NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 64 K 3.8217 8.3149 120.0947 54.8783 33.4759 176.1443 65 W 4.9273 5.6825 122.3071 55.2830 32.9375 174.0199 66 T 5.0255 8.9854 121.8763 61.8494 69.9958 173.7733 67 S 4.6427 9.0600 122.1851 57.9101 64.0391 172.7570 68 A 5.1609 9.3052 126.6484 50.3414 22.7439 174.8194 69 A 5.0661 9.5363 121.3501 50.1292 23.4799 175.1348 70 V 4.8891 9.0243 119.8190 61.2647 34.1789 175.0852 71 V 5.1193 8.8745 120.4837 60.1876 35.4137 174.4811 72 T 4.8450 8.7180 115.6571 59.8673 71.1413 171.2717 73 P 4.4083 0.0000 0.0000 62.2500 31.9097 174.5106 74 P 4.4871 0.0000 0.0000 62.6533 32.4722 175.7632 75 E 4.2539 8.5704 120.0570 54.9995 30.7853 175.9485 76 P 4.1686 0.0000 0.0000 66.3122 31.1547 179.3207 77 V 3.6835 7.7301 109.0773 64.0351 31.5730 177.6943 78 Q 4.3146 8.3192 116.4210 56.7233 29.0623 176.6893 79 W 4.4186 8.2318 129.4554 57.0821 31.1094 176.9080 80 Q 3.9329 7.8806 119.5318 59.9560 28.3719 177.6320 81 E 3.8358 7.9810 119.0955 59.4076 29.4830 179.2267 82 L 3.2683 7.2153 118.4309 57.3414 41.3057 178.9982 83 E 3.6949 7.4896 118.4130 58.8258 29.9345 178.7697 84 K 4.0690 7.7503 118.9204 59.7067 31.6754 179.4588 85 T 3.9775 7.3705 109.6952 64.5581 68.7721 176.7406 86 F 4.5597 7.9940 120.6939 60.6677 38.6873 177.6318 87 T 4.0769 7.8514 115.6551 66.1570 68.0001 177.0182 88 K 4.0689 8.0294 120.2610 59.6005 32.6561 178.9475 89 L 4.0782 7.6367 119.5583 57.1303 41.6806 179.0293 90 R 4.2746 7.9930 120.3592 58.9194 29.7739 178.7585 91 V 3.7193 7.5087 117.2377 65.1739 31.4543 176.7278 92 L 4.4891 6.9721 117.1800 54.3834 42.1679 176.4891 93 D 4.4370 7.8586 115.9901 54.4132 40.2641 173.1746 94 L 4.4728 8.1478 120.4137 53.1323 42.7312 174.9394 95 D 4.8452 8.4793 126.8859 53.1957 41.6190 176.3969 96 I 4.4789 7.7633 123.9060 59.5104 41.2415 174.3951 97 K 3.9477 7.8736 123.4212 54.6436 35.1189 175.6528 98 I 4.3733 8.3769 125.7518 59.1895 38.1834 175.4985 99 D 4.4129 8.5946 125.7220 54.1724 42.1121 176.6548 100 R 3.2762 8.4092 126.0779 59.6406 29.9402 179.1357 101 T 4.0048 7.7941 114.9050 66.4177 68.6980 176.7379 102 E 4.0586 8.0649 119.3217 59.2234 29.4855 179.1521 103 A 4.2130 8.3263 121.0254 55.0522 18.4033 179.4839 104 F 4.4452 8.0102 120.6376 61.1834 39.7327 177.1833 105 N 4.2480 8.8346 115.9533 55.4920 38.2340 176.8116 106 L 4.1205 7.7772 121.6666 57.1276 42.2096 178.3932 107 F 3.9846 8.0203 120.8981 61.2412 39.3635 176.9800 108 I 3.0570 7.4841 119.4997 63.9813 36.5490 178.1612 109 K 3.7574 7.3136 118.5074 59.7046 32.1227 178.6819 110 K 4.0170 7.7725 117.0539 59.0778 32.0201 178.8966 111 F 3.8239 8.1061 121.4561 61.3550 39.1851 177.0858 112 Q 4.5059 8.0934 115.3542 56.6957 28.7296 176.5157 113 S 4.3180 7.5243 116.3570 57.3887 62.5968 174.5530 114 V 3.5826 8.5697 128.3727 66.3980 31.2195 177.9730 115 S 4.2347 8.0088 114.3387 61.3316 62.7314 176.4815 116 L 4.1030 8.0294 121.9265 57.5991 41.3664 179.0582 117 L 3.6455 7.8982 120.2560 58.3176 41.9748 178.8110 118 E 3.8545 8.4671 118.7342 59.4977 29.1568 179.0694 119 E 3.9381 8.0002 118.2907 59.2419 29.9558 178.0806 120 Y 3.7226 7.9071 119.5175 60.4795 38.8790 177.6191 121 L 3.4002 7.6440 119.8309 57.9955 41.5639 180.0100 122 R 3.9442 7.7844 116.3602 58.4032 29.9483 178.2099 123 S 4.7235 7.3245 111.8219 57.0075 63.5994 173.4928 124 S 4.4541 7.2812 118.5524 56.1686 62.8468 172.4595 125 P 4.2012 0.0000 0.0000 66.0629 31.4430 176.9114 126 Y 4.1423 8.3624 118.3683 60.7769 38.4550 178.6031 127 V 3.6433 7.7141 118.6055 65.9905 31.8524 176.9877 128 M 4.3699 8.0254 116.1548 56.2362 31.6504 176.7849 129 D 4.4269 7.6870 121.8422 57.4777 41.4859 179.3194 130 Q 4.0895 7.5485 122.1101 55.4630 25.7847 177.7239 *137 D 4.7781 8.0794 119.6409 52.3664 43.2990 175.3941 138 E 4.6547 7.8607 119.5266 57.7326 28.5512 176.8081 139 L 4.7464 8.6883 125.5824 55.5292 42.2596 177.4361 140 D 4.4719 8.0858 121.9107 56.7119 40.5340 177.7874 141 L 3.8052 8.0042 121.0132 58.6847 41.8992 178.0353 142 H 3.9841 8.3498 117.1902 59.7271 29.5699 176.8465 143 R 3.9023 8.1074 118.6359 59.1793 29.8270 178.7617 144 A 3.9414 7.8622 120.3430 55.1930 18.3559 179.4323 145 I 3.6005 7.8335 118.5264 64.8370 37.0281 178.5609 146 V 3.3655 7.8462 117.4786 66.0949 31.0125 177.7422 147 A 4.1206 8.1435 120.4203 55.0975 18.2488 179.5234 148 L 4.0825 8.6215 118.2806 58.1171 41.6341 179.8087 149 S 4.0897 8.8380 114.6797 61.6823 62.4555 176.0963 150 E 4.1724 7.8345 119.4557 57.7825 29.5930 178.0884 151 K 4.4371 8.3688 118.4548 55.8783 32.6545 175.7247 152 M 5.1118 