NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 T 4.3660 8.0176 110.9403 60.6211 69.9354 174.6570 13 P 4.0755 0.0000 0.0000 65.3508 31.0552 176.9315 14 H 4.0982 8.5615 119.7538 58.9044 30.1695 178.0656 15 A 4.0739 7.5971 121.2774 55.2392 18.2510 179.0891 16 D 4.5010 7.9052 119.2504 57.8469 40.9297 179.5357 17 V 3.9167 7.2318 121.6375 64.0791 32.1030 181.6609 18 L 4.7797 8.1000 120.2579 55.4435 40.1542 182.9884 *48 D 4.4724 8.5804 115.6066 55.4445 41.8162 175.0817 49 G 3.9287 8.2880 110.8568 44.8724 0.0000 175.5103 50 T 3.7924 7.5701 118.4405 66.9560 68.6714 176.5269 51 S 4.1250 7.9888 116.3089 61.4807 63.0413 176.2440 52 E 4.2122 8.2314 121.4111 59.2814 29.5092 178.5496 53 A 4.1241 8.2645 121.1584 55.1991 18.3282 179.5913 54 R 3.8669 8.2512 117.4029 59.3952 29.9740 178.4249 55 E 3.6831 7.9314 118.9667 59.0241 29.6524 178.6469 56 F 4.0913 8.0996 117.2462 60.7485 39.0836 177.5834 57 A 4.5906 8.3672 120.2760 55.4548 17.9167 179.7719 58 T 3.8950 7.9879 113.7437 66.6384 68.6159 176.0871 59 R 4.4227 7.5002 116.3899 56.3988 30.2448 176.9729 60 T 4.2524 7.3937 114.9639 65.4436 69.8685 175.9251 61 G 4.1012 8.1620 113.2484 46.1183 0.0000 174.3866 *63 V 3.5831 7.4717 114.8704 60.6748 31.4540 174.3283 64 S 4.4648 8.3817 119.2429 57.3900 64.4812 175.5872 65 G 3.9063 8.6203 110.9483 43.8233 0.0000 170.7280 66 P 4.7236 0.0000 0.0000 62.7987 32.3328 175.8552 67 V 4.3865 8.9147 121.3442 61.0555 34.3533 174.0368 68 L 4.3903 8.2888 130.0392 53.6508 43.5275 174.4454 69 E 4.9504 8.8468 128.6419 54.5881 31.4116 174.5322 70 L 4.1362 8.9694 127.7945 54.0691 42.7620 176.9654 71 A 3.6816 8.2445 124.8260 53.4720 15.5834 177.0916 72 A 4.2424 8.1112 121.9012 51.3956 18.7704 177.3931 73 G 3.8809 7.6024 105.7393 46.4865 0.0000 174.8964 *75 G 3.6074 7.4987 104.2183 43.9928 0.0000 174.3405 76 R 3.7857 8.1274 122.2122 58.7751 30.1882 177.8026 77 L 3.9894 7.5374 116.2250 56.3462 42.3458 178.8040 78 T 4.0225 7.5339 115.4182 66.6268 68.4427 176.3177 79 F 4.0083 8.2075 119.4793 60.1585 38.7865 175.6683 80 P 4.1815 0.0000 0.0000 65.8472 31.3560 178.2074 81 F 4.0418 7.8977 116.3356 60.5539 38.7933 177.7752 82 L 4.1360 8.4344 118.9671 57.7963 41.2014 178.8959 83 D 4.6258 8.0742 117.0500 55.8645 40.8492 177.4011 84 L 4.4899 7.4398 118.8280 54.1277 41.9044 177.4585 85 G 4.0758 8.0251 107.4564 45.0791 0.0000 174.4593 86 W 4.3055 8.1016 119.1096 56.7829 29.8707 174.9359 87 E 4.6757 8.7323 122.8506 55.0543 30.6950 174.5335 88 V 4.8547 8.7316 127.6816 61.4333 34.5058 174.3135 89 T 4.8247 9.0192 125.3526 62.5096 69.8907 173.5941 90 A 4.9032 9.0277 130.1871 50.2465 21.0661 175.0141 91 L 4.9122 8.6333 125.8246 53.7814 44.1652 175.0251 92 E 4.8564 8.8423 126.4742 54.7576 32.8932 175.8346 93 L 4.0826 8.7149 128.0051 57.2430 42.7670 177.6665 94 S 4.3961 8.3969 113.9133 57.7522 63.6355 174.4989 95 T 3.8604 8.5974 126.1489 66.9930 68.1557 176.4475 96 S 4.0938 8.0004 114.3388 61.3706 62.4998 176.2195 97 V 3.6350 7.8935 120.9931 66.0054 31.2428 177.8876 98 L 4.1263 8.3193 118.7481 57.8077 41.3476 179.4383 99 A 4.0140 8.0976 120.4055 55.1133 18.3664 179.5295 100 A 3.9656 7.8248 119.2932 55.1371 18.3735 179.5773 101 F 4.3065 8.4778 119.2090 61.6331 39.5195 177.2044 102 R 3.8986 8.5180 118.7074 59.3486 29.7205 178.2679 103 K 3.9306 8.3473 119.4147 59.6723 32.0169 178.7540 104 R 3.9081 8.0334 117.6042 59.4321 30.2034 178.1526 105 L 4.4655 8.6995 118.9317 57.7912 41.3806 179.3149 106 A 4.1110 7.9955 120.0407 54.8818 