NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2639 8.2493 123.5839 52.4078 19.8072 177.0257 2 T 4.3235 8.1395 114.6774 59.7554 72.2157 174.1155 3 L 4.1915 9.0666 121.2338 57.8630 42.0000 180.9447 4 K 3.9637 8.0970 117.8972 59.7094 32.1996 178.7527 5 D 4.4026 7.6488 118.4597 57.5338 40.7219 179.1997 6 I 3.7893 7.9241 120.0309 64.8222 37.2726 178.6807 7 T 3.7171 8.3164 116.9527 66.2805 68.0441 176.7795 8 R 3.8352 7.8343 120.2521 59.6444 30.3143 178.8610 9 R 3.9531 7.8699 117.5132 59.0326 29.8950 179.1595 10 L 3.9197 8.5208 119.1233 57.8753 41.5759 179.7074 11 K 3.9465 8.0068 118.6068 59.3144 31.8799 179.7023 12 S 4.1183 7.8885 114.3884 61.6612 63.0942 176.7295 13 I 3.7221 7.6875 123.4306 63.7271 36.8976 178.5856 14 K 4.0518 8.4474 119.7668 59.1173 31.7783 179.1697 15 N 4.4264 7.8072 117.2496 56.2523 38.7474 177.5071 16 I 3.7245 7.9291 121.2939 64.4075 36.8943 178.2867 17 Q 4.0125 8.1845 120.4303 58.6664 28.9095 178.5216 18 K 4.0030 7.5092 118.8969 59.4968 32.2966 179.3141 19 I 3.8069 7.6511 121.2997 64.2523 37.1391 178.7504 20 T 3.9069 7.8457 116.0825 66.3175 67.7307 176.7887 21 K 4.0086 7.7790 121.9738 59.2950 32.2032 179.0500 22 S 4.2565 8.0518 114.3924 61.4265 62.9739 176.1466 23 M 4.2660 8.2456 121.5998 57.1482 31.5421 178.5268 24 K 3.9625 7.8286 120.3355 59.4917 32.3792 178.7900 25 M 4.0206 7.6123 117.8433 58.4642 31.9447 178.7112 26 V 3.5880 8.1011 118.5276 66.2230 31.6204 177.9402 27 A 4.5315 8.1110 121.2150 54.3569 18.2927 179.4550 28 A 4.0930 7.8289 119.3908 55.0890 17.9233 179.6783 29 A 4.0452 8.1961 119.5434 55.0451 18.1984 179.8833 30 K 4.0592 8.0190 116.6446 59.1313 32.1550 179.0830 31 Y 4.0030 8.2772 119.9761 60.5893 38.9182 177.5229 32 A 3.5191 7.8194 121.2668 54.9863 18.3338 179.3815 33 R 3.9324 7.5598 114.1470 58.2337 30.4380 177.3724 34 A 4.4059 7.2499 119.1600 53.2324 19.7775 178.0923 35 E 3.9893 7.8049 117.0576 57.9325 29.9360 177.3720 36 R 4.0694 7.5779 117.2230 57.7514 30.2884 176.3484 37 E 4.5582 7.3759 113.5958 56.2955 30.3683 176.8621 38 L 4.1917 7.6270 121.0445 56.6626 42.0374 178.4177 39 K 3.9312 7.8947 117.6471 59.3493 32.2324 177.0595 40 P 4.4699 0.0000 0.0000 64.5798 31.4961 177.5563 41 A 4.2288 7.7662 117.1685 52.5555 19.0073 178.8680 42 R 4.3620 7.7558 117.3056 57.7995 30.5112 177.7802 43 V 4.1904 7.5593 125.3267 60.7241 31.1888 173.9467 44 Y 4.4707 7.8602 127.8822 58.2670 45.0711 175.2622 *77 L 4.1352 7.9761 120.3975 55.7480 41.4294 176.6006 78 C 4.6795 8.0996 117.6943 58.4447 31.1953 176.6952 79 G 3.8662 8.0426 106.7494 47.1562 0.0000 176.3683 80 A 4.1610 8.4552 121.9699 54.3377 18.2368 179.3697 81 I 3.6658 7.6727 118.3367 64.3834 36.8708 177.4721 82 H 4.2271 8.2730 118.4136 58.2767 29.7802 176.4283 83 S 4.3716 7.9296 113.9920 60.0779 62.2881 175.5324 84 S 4.1181 8.2826 116.4097 61.3027 61.9747 176.2497 85 V 3.9096 7.3954 114.2708 63.2597 31.4216 178.1763 86 A 4.1513 7.2793 116.7467 54.2741 18.4457 178.9514 87 K 4.1157 8.5071 118.6735 58.9431 32.2363 178.5435 88 Q 4.1840 7.5937 115.3637 57.8991 28.9141 176.9337 89 M 4.2463 7.5542 115.5889 56.7819 32.5447 176.8562 90 K 4.3862 7.2466 119.0789 55.7734 32.0442 177.0643 *209 L 4.2533 7.3427 121.2081 55.0836 44.2136 178.0184 210 A 4.1403 7.7147 120.0672 54.8882 18.0352 179.0869 211 N 4.2606 8.1417 115.6244 56.8766 39.2787 176.8084 212 I 4.3137 7.7428 120.3633 63.7227 37.3645 177.8507 213 I 3.7697 7.4938 119.9235 64.7643 37.3184 177.4217 214 Y 4.1357 7.8120 119.8214 60.7898 38.1254 176.8742 215 Y 4.2790 7.7597 121.1714 60.9096 38.7880 178.3847 216 S 4.1935 8.0510 114.4700 60.8597 63.2132 175.8268 217 L 4.1365 7.4021 119.7665 55.6770 40.5215 177.9474 218 K 4.2752 7.3785 117.1190 56.1964 