7.5896 120.6118 55.1871 32.6203 176.0872 153 K 5.0180 9.8214 122.6157 54.6757 36.6667 175.2520 154 A 5.3086 8.7536 123.8469 50.6347 22.1759 175.6250 155 V 4.2322 9.1703 122.6534 60.7547 35.0987 174.0970 156 D 3.3700 7.3030 127.2840 53.6841 41.5221 176.6208 157 D 4.3469 8.4421 125.8593 56.1287 41.0842 176.7168 158 N 4.6742 8.7950 115.3317 52.9372 39.6697 175.8941 159 A 3.9850 7.4573 121.6704 55.0897 19.1767 178.8186 160 S 4.3864 7.6944 112.5519 56.4409 61.3251 173.8205 161 K 4.1870 6.8878 119.4799 53.7426 35.4954 177.1145 162 K 4.0753 8.2564 122.2256 57.2543 30.9230 178.8896 163 K 3.9471 8.5893 126.5327 56.7335 31.7413 174.6056 164 D 4.6352 7.9272 114.6285 55.8442 41.6308 176.2540 165 E 4.5588 8.1596 118.8677 53.9581 28.9903 173.8654 166 P 4.3397 0.0000 0.0000 62.2515 32.4052 176.2629 167 S 4.4319 8.0411 114.8330 56.8354 63.6385 173.9544 168 L 4.0741 8.3024 125.9741 57.6355 41.8261 176.2466 169 Y 4.9070 6.6015 112.7906 55.2868 41.2619 174.0051 170 T 4.4536 8.4082 117.0435 62.7917 69.8077 174.6827 171 S 5.2526 8.3840 118.9383 56.9365 66.8692 172.7643 172 W 5.2626 9.7040 121.2008 55.3711 33.2447 174.2989 173 T 5.0465 9.1836 120.1611 62.1350 70.1429 173.5436 174 L 5.4008 8.9353 127.1738 53.1976 44.6192 175.7768 175 S 5.7709 9.0612 115.8928 57.4192 67.0236 172.7521 176 F 5.9385 8.7842 122.5441 56.2852 42.9896 172.9010 177 T 5.0198 7.8378 121.3447 61.8066 71.0715 173.0734 178 A 4.3367 8.8494 126.7419 50.3476 23.1422 175.1804 179 P 4.1768 0.0000 0.0000 66.1792 31.5905 178.4786 180 T 4.3691 7.7535 114.8777 63.5915 70.6494 175.6503 181 S 4.3010 8.4135 118.2591 61.2065 63.4339 176.2923 182 E 3.9738 8.0814 122.5717 58.7611 29.4148 178.1690 183 E 4.2042 8.5686 120.3323 58.6024 29.8999 178.2344 184 A 4.2129 7.8155 120.6101 55.6045 18.4715 179.4999 185 Q 4.1076 8.0139 119.0310 58.9991 29.1145 178.4163 186 T 3.7853 8.0059 116.8990 66.5482 68.3623 176.9322 187 V 3.6201 7.8246 120.2254 65.7130 31.5682 177.8223 188 L 4.0245 7.9205 119.6426 58.3732 41.9489 179.0741 189 S 4.3563 8.2473 115.2298 61.6615 62.7184 177.0206 190 G 4.2566 8.2428 109.6926 47.4221 0.0000 175.1563 191 Y 2.8471 7.9817 122.0574 60.0947 38.7667 177.7546 192 I 3.7681 7.8685 120.6489 64.9541 37.3625 177.9372 193 D 4.5747 8.4478 119.4227 57.7454 40.7157 178.7324 194 Y 4.0471 7.6772 119.5545 60.6663 38.8297 177.6215 195 I 3.4271 7.9665 121.1745 64.1393 36.9650 178.4418 196 S 4.1620 8.6491 116.2846 61.8357 62.8301 176.5731 197 A 3.8244 7.8883 123.0757 55.0884 17.9700 179.7451 198 L 3.6987 7.5086 117.1416 57.8943 41.7580 179.6100 199 V 3.5695 7.7418 118.1093 66.1358 31.4651 178.0046 200 V 3.3342 7.7169 118.0399 65.7877 31.1525 177.7863 201 K 3.8750 7.8020 118.9067 59.6686 32.0597 178.6067 202 E 3.9542 8.1805 118.6749 59.5873 29.2160 179.4597 203 S 4.2495 8.6561 115.5300 61.8963 62.9508 176.9365 204 I 3.8685 8.0659 122.3411 64.0510 36.8819 177.9567 205 E 3.9750 8.3996 120.4835 59.1388 29.3220 178.5941 206 N 4.2923 8.5895 117.0552 56.3385 38.7028 177.3344 207 V 3.5584 7.4676 119.3025 66.1710 31.5760 178.1496 208 R 3.9405 8.0520 117.6098 59.3852 29.9241 178.7126 209 N 4.3256 8.2319 116.1735 56.4561 38.4917 177.6311 210 K 3.9786 8.4527 120.1595 59.3030 32.0367 179.2190 211 L 3.9417 7.9678 120.8012 57.8952 41.9184 178.5919 212 E 3.9346 8.5437 119.9073 59.1450 29.5293 178.8829 213 I 3.6930 7.8742 119.8273 64.3162 37.2567 178.1619 214 K 3.9180 8.2491 120.6022 60.0171 31.9784 178.8426 215 T 3.8926 8.1230 115.9193 66.5257 68.3307 176.4601 216 Q 3.9037 8.2596 121.5787 59.2535 29.1110 177.6371 217 F 4.0765 8.8682 121.8965 61.7263 39.4046 176.8596 218 E 3.8901 8.5802 117.8367 59.2245 29.1806 179.4436 219 K 3.8933 7.9913 119.6158 59.6307 32.4210 178.8190 220 E 3.9159 8.2258 118.8903 59.0543 29.2793 179.1968 221 K 3.7494 8.0322 120.2609 59.0340 32.1409 178.7367 222 L 3.9007 7.8444 120.7485 57.8951 41.6618 178.7731 223 A 4.0100 7.7450 121.0277 54.8665 18.1861 179.4855 224 Q 3.8757 7.8986 117.9140 59.5237 29.1678 178.1516 225 D 4.3290 8.3301 120.2844 57.3219 40.8001 179.0043 226 R 3.9585 8.0961 118.7884 59.1463 29.9454 179.1908 227 I 3.7559 7.4965 119.3855 64.2935 37.1403 178.5307 228 K 3.9150 8.2540 119.5242 59.6779 31.7248 179.0657 229 M 4.0520 7.9942 118.5797 58.3163 32.1479 178.2141 230 K 3.9340 8.1074 119.9283 59.3539 32.3115 178.4495 231 N 4.3023 8.3700 117.0077 56.4274 38.5083 177.2078 232 Q 3.9621 7.9308 119.2015 58.9682 28.8699 178.4926 233 L 3.9264 8.1367 121.5056 58.4782 42.0442 178.8605 234 D 4.2814 8.2799 118.2483 57.3528 40.8293 