18.3739 178.9559 107 E 4.1448 7.8029 115.6310 57.2555 29.9587 177.1610 108 A 4.3874 6.9533 121.2879 50.6231 19.6912 176.0430 109 P 4.4716 0.0000 0.0000 62.2499 33.3335 177.7128 110 A 4.0525 8.6139 121.9060 55.7168 18.0460 180.0040 111 D 4.3068 8.0277 115.9925 57.3095 41.1846 178.8804 112 V 3.7608 7.6910 118.2827 66.0638 31.8444 177.7583 113 R 3.9127 8.0910 118.4255 59.6895 29.6868 178.0868 114 D 4.4594 8.3296 117.1193 56.5949 41.0840 177.1620 115 R 4.3854 7.9566 117.2795 56.0230 30.5548 174.6698 116 C 5.1248 7.8487 119.5090 57.7703 33.6149 172.9710 117 T 4.5042 8.8476 123.3864 61.7677 70.4912 173.2559 118 L 4.6714 8.3190 127.0430 53.7959 43.1199 176.5564 119 V 4.3957 8.5841 123.1216 60.9854 34.9006 173.9866 120 Q 4.7273 8.8527 129.4347 55.6054 29.5413 174.9783 121 G 3.9535 8.1233 112.9330 46.9889 0.0000 170.9910 122 D 5.4036 7.7325 119.1838 52.5984 43.0382 176.1158 *124 S 4.4603 8.4414 110.2271 58.1114 64.6848 173.0559 125 A 4.4179 7.8102 121.3229 51.7268 20.1666 175.1724 126 F 5.0089 8.1471 114.7739 55.6296 41.1958 175.2303 127 A 4.6991 8.6199 124.2731 51.2634 21.4599 175.9953 128 L 4.6797 9.0296 121.4939 53.9599 43.3715 178.3403 129 D 4.5469 8.2692 115.9498 54.5558 39.4191 173.5524 130 K 4.4512 7.6919 117.9741 54.6522 33.9651 175.9200 131 R 4.9051 7.9470 120.6526 54.9862 32.4955 175.4860 132 F 4.7872 9.2274 118.8372 55.7572 43.0499 176.5079 133 G 3.6728 8.9216 108.5318 49.0230 0.0000 173.6778 134 T 5.2080 7.8774 116.2536 61.5987 73.0056 173.2569 135 V 4.7765 9.2536 125.9087 61.0310 34.7793 174.2709 136 V 5.0862 9.0808 127.3811 61.2257 34.9155 173.9827 137 I 4.9772 8.7633 126.4047 59.6047 41.9617 173.9034 138 S 5.0578 8.7033 122.8617 57.3460 64.3050 174.4913 139 S 4.4680 8.4126 120.6785 61.0415 61.8427 177.0594 140 G 3.7230 8.1238 106.0780 47.9004 0.0000 175.4272 141 S 4.2993 7.9689 116.7776 61.5680 63.0819 176.4349 142 I 3.7977 7.7443 121.1079 64.0536 37.5665 177.2386 143 N 4.5692 8.1098 115.3879 55.0810 38.4565 175.7340 144 E 4.1889 7.8273 116.8873 57.6503 29.9835 176.6782 145 L 4.5111 7.5710 119.4757 53.2189 43.0860 177.0055 146 D 4.6993 8.2801 122.9483 52.2421 42.0582 176.6820 147 E 3.8935 8.7410 118.5146 59.7658 29.4270 178.5850 148 A 4.0006 7.9714 119.9069 55.3883 18.4889 179.2288 149 D 4.3362 8.9224 117.7627 57.3458 40.7328 179.2405 150 R 3.5769 8.1388 118.9867 59.0333 30.0025 179.1801 151 R 4.0675 7.7421 118.0367 59.0640 29.9612 179.2056 152 G 3.6933 7.8782 106.7803 47.0249 0.0000 175.1597 153 L 4.0066 7.8955 123.2655 58.2295 42.0763 178.7317 154 Y 4.4541 7.7994 116.3139 61.2150 37.6323 178.5863 155 A 4.0751 8.0628 120.5128 55.2136 18.6507 179.5161 156 S 3.8728 8.2382 113.9449 61.5891 62.8045 177.0546 157 V 3.6188 7.9126 120.9604 66.0297 30.9554 177.6861 158 R 3.8988 7.9080 117.2834 59.7622 29.9135 177.6717 159 E 4.2376 7.7678 115.4583 57.7995 29.8990 176.7488 160 H 4.9750 8.2139 115.2636 55.3665 30.6894 173.1985 161 L 5.2241 7.8856 119.4709 53.0546 42.8922 176.5000 162 E 4.2738 9.1182 122.4141 55.0895 31.3291 174.6946 163 P 4.2738 0.0000 0.0000 64.4277 31.6501 177.0061 164 G 3.9034 9.0639 110.1754 45.7239 0.0000 173.6340 165 G 3.9180 8.1998 106.9079 45.9461 0.0000 173.1940 166 K 4.9266 9.0195 122.0313 54.3430 35.0461 174.4848 167 F 5.6559 9.6324 130.2832 56.8600 41.2542 173.9530 168 L 5.2587 9.4513 126.9850 52.9664 44.4708 175.7477 169 L 5.5241 8.8389 122.9454 52.9611 45.8436 175.5263 170 S 5.2742 8.9458 117.1580 56.8840 65.7853 173.2953 171 L 4.7264 8.7259 