 116.5891 53.5259 36.6769 174.1429 224 K 4.9621 8.3639 119.5738 55.5281 36.2695 175.4846 225 S 4.6024 8.7235 116.6579 56.8778 65.7002 172.5047 226 A 5.2747 8.5987 127.5330 50.4272 22.3742 174.9349 227 R 4.7713 8.7409 117.0608 54.6563 35.0443 174.0632 228 N 5.2879 8.4722 118.9840 50.8321 39.7314 174.6035 229 S 3.9467 7.8425 115.8120 57.6221 64.2287 173.5935 230 C 4.1877 8.8742 121.8681 60.0053 31.6547 174.0567 231 W 4.4959 8.8438 125.3143 58.0948 29.6795 176.9676 232 S 4.2635 8.2185 113.8283 58.3450 62.1060 174.8515 233 K 4.2664 8.6138 125.1772 58.8328 32.7356 177.2601 234 D 4.5383 7.8989 118.4142 54.6900 41.1909 176.5240 235 A 4.0356 7.6961 123.4255 52.4516 18.4554 177.0481 236 E 4.7307 8.4999 121.7120 57.5317 32.1271 175.1298 237 Y 5.0939 7.1164 114.9710 56.0193 41.4188 174.3692 238 G 3.6522 8.3664 106.1955 44.2285 0.0000 171.6320 239 L 5.0385 8.0254 123.9634 53.2969 44.4366 176.1911 240 Y 4.7510 9.5697 122.5873 56.2783 40.0035 173.5942 241 S 5.1904 8.7156 118.9202 57.9198 64.3891 173.3116 242 I 4.7190 9.0097 125.3634 59.6757 39.8495 173.9801 243 Y 5.5586 8.9496 127.3241 54.9944 42.0284 174.0669 244 Q 4.6398 7.1594 121.5284 55.5985 32.1169 172.8318 245 G 4.0933 8.0321 105.0262 46.1642 0.0000 172.5290 246 G 4.1893 7.6538 106.1264 45.6975 0.0000 172.3667 247 I 4.9370 8.1244 121.4828 60.0457 38.4147 175.6048 248 F 4.8312 9.2265 124.9352 55.5018 43.5138 173.5175 249 E 5.0114 9.1673 123.7377 56.0155 30.4315 175.4871 250 L 5.0613 9.2468 127.1388 52.9665 45.1538 176.5137 251 K 4.6894 9.3855 123.0306 55.0016 34.2042 176.0908 252 E 4.1390 8.5333 122.7801 57.9729 29.9187 176.7883 253 N 4.5965 8.8622 122.2379 53.3038 36.7649 174.3639 254 D 4.8515 7.9075 118.8100 54.4108 42.4844 175.4844 255 R 5.1566 9.1401 119.7127 54.4131 34.1175 174.5909 256 I 5.2709 8.8937 116.4867 59.2922 40.7970 174.3481 257 F 5.4046 9.0146 118.8597 55.7826 42.0638 172.8344 258 V 4.7018 8.4086 118.7943 61.2081 33.9814 174.1442 259 S 5.3520 9.4514 121.8046 56.8298 66.0534 172.9635 260 V 5.8840 9.2278 118.4370 58.9061 36.1851 175.1242 261 T 4.5853 8.8035 113.0794 60.2117 70.8188 173.6160 262 N 4.2565 8.6615 116.4296 53.8478 36.3625 176.1272 263 E 3.9054 8.1859 116.8479 59.6033 29.9828 178.9101 264 H 4.3479 8.2951 113.2630 57.3651 28.9546 175.4712 265 L 4.5605 7.9135 119.7878 54.6703 42.8349 176.2361 266 I 4.0566 7.5542 121.4711 60.9989 37.8198 174.9860 267 D 4.6110 8.7009 127.6530 52.8485 41.7576 175.5022 268 M 4.4939 8.5328 125.2822 55.2555 32.3675 176.2422 269 D 4.5440 8.4873 120.4999 54.9014 41.3568 177.6901 270 H 4.4903 8.9967 118.7270 58.1436 28.6479 176.0932 271 E 4.4081 8.0735 117.9742 57.4467 30.0138 176.8115 272 A 4.4265 8.1134 120.8508 53.1003 19.8376 177.5296 273 S 4.9969 7.9689 110.7385 56.9375 66.4683 173.6913 274 F 5.1672 8.7365 118.1220 56.5387 41.8827 172.4590 275 F 5.1076 8.4207 120.4931 56.9805 42.8527 173.2677 276 G 3.7486 8.0775 111.2846 45.8389 0.0000 171.2832 277 A 5.7738 8.7536 119.5038 52.2884 23.1603 175.4608 278 F 5.5370 8.2495 112.9035 55.3378 41.4694 173.2606 279 L 3.7990 8.6082 124.3259 54.6007 42.3252 177.8245 280 V 4.5944 8.4265 122.5735 60.6646 31.1246 176.3015 281 G 3.8052 8.0731 113.7160 45.9657 0.0000 173.5851 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 119 P 0.00 4.40 0.00 2.07 2.18 0.00 3.63 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.12 0.00 120 Q 8.02 4.35 0.00 2.12 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.81 0.00 0.00 0.00 0.00 0.00 2.30 2.40 0.00 121 R 7.97 4.27 0.00 1.83 1.90 0.00 3.15 0.00 0.00 3.15 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 122 V 8.18 4.70 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 1.20 0.00 0.00 1.00 0.00 0.00 123 A 9.03 5.33 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 A 8.86 4.08 0.91 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 0.00 0.00 0.00 0.00 0.00 125 H 7.78 4.78 0.00 3.25 2.99 0.00 5.72 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 0.00 126 I 8.52 4.91 1.83 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 -0.11 0.71 0.00 0.00 127 T 8.58 5.27 4.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 128 G 8.58 4.