178.4371 235 A 4.0040 8.0928 121.2524 55.5561 18.3807 179.5297 236 N 4.3882 8.7317 114.9803 56.2728 38.5365 177.8429 237 I 3.7562 8.2509 122.0202 64.3099 37.1484 178.4417 238 Q 3.7424 7.9915 118.9329 58.7989 28.4531 178.6112 239 R 4.1857 8.0507 119.7659 59.5632 30.0489 178.3527 240 L 4.0556 7.9764 120.1038 57.7496 42.0509 178.1859 241 N 4.1952 8.1403 117.2215 57.0666 38.7518 176.4103 242 Y 4.2731 7.5880 117.8647 61.0633 37.8766 178.4460 243 S 4.2222 8.5935 116.6025 61.7862 62.9529 176.2665 244 L 3.9041 8.2409 122.9429 58.6296 41.7303 178.7516 245 D 4.3599 8.0660 118.2564 57.6546 40.8194 179.1072 246 I 3.6805 8.0664 120.2122 64.0722 37.1624 178.3733 247 A 3.9789 8.6048 122.0431 55.2525 18.2392 179.2916 248 N 4.2462 8.4756 115.0896 56.6286 38.4319 177.5511 249 A 4.0193 8.0238 120.5355 54.5988 18.5434 178.6600 250 A 4.3209 7.8218 117.0408 52.0602 19.0859 178.3016 251 G 3.7614 7.7421 105.3515 45.6464 0.0000 174.6874 252 I 4.0794 7.4442 121.7797 60.1696 36.1722 176.3931 253 K 4.0824 8.4140 124.9216 57.8235 33.0249 177.3396 254 K 4.8614 7.5344 115.7571 53.9995 33.9321 175.0508 255 P 4.3646 0.0000 0.0000 63.3613 32.1077 177.2749 256 V 3.5201 8.1933 123.8218 61.1628 30.1663 175.3186 257 Y 4.2484 7.2208 121.4995 58.8909 40.0276 177.3656 *264 K 4.1999 8.4089 120.7869 56.0939 32.7303 177.0985 265 D 4.4712 9.0690 111.6367 53.7093 42.6348 174.1041 266 D 4.4946 8.5479 125.3423 53.5901 41.7372 175.1177 267 P 4.3270 0.0000 0.0000 64.3271 32.0551 176.4229 268 D 4.3406 7.7167 118.4291 55.1875 41.9639 176.5847 269 F 4.7362 8.9767 119.0628 54.5866 39.6971 173.4032 270 S 4.3878 8.5818 118.7448 58.6934 62.8281 173.9424 271 I 4.6072 8.7552 119.1495 60.4004 38.4069 177.3965 272 S 4.1899 8.0108 117.3979 61.1355 63.2533 176.0455 273 L 3.8912 7.8458 122.0148 56.0375 42.2237 177.8446 274 G 4.0972 8.1403 102.8960 45.7454 0.0000 174.1798 275 A 3.9622 8.9248 122.3726 55.0904 18.0223 180.0210 276 D 4.4168 8.2833 117.4139 57.7183 40.9036 179.4914 277 G 3.6263 8.0290 105.4497 47.8241 0.0000 175.5977 278 I 3.7150 8.0635 122.4709 64.0004 37.1629 177.9103 279 E 3.9044 8.4576 120.5494 59.5274 29.4139 179.0398 280 R 3.9096 7.7347 118.3102 59.1497 30.0795 178.1930 281 K 3.9053 8.3487 119.8453 59.4092 32.0951 178.5326 282 L 3.9316 8.3207 120.9802 58.1580 41.8144 178.6285 283 E 3.9551 7.8659 117.3223 59.5422 29.6377 179.3385 284 I 3.8416 7.6544 119.5547 64.5121 37.3696 178.1017 285 E 3.9500 8.4530 119.6540 59.7219 29.1442 179.8494 286 K 4.0623 8.1884 116.7085 58.4525 32.1536 178.1715 287 A 4.5612 7.6519 118.9232 50.7174 19.4294 177.1342 288 V 3.6505 7.0837 118.6452 63.2329 32.0263 175.7059 289 T 4.1748 8.6299 124.0206 64.9898 69.3999 174.5360 290 D 4.8701 7.6762 121.1960 52.1004 42.9002 176.7522 291 V 3.6817 8.4925 120.0408 63.6447 32.0668 177.0548 292 A 4.2241 8.5724 122.7215 53.4728 18.9773 179.0147 293 E 3.8782 8.1545 116.9486 59.1598 29.5475 177.7844 294 L 4.3965 7.7871 114.2194 54.4573 42.2667 176.0503 295 N 4.8016 7.9075 118.3294 50.6333 39.8821 174.4513 296 G 3.7689 8.7330 113.1843 47.9408 0.0000 172.6785 297 E 4.0407 8.1999 120.6506 58.7999 29.5718 178.7249 298 L 4.0825 8.2456 119.3615 57.4944 41.7748 179.2018 299 R 3.9424 8.0036 117.6024 59.5324 29.9276 178.6936 300 N 4.5222 8.3307 116.1316 56.2838 38.4833 177.8211 301 R 3.9508 8.0909 119.6587 59.1230 30.0642 178.6282 302 Q 3.9576 8.3127 119.5704 59.5100 28.9151 178.0652 303 Y 4.3273 8.0244 120.3626 60.5883 38.7637 177.5558 304 L 3.6434 8.2685 121.6692 58.1741 42.1441 179.1831 305 V 3.5353 8.0183 118.2806 66.0450 31.4896 177.7011 306 E 3.9395 8.3527 118.4944 59.7014 29.4242 179.4892 307 Q 3.9303 8.0120 118.1072 58.6744 28.4922 178.6097 308 L 4.0026 7.9327 119.7593 57.9566 41.6822 179.3646 309 T 4.0186 7.8066 115.0063 66.6248 68.5047 176.7690 310 K 4.0934 7.9888 118.8154 57.9261 32.4352 177.8380 311 A 4.2001 7.0926 121.4416 52.2160 18.8926 176.1436 312 N 4.9906 8.2302 116.3363 51.4227 40.4408 173.9139 313 I 4.3051 8.0472 120.0248 59.3536 38.3522 175.6768 314 N 4.2194 8.7439 123.0578 53.4850 38.9017 175.1023 315 D 4.4285 8.4513 120.3149 54.5253 39.8781 175.7198 316 V 4.0926 8.0076 123.8983 61.1376 32.8769 174.5399 317 N 4.8317 7.8765 123.2556 51.7917 40.1382 173.7298 318 F 4.7994 7.8417 118.7837 55.9536 41.3253 173.3422 319 T 4.0900 8.3065 116.0163 61.1500 70.8779 172.9467 320 P 4.9943 0.0000 0.0000 63.0200 31.2145 175.2689 321 F 5.0224 6.7999 112.6678 56.1502 41.1257 172.8003 322 K 4.5908 9.6482 122.8989 54.5044 34.6016 174.6359 323 Y 4.8750 8.8313 125.6336 