121.7892 53.1706 44.9691 176.8731 172 A 4.0773 8.7482 129.0685 52.0340 18.7709 176.4040 *174 S 4.2557 8.2367 110.5135 58.2096 65.2446 174.3247 175 E 3.9112 8.4948 120.3258 59.6112 28.8916 179.5474 176 A 3.9811 7.9028 118.9546 55.1116 18.6044 179.1113 177 A 4.0866 7.8273 118.6540 54.9285 18.5038 179.1986 178 E 4.1049 8.0145 115.2453 57.9625 30.3978 177.7616 179 S 4.2982 7.0684 115.5220 57.7705 63.5761 173.4233 180 E 4.1038 8.5185 124.7090 55.1254 29.9485 174.9651 181 P 4.3027 0.0000 0.0000 62.2395 32.0111 175.7848 182 L 4.0442 8.3701 124.6969 54.8762 42.3023 175.5541 183 E 4.5748 8.6714 127.7993 55.5787 30.7290 175.3608 184 R 4.7110 9.0375 125.9939 54.3690 33.1404 174.9393 185 K 4.9024 8.6378 122.7767 55.2976 34.2497 176.0769 186 Q 4.5173 8.9382 122.1098 54.3609 33.0867 173.7615 187 E 5.0705 8.8947 123.9106 55.1458 30.8863 175.6482 188 L 4.8804 8.7573 124.2203 53.4606 44.1733 174.6001 189 P 4.6669 0.0000 0.0000 62.2317 32.2251 175.7929 *194 R 3.9059 8.1534 119.5945 56.2271 30.8383 175.0961 195 R 4.4981 8.1460 123.6815 55.5760 31.5539 175.1570 196 Y 4.8860 8.9895 119.1182 56.1291 42.2777 174.4629 197 V 4.8293 8.4923 120.5550 61.1518 33.8808 174.2266 198 L 4.6837 9.0422 130.5806 53.7768 43.9852 174.3949 199 H 5.3108 8.8768 123.2634 54.0336 30.9597 173.8717 200 V 4.4615 8.8308 123.3349 61.0937 34.0965 174.4668 201 R 4.9051 8.5803 125.3770 54.6475 33.9588 174.6603 202 H 4.8446 8.6938 119.0631 54.0616 30.1160 173.9456 203 L 4.4474 8.3523 125.2874 52.7102 42.6548 175.3600 204 P 4.4161 0.0000 0.0000 63.1007 32.2911 174.7453 205 A 4.6068 8.5592 120.4688 53.0459 21.2639 175.1740 206 E 5.1125 8.0541 113.5047 54.8436 33.0854 173.4025 207 E 4.8803 9.5812 124.5330 54.6658 34.5132 174.3207 208 I 4.7966 8.1714 120.8544 59.6795 39.6138 175.3032 209 Q 4.3007 9.2723 129.6725 55.2506 30.1316 173.7921 210 E 5.1105 8.8011 127.5880 54.3692 31.6321 174.6001 211 I 4.6646 8.5009 126.4934 59.5531 41.7708 174.6519 212 T 4.4050 8.1241 122.9597 62.1497 71.2300 173.8185 *227 T 4.2365 8.4100 122.8328 63.7166 69.5814 173.1005 228 H 4.7351 8.4216 123.7296 55.1998 33.8664 172.3038 229 R 5.1618 8.3726 124.6589 54.6207 32.0770 175.7298 230 R 4.7478 8.9733 119.0477 53.8859 33.3068 174.5614 231 R 4.2018 8.6716 121.4042 56.7259 31.1451 175.7202 232 L 4.6405 9.0589 127.8451 53.2335 44.4243 174.9330 233 L 4.8060 9.1803 126.6413 53.7838 43.0056 176.9883 234 A 4.0940 8.7315 125.2874 51.3398 19.1410 176.6232 235 P 4.1628 0.0000 0.0000 66.1455 31.4660 178.6059 236 D 4.3769 8.1396 116.8005 57.3113 40.6683 178.6106 237 Q 3.9434 7.9718 119.9959 59.2455 29.0489 178.4307 238 V 3.6573 7.7860 118.7769 65.9745 31.5829 177.8373 239 V 3.5056 7.9113 117.9434 66.1504 31.3787 178.1591 240 R 3.9500 8.0396 117.6704 59.3937 29.9087 178.9511 241 E 4.0544 8.2543 118.3535 59.2978 29.4750 179.3627 242 L 3.5211 7.9841 119.3716 57.5286 41.6041 179.7330 243 V 3.9963 7.7164 119.4564 65.6669 31.3182 178.0245 244 R 3.9435 7.9010 117.1888 59.0167 29.9276 177.5655 245 S 4.6181 7.6386 111.4803 58.1357 63.6523 174.6008 246 G 3.9968 8.0615 110.5204 45.5394 0.0000 174.5592 247 F 4.3569 8.3497 118.8649 57.5122 40.6924 173.8435 248 D 4.9023 9.4006 121.7960 52.7986 42.8585 175.4933 249 V 4.6374 8.5108 127.3182 62.2010 31.3037 175.2344 250 I 4.3489 8.4516 122.1958 61.8195 38.8581 175.9025 251 A 4.6945 7.6425 123.7816 50.7394 22.7199 175.0949 252 Q 4.7517 8.6814 119.7768 54.5421 32.2199 175.1032 253 T 4.6418 8.8375 122.3302 60.6911 71.0465 172.1893 