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 T 8.30 4.70 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 1.24 0.00 0.00 130 R 8.78 3.90 0.00 1.81 1.92 0.00 3.08 0.00 0.00 3.22 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 131 G 8.61 3.96 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 0.00 0.00 0.00 0.00 0.00 0.00 *144 E 8.78 4.16 0.00 1.97 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 2.16 2.26 0.00 145 K 8.03 4.36 0.00 1.67 1.71 0.00 1.75 0.00 0.00 1.95 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.29 1.37 7.81 146 A 7.32 4.35 0.33 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 0.00 147 L 8.27 4.00 0.00 0.39 1.15 0.71 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 148 G 8.45 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 149 R 8.50 4.70 0.00 1.69 1.77 0.00 3.14 0.00 0.00 3.38 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.55 0.00 150 K 8.68 4.59 0.00 1.60 1.57 0.00 1.44 0.00 0.00 0.70 0.00 0.00 2.60 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.33 1.63 7.81 151 I 8.60 4.04 1.54 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.55 -0.24 0.00 0.00 152 N 8.59 4.90 0.00 2.74 2.81 0.00 0.00 6.29 7.64 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 0.00 153 S 7.48 4.60 0.00 3.99 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 W 7.96 5.04 0.00 3.26 3.06 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 0.00 0.00 0.00 155 E 9.23 4.79 0.00 2.03 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.32 0.00 156 S 8.56 4.64 0.00 3.89 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 0.00 157 S 8.49 4.53 0.00 4.00 3.96 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 0.00 0.00 0.00 158 R 8.88 4.00 0.00 1.92 2.08 0.00 3.14 0.00 0.00 3.42 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.69 0.00 159 S 8.16 4.32 0.00 3.96 3.99 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 0.00 0.00 0.00 160 G 8.26 3.82 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 0.00 0.00 0.00 161 H 7.89 4.34 0.00 3.43 3.40 0.00 5.62 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 S 7.63 5.35 0.00 3.85 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 F 8.92 5.18 0.00 3.08 3.15 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 0.00 164 L 8.58 4.79 0.00 1.52 1.74 0.94 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 165 S 8.88 4.41 0.00 4.14 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 0.00 166 N 10.05 4.29 0.00 3.03 3.06 0.00 0.00 6.98 7.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 L 7.47 4.36 0.00 1.36 1.37 1.04 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 168 H 8.46 5.01 0.00 3.11 3.40 0.00 5.23 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 L 8.44 5.11 0.00 1.67 1.64 1.04 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 170 R 9.17 4.36 0.00 1.97 1.78 0.00 3.38 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.67 0.00 171 N 9.76 4.21 0.00 2.87 2.82 0.00 0.00 7.17 7.65 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 0.00 172 G 8.50 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 0.00 0.00 0.00 0.00 173 E 8.06 5.20 0.00 2.16 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.61 0.00 174 L 9.01 4.56 0.00 1.40 1.34 -0.11 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 175 V 8.83 4.52 1.61 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 1.00 0.00 0.00 0.87 0.00 0.00 176 I 8.60 3.99 1.92 0.00 0.00 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.42 0.87 0.00 0.00 177 H 8.99 4.72 0.00 3.17 3.35 0.00 5.67 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 E 8.18 4.85 0.00 2.07 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.27 0.00 179 K 9.00 4.50 0.00 1.97 1.84 0.00 1.78 0.00 0.00 1.72 0.00 0.00 2.91 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.41 1.43 7.81 180 G 7.91 3.70 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 0.00 0.00 0.00 181 F 7.67 5.35 0.00 2.96 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 Y 9.29 5.07 0.00 2.96 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 0.00 183 Y 8.61 4.63 0.00 2.76 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 0.00 184 I 8.29 4.99 1.80 0.00 0.00 0.87 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 0.80 0.85 0.00 0.00 185 Y 8.24 5.10 0.00 2.92 2.99 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 0.00 0.00 0.00 186 S 8.20 5.06 0.00 3.89 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 187 Q 8.80 5.17 0.00 2.