58.7755 37.7946 175.8033 324 Q 4.3047 9.4538 124.6980 57.6466 30.2026 176.2906 325 L 4.8176 7.8600 121.0897 53.0595 44.9077 176.2319 326 S 3.4162 8.5071 120.8607 56.3161 64.6612 172.0241 327 P 4.4994 0.0000 0.0000 63.4623 31.3109 176.5486 328 S 4.3356 8.9511 120.1535 57.9400 64.3668 174.0845 329 L 4.3815 8.2506 123.7474 52.7408 41.8381 174.5635 330 P 4.4094 0.0000 0.0000 62.9626 31.4432 176.2779 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 64 K 8.31 3.82 0.00 1.63 1.45 0.00 1.40 0.00 0.00 1.19 0.00 0.00 2.78 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.13 1.27 7.81 65 W 5.68 4.93 0.00 3.23 2.94 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 0.00 0.00 0.00 66 T 8.99 5.03 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 1.27 0.00 0.00 67 S 9.06 4.64 0.00 4.01 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 68 A 9.31 5.16 1.24 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 0.00 0.00 69 A 9.54 5.07 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 V 9.02 4.89 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 1.19 0.00 0.00 1.00 0.00 0.00 71 V 8.87 5.12 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 0.03 0.00 0.00 0.95 0.00 0.00 72 T 8.72 4.84 4.27 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 1.22 0.00 0.00 73 P 0.00 4.41 0.00 1.71 1.71 0.00 3.42 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.15 0.00 74 P 0.00 4.49 0.00 2.06 2.36 0.00 3.75 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 2.06 0.00 75 E 8.57 4.25 0.00 1.99 1.85 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 2.32 2.23 0.00 76 P 0.00 4.17 0.00 2.13 2.12 0.00 3.53 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.13 0.00 77 V 7.73 3.68 2.09 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 0.78 0.00 0.00 0.94 0.00 0.00 78 Q 8.32 4.31 0.00 2.37 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.83 0.00 0.00 0.00 0.00 0.00 2.42 2.40 0.00 79 W 8.23 4.42 0.00 3.40 2.97 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 80 Q 7.88 3.93 0.00 2.20 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.63 6.67 0.00 0.00 0.00 0.00 0.00 2.40 2.47 0.00 81 E 7.98 3.84 0.00 1.90 1.81 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 2.31 2.33 0.00 82 L 7.22 3.27 0.00 0.93 0.48 0.28 -1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 83 E 7.49 3.69 0.00 2.10 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 2.36 2.44 0.00 84 K 7.75 4.07 0.00 1.91 1.77 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.41 1.54 7.81 85 T 7.37 3.98 4.20 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 1.16 0.00 0.00 86 F 7.99 4.56 0.00 3.17 3.02 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 87 T 7.85 4.08 4.45 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 1.23 0.00 0.00 88 K 8.03 4.07 0.00 1.98 2.07 0.00 1.49 0.00 0.00 1.80 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.71 1.53 7.81 89 L 7.64 4.08 0.00 1.77 1.75 0.98 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 90 R 7.99 4.27 0.00 2.16 2.05 0.00 3.16 0.00 0.00 3.21 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 91 V 7.51 3.72 2.26 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 0.91 0.00 0.00 0.97 0.00 0.00 92 L 6.97 4.49 0.00 1.62 1.63 0.86 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 93 D 7.86 4.44 0.00 2.83 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 L 8.15 4.47 0.00 1.69 1.68 0.87 1.15 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 95 D 8.48 4.85 0.00 2.64 2.54 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 0.00 96 I 7.76 4.48 1.63 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.38 0.24 0.00 0.00 97 K 7.87 3.95 0.00 1.51 1.51 0.00 1.71 0.00 0.00 1.69 0.00 0.00 2.81 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.48 7.81 98 I 8.38 4.37 2.19 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.94 1.16 0.00 0.00 99 D 8.59 4.41 0.00 2.80 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 R 8.41 3.28 0.00 1.44 1.47 0.00 2.88 0.00 0.00 2.50 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 101 T 7.79 4.00 4.41 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 1.25 0.00 0.00 102 E 8.06 4.06 0.00 2.26 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 2.37 2.36 0.00 103 A 8.33 4.21 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 0.00 0.00 104 F 8.01 4.45 0.00 3.14 3.29 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 0.00 105 N 8.83 4.25 0.00 3.00 2.88 0.00 0.00 6.70 