254 P 4.8707 0.0000 0.0000 63.0813 32.3638 175.4726 255 F 4.9806 8.2891 115.2139 55.9482 41.8636 172.6962 256 A 4.7455 8.5977 122.7505 50.6338 19.2060 178.4453 257 S 4.1098 9.1457 119.7505 61.3097 62.9548 175.8457 258 G 3.7403 8.0138 106.9846 45.4910 0.0000 174.2621 259 G 3.9138 10.1718 107.8652 46.2634 0.0000 173.2044 260 A 4.5319 7.5080 119.9982 51.9473 22.4082 177.7995 261 G 3.8405 8.5444 106.2476 44.4154 0.0000 173.3693 262 R 3.9878 8.2838 119.0291 56.1918 30.6942 176.5446 263 K 4.2283 8.4120 121.8951 56.6460 32.6457 176.8253 264 D 4.6283 8.2304 123.4378 53.0458 40.2286 175.2440 *266 V 4.0771 7.9036 118.1095 63.7895 33.3157 173.4155 267 L 4.8158 9.3163 130.4521 53.8466 43.4018 174.9385 268 V 4.6247 9.0239 127.7907 61.3534 33.7250 174.0790 269 E 5.0212 9.1070 127.6354 54.6009 31.8247 174.7749 270 A 5.2544 9.1171 126.5026 49.4535 22.3251 173.9735 271 V 4.6529 9.1570 116.6785 60.5887 35.6692 174.5226 *273 P 4.1645 0.0000 0.0000 63.8202 31.6275 176.0194 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 12 T 8.02 4.37 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 1.21 0.00 0.00 13 P 0.00 4.08 0.00 2.37 2.36 0.00 3.70 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.09 0.00 14 H 8.56 4.10 0.00 3.29 3.32 0.00 5.87 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 A 7.60 4.07 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 16 D 7.91 4.50 0.00 2.61 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 17 V 7.23 3.92 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 0.74 0.00 0.00 0.93 0.00 0.00 18 L 8.10 4.78 0.00 1.75 0.60 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 *48 D 8.58 4.47 0.00 2.60 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 49 G 8.29 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 0.00 0.00 0.00 50 T 7.57 3.79 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 1.17 0.00 0.00 51 S 7.99 4.12 0.00 4.05 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 52 E 8.23 4.21 0.00 2.19 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 0.00 2.73 2.73 0.00 53 A 8.26 4.12 0.96 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 54 R 8.25 3.87 0.00 1.97 2.07 0.00 3.10 0.00 0.00 3.09 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 55 E 7.93 3.68 0.00 1.71 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.47 0.00 56 F 8.10 4.09 0.00 3.65 3.34 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 57 A 8.37 4.59 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 58 T 7.99 3.90 4.35 0.00 0.00 0.00 0.00 0.00 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 59 R 7.50 4.42 0.00 1.72 2.14 0.00 3.36 0.00 0.00 3.19 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.66 0.00 60 T 7.39 4.25 4.71 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 1.15 0.00 0.00 61 G 8.16 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 *63 V 7.47 3.58 1.62 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 -0.06 0.00 0.00 0.70 0.00 0.00 64 S 8.38 4.46 0.00 3.92 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 65 G 8.62 3.91 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 0.00 66 P 0.00 4.72 0.00 2.38 2.15 0.00 3.69 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.94 0.00 67 V 8.91 4.39 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 0.77 0.00 0.00 0.06 0.00 0.00 68 L 8.29 4.39 0.00 0.27 0.85 0.51 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 69 E 8.85 4.95 0.00 2.11 