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.53 0.00 0.00 0.00 0.00 0.00 2.20 2.45 0.00 188 T 8.93 4.76 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 1.24 0.00 0.00 189 Y 8.72 5.06 0.00 3.19 3.06 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 0.00 0.00 0.00 190 F 9.31 4.84 0.00 3.37 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 0.00 191 R 9.12 5.01 0.00 0.67 1.20 0.00 3.13 0.00 0.00 2.65 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.37 0.00 192 F 8.68 4.94 0.00 3.14 3.06 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 0.00 0.00 0.00 193 Q 8.69 5.14 0.00 2.10 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 7.04 0.00 0.00 0.00 0.00 0.00 2.30 2.39 0.00 194 E 8.88 4.43 0.00 1.97 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 0.00 2.63 2.41 0.00 195 E 8.49 4.60 0.00 1.91 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 2.20 2.38 0.00 196 I 8.38 3.86 1.89 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.95 0.93 0.00 0.00 197 K 8.21 4.03 0.00 1.72 1.76 0.00 1.75 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.59 1.36 7.81 198 E 8.08 3.96 0.00 1.91 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.35 0.00 199 N 8.10 4.72 0.00 2.70 2.76 0.00 0.00 6.75 7.70 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 0.00 200 T 7.14 4.47 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 201 K 8.36 4.33 0.00 1.74 1.87 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.46 1.43 7.81 202 N 8.34 4.77 0.00 2.59 2.72 0.00 0.00 7.02 8.47 0.00 0.00 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 D 7.93 3.79 0.00 1.82 1.77 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.05 4.36 0.00 1.31 1.34 0.00 0.84 0.00 0.00 0.88 0.00 0.00 2.13 0.00 0.00 2.47 0.00 0.00 0.00 0.00 1.00 1.23 7.81 205 Q 8.41 4.47 0.00 1.79 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.85 0.00 0.00 0.00 0.00 0.00 2.14 2.21 0.00 206 M 8.43 3.75 0.00 0.51 1.21 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.51 0.00 207 V 8.22 4.58 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.12 0.00 0.00 nan 0.00 0.00 208 Q 8.64 5.03 0.00 2.21 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.53 0.00 0.00 0.00 0.00 0.00 2.18 2.28 0.00 209 Y 9.36 5.11 0.00 2.98 2.37 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.64 4.65 1.61 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.69 0.78 0.00 0.00 211 Y 8.17 4.87 0.00 1.43 1.88 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 0.00 212 K 8.57 5.08 0.00 1.81 1.69 0.00 1.28 0.00 0.00 1.60 0.00 0.00 2.80 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.34 1.37 7.81 213 Y 9.31 4.91 0.00 3.07 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 0.00 214 T 8.71 5.46 4.32 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 0.00 0.00 0.00 1.36 0.00 0.00 215 S 8.54 4.62 0.00 4.08 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 Y 7.66 4.82 0.00 2.90 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 P 0.00 4.31 0.00 1.74 1.98 0.00 2.56 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.97 0.00 218 D 7.41 5.01 0.00 2.92 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 0.00 219 P 0.00 4.17 0.00 1.51 0.97 0.00 3.73 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.76 0.00 220 I 8.53 4.52 1.82 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.95 0.84 0.00 0.00 221 L 8.60 3.55 0.00 1.23 1.39 0.17 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 222 L 8.24 4.09 0.00 0.98 0.13 0.41 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 223 M 7.24 4.99 0.00 2.05 1.72 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.66 0.00 224 K 8.36 4.96 0.00 1.53 1.73 0.00 1.67 0.00 0.00 1.73 0.00 0.00 2.69 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.27 1.34 7.81 225 S 8.72 4.60 0.00 4.03 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 226 A 8.60 5.27 1.07 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 0.00 227 R 8.74 4.77 0.00 1.54 1.68 0.00 3.32 0.00 0.00 3.37 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.82 0.00 228 N 8.47 5.29 0.00 2.45 2.72 0.00 0.00 6.12 7.64 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 0.00 229 S 7.84 3.95 0.00 3.91 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 0.00 230 C 8.87 4.19 0.00 3.06 2.98 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.84 4.50 0.00 3.25 3.21 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 0.00 232 S 8.22 4.26 0.00 3.91 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 0.00 233 K 8.61 4.27 0.00 1.94 1.96 0.00 1.64 0.00 0.00 1.73 0.00 0.00 3.01 