6.37 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 0.00 106 L 7.78 4.12 0.00 1.95 1.89 0.92 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 107 F 8.02 3.98 0.00 3.22 3.02 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 0.00 108 I 7.48 3.06 1.15 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 -0.36 -0.45 0.00 0.00 109 K 7.31 3.76 0.00 1.86 1.77 0.00 1.78 0.00 0.00 1.69 0.00 0.00 3.04 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.47 7.81 110 K 7.77 4.02 0.00 1.68 1.71 0.00 1.67 0.00 0.00 1.54 0.00 0.00 2.96 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.41 1.55 7.81 111 F 8.11 3.82 0.00 2.51 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 0.00 112 Q 8.09 4.51 0.00 2.22 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.71 0.00 0.00 0.00 0.00 0.00 2.60 2.59 0.00 113 S 7.52 4.32 0.00 3.83 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 0.00 114 V 8.57 3.58 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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*137 D 8.08 4.78 0.00 2.72 2.61 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 0.00 138 E 7.86 4.65 0.00 1.91 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 2.22 2.35 0.00 139 L 8.69 4.75 0.00 1.59 1.63 0.91 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 140 D 8.09 4.47 0.00 2.68 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 0.00 141 L 8.00 3.81 0.00 1.86 1.71 0.91 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 142 H 8.35 3.98 0.00 3.28 3.45 0.00 5.93 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 R 8.11 3.90 0.00 2.06 1.97 0.00 3.19 0.00 0.00 3.35 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.73 0.00 144 A 7.86 3.94 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 0.00 145 I 7.83 3.60 1.93 0.00 0.00 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0.00 0.00 0.00 1.14 0.90 7.81 162 K 8.26 4.08 0.00 1.79 1.80 0.00 1.65 0.00 0.00 1.84 0.00 0.00 3.04 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.51 1.42 7.81 163 K 8.59 3.95 0.00 1.77 1.76 0.00 1.80 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.37 1.04 7.81 164 D 7.93 4.64 0.00 2.60 2.69 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 0.00 0.00 0.00 0.00 165 E 8.16 4.56 0.00 2.00 1.82 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 2.21 2.21 0.00 166 P 0.00 4.34 0.00 2.01 1.96 0.00 3.64 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.05 0.00 167 S 8.04 4.43 0.00 3.63 3.69 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 0.00 0.00 0.00 0.00 168 L 8.30 4.07 0.00 1.56 1.75 0.93 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 169 Y 6.60 4.91 0.00 2.98 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 0.00 170 T 8.41 4.45 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 1.35 0.00 0.00 171 S 8.38 5.25 0.00 4.07 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 0.00 172 W 9.70 5.26 0.00 3.37 3.22 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 0.00 173 T 9.18 5.05 4.27 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 1.27 0.00 0.00 174 L 8.94 5.40 0.00 1.59 1.47 0.65 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 175 S 9.06 5.77 0.00 3.97 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 0.00 176 F 8.78 5.94 0.00 3.15 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 T 7.84 5.02 4.05 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 0.00 0.00 0.00 1.15 0.00 0.00 178 A 8.85 4.34 1.17 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 0.00 179 P 0.00 4.18 0.00 2.12 2.13 0.00 3.99 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 2.06 2.10 0.00 180 T 7.75 4.37 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 181 S 8.41 4.30 0.00 3.70 3.10 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 0.00 182 E 8.08 3.97 0.00 2.05 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 0.00 2.38 2.36 0.00 183 E 8.57 4.20 0.00 2.34 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 0.00 2.68 2.72 0.00 184 A 7.82 4.21 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 Q 8.01 4.11 0.00 2.19 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.76 0.00 0.00 0.00 0.00 0.00 2.36 2.46 0.00 186 T 8.01 3.79 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 0.67 0.00 0.00 187 V 7.82 3.62 2.38 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 0.41 0.00 0.00 1.10 0.00 0.00 188 L 7.92 4.02 0.00 2.04 1.79 1.26 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 189 S 8.25 4.36 0.00 4.18 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 0.00 190 G 8.24 4.26 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 0.00 0.00 0.00 191 Y 7.98 2.85 0.00 2.58 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 0.00 192 I 7.87 3.77 2.28 0.00 0.00 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 1.88 0.86 1.16 0.00 0.00 193 D 8.45 4.57 0.00 2.83 2.80 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.68 4.05 0.00 3.02 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 0.00 195 I 7.97 3.43 1.67 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 0.65 -0.35 0.38 0.00 0.00 196 S 8.65 4.16 0.00 4.