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 2.25 2.34 0.00 70 L 8.97 4.14 0.00 1.50 1.44 0.96 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 71 A 8.24 3.68 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 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0.00 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 D 8.92 4.34 0.00 2.73 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 0.00 150 R 8.14 3.58 0.00 1.88 1.52 0.00 3.21 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.87 0.00 151 R 7.74 4.07 0.00 2.01 2.03 0.00 3.20 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.74 0.00 152 G 7.88 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 0.00 0.00 0.00 153 L 7.90 4.01 0.00 1.72 1.54 1.08 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 154 Y 7.80 4.45 0.00 3.20 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 0.00 155 A 8.06 4.08 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 0.00 156 S 8.24 3.87 0.00 3.77 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 0.00 157 V 7.91 3.62 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 0.29 0.00 0.00 0.55 0.00 0.00 158 R 7.91 3.90 0.00 2.10 2.08 0.00 3.12 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.34 0.00 159 E 7.77 4.24 0.00 1.99 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 2.52 2.41 0.00 160 H 8.21 4.98 0.00 3.25 3.63 0.00 5.60 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 0.00 161 L 7.89 5.22 0.00 1.60 1.68 1.22 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 162 E 9.12 4.27 0.00 2.02 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 2.48 2.30 0.00 163 P 0.00 4.27 0.00 2.05 2.05 0.00 3.75 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 2.02 2.09 0.00 164 G 9.06 3.90 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 0.00 0.00 0.00 165 G 8.20 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 0.00 0.00 0.00 166 K 9.02 4.93 0.00 1.85 1.69 0.00 1.63 0.00 0.00 1.61 0.00 0.00 2.80 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.41 7.81 167 F 9.63 5.66 0.00 3.02 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 0.00 168 L 9.45 5.26 0.00 1.87 1.83 1.06 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 169 L 8.84 5.52 0.00 1.41 1.43 0.05 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 170 S 8.95 5.27 0.00 4.12 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 0.00 171 L 8.73 4.73 0.00 1.48 1.58 0.90 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 172 A 8.75 4.08 1.21 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 0.00 0.00 *174 S 8.24 4.26 0.00 4.07 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 0.00 175 E 8.49 3.91 0.00 2.02 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 2.37 0.00 176 A 7.90 3.98 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 0.00 177 A 7.83 4.09 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 0.00 178 E 8.01 4.10 0.00 2.14 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 2.53 2.39 0.00 179 S 7.07 4.30 0.00 3.84 3.83 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 0.00 180 E 8.52 4.10 0.00 1.90 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 2.29 2.39 0.00 181 P 0.00 4.30 0.00 2.08 2.19 0.00 3.73 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 182 L 8.37 4.04 0.00 1.59 1.60 0.92 0.93 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 0.00 183 E 8.67 4.57 0.00 2.02 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 