33.3888 177.1856 219 E 4.1187 7.2069 119.4527 58.0290 29.4587 178.7315 220 S 4.0929 7.8003 114.0601 61.6317 62.7264 176.2617 221 T 3.9285 7.7219 111.9107 65.0125 68.5183 176.3832 222 T 4.0035 7.3621 116.0534 66.5705 68.5924 176.9980 223 S 4.1923 7.6798 115.8323 61.1549 62.7610 176.2938 224 E 3.9458 8.5659 122.4321 59.3882 29.8084 178.6831 225 Q 4.0934 7.9922 116.9486 57.9452 28.7889 178.6957 226 S 3.8243 7.7180 114.1903 61.2083 62.5397 175.8959 227 A 3.9763 7.8035 123.0829 55.0004 18.0830 179.5807 228 R 3.7981 8.3635 117.8358 59.6763 30.1812 178.4039 229 M 3.9992 7.6205 116.8281 58.7739 32.0350 178.4695 230 T 3.8289 7.6437 115.1870 66.3911 68.7663 176.7166 231 A 3.9645 8.5229 123.0117 55.6524 18.5278 179.6179 232 M 4.0849 8.1329 116.8889 58.1250 32.0578 178.4516 233 D 4.3496 8.0426 118.3095 57.1163 41.2209 178.1134 234 N 4.3679 8.0191 116.8147 56.2516 38.8511 176.9463 235 A 3.9506 8.0145 122.2996 55.5769 18.3171 179.8260 236 S 4.1484 8.0513 112.1603 61.3769 63.3216 176.8614 237 K 4.0192 7.6724 120.5810 58.9605 31.7779 179.1601 238 N 4.5199 8.9296 117.3330 56.2150 38.4582 177.3295 239 A 4.0296 7.9661 121.9597 55.0834 18.4357 179.9035 240 S 4.0712 8.2847 113.9111 61.8938 63.0574 176.7964 241 E 4.0108 8.1693 121.2361 59.5135 29.1576 179.0446 242 M 4.1319 8.0376 118.2641 58.1153 32.2520 178.4905 243 I 3.6621 7.7966 120.3135 64.5669 37.4869 177.8609 244 D 4.4752 8.0842 119.6594 57.3369 40.6625 179.1673 245 K 4.0587 7.9654 119.5209 59.6039 32.2419 179.0701 246 L 4.1014 7.9924 119.2739 57.9787 41.3664 179.5632 247 T 3.9207 8.5301 116.2285 66.4949 68.4243 176.7218 248 L 4.0724 7.6643 119.7399 58.0506 41.6106 179.5464 249 T 3.9086 7.9289 115.6475 66.5793 68.3275 176.4226 250 F 4.1123 8.5760 122.7853 61.3143 39.3539 177.0553 251 N 4.1715 8.0920 116.1118 56.2143 38.3546 177.2862 252 R 3.8861 7.7322 119.1102 59.9654 30.2051 179.1313 253 T 3.7827 8.0072 115.1632 66.4455 68.3918 176.6008 254 R 3.6105 7.7150 120.5701 59.4891 30.0561 178.2982 255 Q 3.8521 8.0210 117.3909 58.9685 28.6953 178.5340 256 A 3.9139 8.1639 121.8285 55.5063 18.3024 179.6612 257 V 3.4911 7.8179 116.2527 66.2829 31.5085 178.1265 258 I 3.6578 7.6127 119.2659 64.7264 36.8969 178.4609 259 T 3.8042 7.7933 116.3067 66.5208 68.3130 176.2304 260 K 3.8191 8.2723 121.6999 59.9688 32.0165 178.6095 261 E 4.0147 8.5055 118.6849 59.0258 29.3985 179.2223 262 L 3.9367 7.7567 120.2670 58.0037 42.2785 178.9078 263 I 3.7949 8.0192 119.8581 64.2075 36.5503 178.2990 264 E 4.0242 8.2078 119.8097 59.3508 28.8916 179.3626 265 I 3.8368 7.4047 119.6419 64.1675 37.1117 178.6356 266 I 3.7276 7.7198 120.5044 64.4187 37.1187 178.2518 267 S 4.2238 8.1167 116.2394 62.0131 62.5302 177.4235 268 G 3.6269 7.6003 104.8957 47.3965 0.0000 175.2583 269 A 4.1898 7.6860 122.5202 54.7904 18.3802 179.5764 270 A 4.0441 7.9205 118.3152 55.1034 18.6320 179.4734 271 A 4.0671 7.7383 117.4894 54.3963 18.4415 177.5450 272 L 4.1554 7.3416 120.4829 54.9879 41.8168 176.6397 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 1 A 8.25 4.26 1.30 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 0.00 0.00 2 T 8.14 4.32 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 1.22 0.00 0.00 3 L 9.07 4.19 0.00 1.79 1.99 0.87 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 4 K 8.10 3.96 0.00 1.79 1.88 0.00 1.71 0.00 0.00 1.83 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.56 1.51 7.81 5 D 7.65 4.40 0.00 3.07 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 6 I 7.92 3.79 2.10 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.88 1.03 0.00 0.00 7 T 8.32 3.72 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 1.01 0.00 0.00 8 R 7.83 3.84 0.00 