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 A 7.89 3.82 1.28 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 0.00 0.00 0.00 198 L 7.51 3.70 0.00 1.74 1.55 0.60 0.33 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 0.00 199 V 7.74 3.57 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 1.03 0.00 0.00 1.04 0.00 0.00 200 V 7.72 3.33 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 -0.04 0.00 0.00 201 K 7.80 3.87 0.00 2.07 1.79 0.00 1.63 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.44 7.81 202 E 8.18 3.95 0.00 2.08 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 2.32 2.33 0.00 203 S 8.66 4.25 0.00 4.31 4.12 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 0.00 204 I 8.07 3.87 2.03 0.00 0.00 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 1.44 1.04 0.93 0.00 0.00 205 E 8.40 3.97 0.00 2.26 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 0.00 2.31 2.36 0.00 206 N 8.59 4.29 0.00 3.05 2.86 0.00 0.00 6.59 7.29 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 0.00 207 V 7.47 3.56 2.26 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 1.09 0.00 0.00 0.98 0.00 0.00 208 R 8.05 3.94 0.00 2.06 1.97 0.00 3.19 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.69 0.00 209 N 8.23 4.33 0.00 2.91 2.87 0.00 0.00 7.07 7.06 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 0.00 210 K 8.45 3.98 0.00 1.88 1.81 0.00 1.61 0.00 0.00 1.49 0.00 0.00 2.84 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.42 7.81 211 L 7.97 3.94 0.00 1.77 1.83 0.97 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 212 E 8.54 3.93 0.00 2.04 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 2.32 2.36 0.00 213 I 7.87 3.69 2.02 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 1.63 0.86 0.91 0.00 0.00 214 K 8.25 3.92 0.00 1.85 1.96 0.00 1.59 0.00 0.00 1.64 0.00 0.00 3.04 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.57 7.81 215 T 8.12 3.89 4.39 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 1.21 0.00 0.00 216 Q 8.26 3.90 0.00 2.28 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.76 0.00 0.00 0.00 0.00 0.00 2.46 2.38 0.00 217 F 8.87 4.08 0.00 3.13 3.22 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 0.00 218 E 8.58 3.89 0.00 2.06 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 2.64 2.54 0.00 219 K 7.99 3.89 0.00 1.85 2.02 0.00 1.62 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.46 7.81 220 E 8.23 3.92 0.00 2.12 1.86 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 2.28 2.27 0.00 221 K 8.03 3.75 0.00 1.00 1.42 0.00 1.21 0.00 0.00 1.21 0.00 0.00 3.04 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.27 1.32 7.81 222 L 7.84 3.90 0.00 1.82 1.81 0.91 1.03 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 0.00 223 A 7.75 4.01 1.27 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 0.00 0.00 224 Q 7.90 3.88 0.00 2.11 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.75 0.00 0.00 0.00 0.00 0.00 2.32 2.37 0.00 225 D 8.33 4.33 0.00 2.73 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 0.00 226 R 8.10 3.96 0.00 2.00 1.96 0.00 3.11 0.00 0.00 3.15 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.86 0.00 227 I 7.50 3.76 1.98 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 1.51 0.57 0.90 0.00 0.00 228 K 8.25 3.91 0.00 1.93 1.86 0.00 1.78 0.00 0.00 1.56 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.56 7.81 229 M 7.99 4.05 0.00 2.27 2.15 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.58 0.00 230 K 8.11 3.93 0.00 2.00 1.78 0.00 1.71 0.00 0.00 1.74 0.00 0.00 2.92 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.62 7.81 231 N 8.37 4.30 0.00 2.98 2.86 0.00 0.00 7.00 7.