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.49 7.81 234 D 7.90 4.54 0.00 2.73 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 235 A 7.70 4.04 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 236 E 8.50 4.73 0.00 1.96 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 0.00 2.34 2.44 0.00 237 Y 7.12 5.09 0.00 2.93 2.88 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 0.00 238 G 8.37 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 0.00 239 L 8.03 5.04 0.00 1.43 1.76 0.99 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 240 Y 9.57 4.75 0.00 3.04 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 0.00 241 S 8.72 5.19 0.00 3.80 3.82 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 0.00 242 I 9.01 4.72 2.07 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.29 0.98 0.00 0.00 243 Y 8.95 5.56 0.00 3.21 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 0.00 244 Q 7.16 4.64 0.00 2.09 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.61 0.00 0.00 0.00 0.00 0.00 2.17 2.22 0.00 245 G 8.03 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.65 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 0.00 247 I 8.12 4.94 1.62 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.71 0.79 0.00 0.00 248 F 9.23 4.83 0.00 3.00 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 249 E 9.17 5.01 0.00 2.43 2.07 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 2.38 2.36 0.00 250 L 9.25 5.06 0.00 1.61 1.45 0.59 0.92 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 0.00 251 K 9.39 4.69 0.00 1.90 1.76 0.00 1.72 0.00 0.00 1.61 0.00 0.00 2.85 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.47 1.43 7.81 252 E 8.53 4.14 0.00 1.97 1.89 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 2.33 2.50 0.00 253 N 8.86 4.60 0.00 2.99 3.06 0.00 0.00 7.06 8.15 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 0.00 254 D 7.91 4.85 0.00 2.82 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 R 9.14 5.16 0.00 1.98 1.96 0.00 3.09 0.00 0.00 3.31 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.71 0.00 256 I 8.89 5.27 1.99 0.00 0.00 0.62 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 0.74 0.83 0.00 0.00 257 F 9.01 5.40 0.00 3.15 3.27 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 0.00 0.00 0.00 0.00 258 V 8.41 4.70 2.14 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 1.08 0.00 0.00 -0.23 0.00 0.00 259 S 9.45 5.35 0.00 4.28 4.06 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 0.00 0.00 0.00 260 V 9.23 5.88 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.40 0.00 0.00 0.92 0.00 0.00 261 T 8.80 4.59 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 262 N 8.66 4.26 0.00 3.01 2.84 0.00 0.00 6.53 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 0.00 263 E 8.19 3.91 0.00 2.09 2.23 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 2.40 2.32 0.00 264 H 8.30 4.35 0.00 3.28 3.45 0.00 5.51 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 265 L 7.91 4.56 0.00 1.79 1.91 0.65 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 266 I 7.55 4.06 1.75 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.47 0.67 0.00 0.00 267 D 8.70 4.61 0.00 2.39 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 268 M 8.53 4.49 0.00 2.02 2.04 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.38 0.00 269 D 8.49 4.54 0.00 2.90 2.87 0.00 0.00 0.00 0.00 0.00 0.00 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 H 9.00 4.49 0.00 3.55 3.59 0.00 5.52 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 271 E 8.07 4.41 0.00 2.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.29 0.00 272 A 8.11 4.43 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.97 5.00 0.00 3.85 3.87 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.74 5.17 0.00 2.98 3.23 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 0.00 275 F 8.42 5.11 0.00 1.81 1.45 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.08 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 277 A 8.75 5.77 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 278 F 8.25 5.54 0.00 3.19 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 279 L 8.61 3.80 0.00 1.45 1.56 0.26 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 280 V 8.43 4.59 2.17 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 0.82 0.00 0.00 1.03 0.00 0.00 281 G 8.07 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.