2.32 2.36 0.00 184 R 9.04 4.71 0.00 1.73 1.77 0.00 3.17 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.56 0.00 185 K 8.64 4.90 0.00 1.61 1.68 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.21 1.43 7.81 186 Q 8.94 4.52 0.00 1.91 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.87 0.00 0.00 0.00 0.00 0.00 2.26 2.31 0.00 187 E 8.89 5.07 0.00 1.83 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 2.26 2.35 0.00 188 L 8.76 4.88 0.00 1.76 1.72 0.98 0.65 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 0.00 189 P 0.00 4.67 0.00 2.10 2.04 0.00 3.74 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.08 0.00 *194 R 8.15 3.91 0.00 1.70 1.76 0.00 3.07 0.00 0.00 2.93 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 1.33 0.00 195 R 8.15 4.50 0.00 1.73 1.77 0.00 3.18 0.00 0.00 3.21 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.59 0.00 196 Y 8.99 4.89 0.00 2.87 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 0.00 197 V 8.49 4.83 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 0.64 0.00 0.00 0.95 0.00 0.00 198 L 9.04 4.68 0.00 1.75 1.63 0.92 0.83 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 0.00 199 H 8.88 5.31 0.00 3.02 3.20 0.00 5.89 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 V 8.83 4.46 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 0.96 0.00 0.00 0.92 0.00 0.00 201 R 8.58 4.91 0.00 1.66 1.75 0.00 3.21 0.00 0.00 3.41 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.61 0.00 202 H 8.69 4.84 0.00 3.11 3.21 0.00 5.71 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 L 8.35 4.45 0.00 1.65 1.60 0.93 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 204 P 0.00 4.42 0.00 2.18 2.06 0.00 3.71 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.15 0.00 205 A 8.56 4.61 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 0.00 206 E 8.05 5.11 0.00 1.94 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 2.19 2.35 0.00 207 E 9.58 4.88 0.00 1.85 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 2.20 2.25 0.00 208 I 8.17 4.80 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 1.22 0.86 0.90 0.00 0.00 209 Q 9.27 4.30 0.00 2.08 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.32 2.29 0.00 210 E 8.80 5.11 0.00 1.97 1.78 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 2.17 2.25 0.00 211 I 8.50 4.66 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 1.22 1.32 0.96 0.00 0.00 212 T 8.12 4.41 4.16 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 1.19 0.00 0.00 *227 T 8.41 4.24 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 1.22 0.00 0.00 228 H 8.42 4.74 0.00 3.27 3.10 0.00 5.76 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 R 8.37 5.16 0.00 1.63 1.77 0.00 3.16 0.00 0.00 3.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.56 0.00 230 R 8.97 4.75 0.00 1.81 2.03 0.00 2.89 0.00 0.00 3.11 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.55 0.00 231 R 8.67 4.20 0.00 1.85 2.08 0.00 3.38 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.82 0.00 232 L 9.06 4.64 0.00 1.74 1.62 0.91 0.65 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 0.00 233 L 9.18 4.81 0.00 1.63 1.60 0.97 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 234 A 8.73 4.09 1.25 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 0.00 0.00 235 P 0.00 4.16 0.00 2.15 2.13 0.00 3.60 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.18 0.00 236 D 8.14 4.38 0.00 2.68 2.73 