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 232 Q 7.93 3.96 0.00 2.23 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.73 0.00 0.00 0.00 0.00 0.00 2.38 2.51 0.00 233 L 8.14 3.93 0.00 1.73 1.86 0.92 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 234 D 8.28 4.28 0.00 2.88 2.69 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 0.00 0.00 0.00 0.00 235 A 8.09 4.00 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 N 8.73 4.39 0.00 2.81 2.88 0.00 0.00 7.06 7.36 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 0.00 237 I 8.25 3.76 1.98 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 1.50 0.87 0.87 0.00 0.00 238 Q 7.99 3.74 0.00 2.18 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.79 0.00 0.00 0.00 0.00 0.00 2.45 2.45 0.00 239 R 8.05 4.19 0.00 2.10 2.12 0.00 3.09 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.75 0.00 240 L 7.98 4.06 0.00 2.02 1.82 0.95 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 241 N 8.14 4.20 0.00 2.83 2.46 0.00 0.00 7.17 7.15 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 0.00 242 Y 7.59 4.27 0.00 3.11 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 0.00 0.00 0.00 243 S 8.59 4.22 0.00 4.05 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 0.00 244 L 8.24 3.90 0.00 1.72 1.91 0.93 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 245 D 8.07 4.36 0.00 2.88 2.69 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 0.00 0.00 0.00 0.00 246 I 8.07 3.68 1.86 0.00 0.00 0.48 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 0.49 0.91 0.00 0.00 247 A 8.60 3.98 1.43 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 0.00 0.00 0.00 0.00 0.00 0.00 248 N 8.48 4.25 0.00 2.87 2.88 0.00 0.00 6.96 7.97 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 0.00 249 A 8.02 4.02 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 250 A 7.82 4.32 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 0.00 251 G 7.74 3.76 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 0.00 0.00 0.00 252 I 7.44 4.08 1.86 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 1.26 0.58 0.92 0.00 0.00 253 K 8.41 4.08 0.00 1.81 1.84 0.00 1.65 0.00 0.00 1.82 0.00 0.00 2.87 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.47 1.44 7.81 254 K 7.53 4.86 0.00 1.60 1.77 0.00 1.88 0.00 0.00 1.76 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.48 7.81 255 P 0.00 4.36 0.00 2.03 2.04 0.00 3.76 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.16 0.00 256 V 8.19 3.52 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 0.64 0.00 0.00 0.92 0.00 0.00 257 Y 7.22 4.25 0.00 3.03 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 *264 K 8.41 4.20 0.00 1.74 1.59 0.00 1.78 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.32 1.43 7.81 265 D 9.07 4.47 0.00 2.66 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 266 D 8.55 4.49 0.00 2.77 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 267 P 0.00 4.33 0.00 2.17 2.13 0.00 3.79 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 1.95 1.96 0.00 268 D 7.72 4.34 0.00 2.37 1.83 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 0.00 269 F 8.98 4.74 0.00 2.95 3.01 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 0.00 0.00 0.00 270 S 8.58 4.39 0.00 3.84 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 0.00 271 I 8.76 4.61 1.89 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 1.39 0.61 1.04 0.00 0.00 272 S 8.01 4.19 0.00 4.02 4.30 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 0.00 273 L 7.85 3.89 0.00 1.62 1.76 0.94 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 274 G 8.14 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 0.00 0.00 0.00 275 A 8.92 3.96 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.28 4.42 0.00 2.78 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 0.00 277 G 8.03 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.06 3.71 1.94 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.74 0.93 0.00 0.00 279 E 8.46 3.90 0.00 2.14 2.19 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 2.31 2.33 0.00 280 R 7.73 3.91 0.00 1.96 2.04 0.00 3.31 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 1.63 1.68 0.00 281 K 8.35 3.91 0.00 1.96 1.96 0.00 1.70 0.00 0.00 1.59 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.46 7.81 282 L 8.32 3.93 0.00 1.93 1.83 0.89 0.83 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 0.00 283 E 7.87 3.96 0.00 2.17 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 2.35 2.51 0.00 284 I 7.65 3.84 2.02 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.65 0.91 0.00 0.00 285 E 8.45 3.95 0.00 1.98 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 