2.00 2.09 0.00 3.10 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 1.62 1.66 0.00 9 R 7.87 3.95 0.00 2.16 1.96 0.00 3.19 0.00 0.00 3.18 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.84 0.00 10 L 8.52 3.92 0.00 1.80 1.60 0.65 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 11 K 8.01 3.95 0.00 1.94 1.83 0.00 1.63 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.39 7.81 12 S 7.89 4.12 0.00 4.00 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 13 I 7.69 3.72 2.04 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.61 0.90 0.00 0.00 14 K 8.45 4.05 0.00 1.98 1.83 0.00 1.61 0.00 0.00 1.61 0.00 0.00 2.87 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.57 7.81 15 N 7.81 4.43 0.00 2.93 2.84 0.00 0.00 6.88 7.33 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 16 I 7.93 3.72 1.98 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.05 0.90 0.00 0.00 17 Q 8.18 4.01 0.00 2.21 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.84 0.00 0.00 0.00 0.00 0.00 2.34 2.55 0.00 18 K 7.51 4.00 0.00 2.14 1.82 0.00 1.82 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.46 7.81 19 I 7.65 3.81 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.12 0.90 0.00 0.00 20 T 7.85 3.91 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 1.24 0.00 0.00 21 K 7.78 4.01 0.00 2.04 1.90 0.00 1.62 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.43 7.81 22 S 8.05 4.26 0.00 4.13 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 23 M 8.25 4.27 0.00 2.08 2.21 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.53 0.00 24 K 7.83 3.96 0.00 1.99 2.02 0.00 1.73 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.45 7.81 25 M 7.61 4.02 0.00 2.15 2.24 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.54 0.00 26 V 8.10 3.59 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 1.01 0.00 0.00 0.97 0.00 0.00 27 A 8.11 4.53 1.42 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 0.00 0.00 28 A 7.83 4.09 1.44 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 0.00 0.00 29 A 8.20 4.05 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 30 K 8.02 4.06 0.00 1.94 1.88 0.00 1.83 0.00 0.00 1.58 0.00 0.00 2.88 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.63 7.81 31 Y 8.28 4.00 0.00 3.22 3.08 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 0.00 32 A 7.82 3.52 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 33 R 7.56 3.93 0.00 2.01 1.93 0.00 3.23 0.00 0.00 3.21 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 34 A 7.25 4.41 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 35 E 7.80 3.99 0.00 1.45 1.59 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 2.19 2.11 0.00 36 R 7.58 4.07 0.00 1.97 1.87 0.00 3.24 0.00 0.00 3.18 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.55 0.00 37 E 7.38 4.56 0.00 1.97 1.90 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 2.22 2.26 0.00 38 L 7.63 4.19 0.00 1.80 1.60 0.92 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 39 K 7.89 3.93 0.00 1.76 1.87 0.00 1.79 0.00 0.00 1.70 0.00 0.00 3.06 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.52 7.81 40 P 0.00 4.47 0.00 2.04 2.16 0.00 3.82 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.16 0.00 41 A 7.77 4.23 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 42 R 7.76 4.36 0.00 2.06 2.08 0.00 3.31 0.00 0.00 3.31 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.83 0.00 43 V 7.56 4.19 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 0.77 0.00 0.00 0.95 0.00 0.00 44 Y 7.86 4.47 0.00 3.10 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 *77 L 7.98 4.14 0.00 1.77 1.72 0.90 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 