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 0.00 237 Q 7.97 3.94 0.00 2.21 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.80 0.00 0.00 0.00 0.00 0.00 2.51 2.46 0.00 238 V 7.79 3.66 2.21 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 1.12 0.00 0.00 1.00 0.00 0.00 239 V 7.91 3.51 2.21 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 0.96 0.00 0.00 1.01 0.00 0.00 240 R 8.04 3.95 0.00 2.10 1.98 0.00 3.19 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.90 0.00 241 E 8.25 4.05 0.00 2.28 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 0.00 2.45 2.63 0.00 242 L 7.98 3.52 0.00 1.70 1.57 0.69 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 243 V 7.72 4.00 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 1.33 0.00 0.00 1.01 0.00 0.00 244 R 7.90 3.94 0.00 2.00 2.19 0.00 3.35 0.00 0.00 3.31 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.69 0.00 245 S 7.64 4.62 0.00 4.33 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 0.00 246 G 8.06 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 0.00 0.00 0.00 247 F 8.35 4.36 0.00 3.11 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 0.00 248 D 9.40 4.90 0.00 2.78 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 0.00 249 V 8.51 4.64 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 0.84 0.00 0.00 0.89 0.00 0.00 250 I 8.45 4.35 1.88 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 1.19 0.77 0.94 0.00 0.00 251 A 7.64 4.69 1.23 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 0.00 0.00 252 Q 8.68 4.75 0.00 1.88 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.76 0.00 0.00 0.00 0.00 0.00 2.22 2.34 0.00 253 T 8.84 4.64 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 0.00 254 P 0.00 4.87 0.00 2.08 2.05 0.00 3.81 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.97 0.00 255 F 8.29 4.98 0.00 3.13 3.05 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 0.00 256 A 8.60 4.75 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 0.00 257 S 9.15 4.11 0.00 3.90 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 0.00 258 G 8.01 3.74 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 0.00 0.00 0.00 259 G 10.17 3.91 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 0.00 260 A 7.51 4.53 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 0.00 261 G 8.54 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 0.00 262 R 8.28 3.99 0.00 1.78 1.85 0.00 3.19 0.00 0.00 3.20 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 263 K 8.41 4.23 0.00 1.71 1.68 0.00 1.71 0.00 0.00 1.87 0.00 0.00 3.06 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.42 7.81 264 D 8.23 4.63 0.00 2.52 2.57 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 *266 V 7.90 4.08 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 0.94 0.00 0.00 0.91 0.00 0.00 267 L 9.32 4.82 0.00 1.34 1.31 -0.30 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 268 V 9.02 4.62 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 0.86 0.00 0.00 0.88 0.00 0.00 269 E 9.11 5.02 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 2.22 2.19 0.00 270 A 9.12 5.25 1.09 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 0.00 271 V 9.16 4.65 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 0.77 0.00 0.00 1.06 0.00 0.00 *273 P 0.00 4.16 0.00 2.04 2.00 0.00 3.62 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 2.09 0.00 * Residues marked with a * may have inaccurate shift predictions.