2.33 2.55 0.00 286 K 8.19 4.06 0.00 1.96 1.86 0.00 1.76 0.00 0.00 1.69 0.00 0.00 3.03 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.43 7.81 287 A 7.65 4.56 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 0.00 288 V 7.08 3.65 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 0.79 0.00 0.00 1.04 0.00 0.00 289 T 8.63 4.17 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 1.21 0.00 0.00 290 D 7.68 4.87 0.00 2.62 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 291 V 8.49 3.68 2.08 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 0.76 0.00 0.00 0.98 0.00 0.00 292 A 8.57 4.22 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 293 E 8.15 3.88 0.00 2.01 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 2.32 2.30 0.00 294 L 7.79 4.40 0.00 1.67 1.67 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 295 N 7.91 4.80 0.00 2.70 2.76 0.00 0.00 7.03 7.61 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 0.00 296 G 8.73 3.77 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 0.00 0.00 0.00 297 E 8.20 4.04 0.00 2.05 1.97 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 2.39 2.42 0.00 298 L 8.25 4.08 0.00 1.85 1.69 0.96 0.74 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 0.00 299 R 8.00 3.94 0.00 2.04 1.99 0.00 3.11 0.00 0.00 3.32 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.85 0.00 300 N 8.33 4.52 0.00 2.79 2.94 0.00 0.00 7.04 7.05 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 0.00 301 R 8.09 3.95 0.00 1.89 1.98 0.00 3.15 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.84 0.00 302 Q 8.31 3.96 0.00 2.25 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.47 0.00 303 Y 8.02 4.33 0.00 3.07 3.16 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 0.00 0.00 0.00 304 L 8.27 3.64 0.00 1.76 1.83 0.90 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 305 V 8.02 3.54 2.19 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 0.96 0.00 0.00 0.93 0.00 0.00 306 E 8.35 3.94 0.00 2.19 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 2.35 2.47 0.00 307 Q 8.01 3.93 0.00 1.88 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 1.72 1.76 0.00 308 L 7.93 4.00 0.00 1.78 1.71 0.93 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 309 T 7.81 4.02 4.37 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 1.20 0.00 0.00 310 K 7.99 4.09 0.00 1.71 1.86 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.47 1.55 7.81 311 A 7.09 4.20 1.29 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 0.00 0.00 0.00 312 N 8.23 4.99 0.00 2.77 2.73 0.00 0.00 5.98 7.81 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 0.00 313 I 8.05 4.31 1.88 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 1.45 0.52 0.92 0.00 0.00 314 N 8.74 4.22 0.00 2.66 2.76 0.00 0.00 7.21 8.06 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 0.00 315 D 8.45 4.43 0.00 2.63 2.64 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 0.00 316 V 8.01 4.09 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 0.65 0.00 0.00 0.86 0.00 0.00 317 N 7.88 4.83 0.00 2.61 2.63 0.00 0.00 6.98 6.90 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 0.00 318 F 7.84 4.80 0.00 2.79 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.31 4.09 3.94 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 0.00 0.00 0.18 0.00 0.00 320 P 0.00 4.99 0.00 2.47 2.46 0.00 3.22 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.95 0.00 321 F 6.80 5.02 0.00 3.19 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 322 K 9.65 4.59 0.00 1.74 1.80 0.00 1.56 0.00 0.00 1.64 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.28 1.45 7.81 323 Y 8.83 4.87 0.00 3.04 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 0.00 324 Q 9.45 4.30 0.00 2.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.61 0.00 0.00 0.00 0.00 0.00 2.36 2.46 0.00 325 L 7.86 4.82 0.00 1.75 1.61 0.90 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 326 S 8.51 3.42 0.00 3.14 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 0.00 327 P 0.00 4.50 0.00 1.93 2.12 0.00 3.29 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.16 0.00 328 S 8.95 4.34 0.00 3.85 3.86 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 0.00 329 L 8.25 4.38 0.00 1.55 1.59 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 330 P 0.00 4.41 0.00 2.32 2.25 0.00 3.77 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.06 0.00 * Residues marked with a * may have inaccurate shift predictions.