78 C 8.10 4.68 0.00 3.06 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 79 G 8.04 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 0.00 0.00 0.00 80 A 8.46 4.16 1.32 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 0.00 0.00 0.00 81 I 7.67 3.67 1.87 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.69 0.92 0.00 0.00 82 H 8.27 4.23 0.00 3.16 3.29 0.00 5.66 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 S 7.93 4.37 0.00 3.93 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 84 S 8.28 4.12 0.00 4.09 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 85 V 7.40 3.91 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 0.87 0.00 0.00 0.87 0.00 0.00 86 A 7.28 4.15 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 87 K 8.51 4.12 0.00 2.03 1.80 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.47 7.81 88 Q 7.59 4.18 0.00 2.21 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.77 0.00 0.00 0.00 0.00 0.00 2.40 2.52 0.00 89 M 7.55 4.25 0.00 2.05 2.18 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.50 0.00 90 K 7.25 4.39 0.00 1.79 1.79 0.00 1.75 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.39 1.49 7.81 *209 L 7.34 4.25 0.00 1.76 1.64 0.94 1.11 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 0.00 210 A 7.71 4.14 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 0.00 211 N 8.14 4.26 0.00 2.88 2.86 0.00 0.00 7.23 7.82 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 0.00 212 I 7.74 4.31 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 1.68 0.81 1.03 0.00 0.00 213 I 7.49 3.77 1.95 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 1.63 0.78 0.97 0.00 0.00 214 Y 7.81 4.14 0.00 3.18 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 0.00 215 Y 7.76 4.28 0.00 3.35 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 0.00 216 S 8.05 4.19 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 0.00 217 L 7.40 4.14 0.00 1.74 1.53 0.93 0.74 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 0.00 218 K 7.38 4.28 0.00 1.33 1.57 0.00 1.50 0.00 0.00 1.63 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 0.78 0.89 7.81 219 E 7.21 4.12 0.00 2.03 1.79 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 1.87 1.79 0.00 220 S 7.80 4.09 0.00 3.83 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 0.00 221 T 7.72 3.93 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 1.22 0.00 0.00 222 T 7.36 4.00 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 1.26 0.00 0.00 223 S 7.68 4.19 0.00 4.11 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 0.00 224 E 8.57 3.95 0.00 2.05 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 2.30 2.35 0.00 225 Q 7.99 4.09 0.00 2.39 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.61 0.00 0.00 0.00 0.00 0.00 2.39 2.53 0.00 226 S 7.72 3.82 0.00 4.28 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 0.00 227 A 7.80 3.98 1.37 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 0.00 0.00 228 R 8.36 3.80 0.00 1.94 1.91 0.00 3.09 0.00 0.00 3.08 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.77 0.00 229 M 7.62 4.00 0.00 2.11 2.07 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.49 0.00 230 T 7.64 3.83 4.31 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 1.16 0.00 0.00 231 A 8.52 3.96 1.32 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 0.00 0.00 0.00 232 M 8.13 4.08 0.00 2.20 2.21 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.76 0.00 233 D 8.04 4.35 0.00 2.94 2.78 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 0.00 234 N 8.02 4.37 0.00 2.91 2.82 0.00 0.00 6.77 8.79 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 0.00 235 A 8.01 3.95 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 S 8.05 4.15 0.00 4.09 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 0.00 237 K 7.67 4.02 0.00 2.10 1.88 0.00 1.65 0.00 0.00 1.64 0.00 0.00 2.91 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.45 1.52 7.81 238 N 8.93 4.52 0.00 2.82 2.85 0.00 0.00 6.79 8.42 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 0.00 239 A 7.97 4.03 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 0.00 240 S 8.28 4.07 0.00 4.03 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 0.00 241 E 8.17 4.01 0.00 2.20 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 2.33 2.39 0.00 242 M 8.04 4.13 0.00 2.18 2.19 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.57 0.00 243 I 7.80 3.66 2.03 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 0.41 0.89 0.00 0.00 244 D 8.08 4.48 0.00 2.92 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 0.00 245 K 7.97 4.06 0.00 1.98 1.80 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.48 7.81 246 L 7.99 4.10 0.00 1.95 1.71 0.92 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 247 T 8.53 3.92 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 1.24 0.00 0.00 248 L 7.66 4.07 0.00 1.98 1.73 0.93 0.69 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 0.00 249 T 7.93 3.91 4.43 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 1.24 0.00 0.00 250 F 8.58 4.11 0.00 3.19 3.25 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 0.00 251 N 8.09 4.17 0.00 2.79 2.85 0.00 0.00 7.00 7.55 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 0.00 252 R 7.73 3.89 0.00 2.03 1.97 0.00 3.13 0.00 0.00 3.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 253 T 8.01 3.78 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 1.21 0.00 0.00 254 R 7.71 3.61 0.00 1.27 1.78 0.00 3.06 0.00 0.00 3.04 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.47 0.00 255 Q 8.02 3.85 0.00 2.32 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.48 0.00 0.00 0.00 0.00 0.00 2.34 2.45 0.00 256 A 8.16 3.91 1.32 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 0.00 0.00 0.00 257 V 7.82 3.49 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 1.10 0.00 0.00 0.94 0.00 0.00 258 I 7.61 3.66 1.98 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.03 0.89 0.00 0.00 259 T 7.79 3.80 4.36 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 1.20 0.00 0.00 260 K 8.27 3.82 0.00 1.91 1.94 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.48 7.81 261 E 8.51 4.01 0.00 2.02 1.98 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 2.32 2.53 0.00 262 L 7.76 3.94 0.00 1.88 1.81 0.91 1.31 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 0.00 263 I 8.02 3.79 1.97 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.84 0.90 0.00 0.00 264 E 8.21 4.02 0.00 2.03 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 2.32 2.34 0.00 265 I 7.40 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 0.91 0.91 0.00 0.00 266 I 7.72 3.73 2.00 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 1.69 0.96 0.91 0.00 0.00 267 S 8.12 4.22 0.00 4.03 3.93 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 0.00 268 G 7.60 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 0.00 269 A 7.69 4.19 1.37 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 0.00 0.00 270 A 7.92 4.04 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 0.00 271 A 7.74 4.07 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 0.00 272 L 7.34 4.16 0.00 1.87 1.58 0.92 0.79 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 * Residues marked with a * may have inaccurate shift predictions.