NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 251 G 3.8170 8.3544 109.7302 44.8479 0.0000 174.4296 252 D 4.2993 7.4784 127.0020 50.5472 42.3874 173.8466 253 R 3.6974 9.1577 129.1283 58.5884 31.0791 176.6376 254 F 4.8670 8.0457 114.9845 57.4929 39.5079 176.7769 255 Y 4.3764 8.2451 124.2714 61.0732 38.4942 178.0333 256 D 3.9513 8.0344 119.1070 57.2210 40.9170 178.4961 257 L 3.8335 7.8899 118.9158 57.9424 41.7305 179.3848 258 I 3.7464 8.1718 118.7595 63.9418 37.8354 177.7713 259 S 3.8965 8.0142 114.0814 61.3346 62.1635 176.1267 260 A 3.5584 7.6432 123.3782 54.5921 17.7449 179.3431 261 L 4.0341 7.9892 119.1551 58.5684 42.1879 178.4277 262 H 4.1268 8.6238 118.4377 59.5622 29.7666 177.1012 263 K 3.8561 8.1718 120.1816 59.6682 31.8040 179.5827 264 S 4.1941 8.2266 115.3278 61.3923 62.7136 176.7811 265 V 3.5655 8.0899 121.1942 66.2149 31.1520 178.1125 266 R 4.0021 8.2856 117.3687 58.9032 29.8488 177.5742 267 G 3.9217 7.8986 103.4296 43.4562 0.0000 173.4981 268 S 4.5104 8.3804 114.3644 58.9432 61.2935 173.7243 269 A 4.7154 8.0695 123.0432 49.1484 18.6116 175.7235 270 P 4.4111 0.0000 0.0000 64.8821 31.5584 178.5703 271 D 4.3311 8.0872 117.7770 57.2991 40.8497 178.4829 272 A 4.0382 8.0795 120.4875 54.9687 18.3450 179.3355 273 A 4.1726 8.3229 119.4856 55.4330 18.4998 179.8886 274 L 4.1043 8.2804 117.6210 57.9615 41.6193 178.8325 275 Y 3.9072 8.1239 119.5070 60.7755 38.6855 178.5410 276 W 4.2771 8.2943 119.6866 59.6922 28.9859 177.8474 277 Y 4.3222 8.5511 119.5962 60.9143 38.2128 177.9249 278 A 3.6730 8.3798 121.8583 55.3039 18.3836 179.8280 279 R 3.6581 7.8862 116.6190 59.2868 30.0882 179.2900 280 I 3.7040 7.8165 119.5063 64.3782 37.0414 178.5315 281 L 3.9666 7.6050 119.9035 58.0140 41.2623 179.7555 282 T 3.8748 7.8971 108.0444 63.9840 68.7799 175.4504 283 A 4.4803 7.7148 121.9844 52.0187 18.6540 177.6915 284 G 3.8598 8.1898 106.4577 45.7772 0.0000 174.4135 285 G 2.8397 7.7294 108.1793 44.0366 0.0000 173.5914 286 D 4.4984 7.8261 120.5724 52.5610 42.2670 175.7021 287 P 4.2549 0.0000 0.0000 65.6783 31.1922 178.7557 288 L 3.1636 7.7823 117.4890 56.7626 40.9776 178.5151 289 Y 3.9464 7.4675 120.0985 60.6909 38.6177 178.5620 290 V 3.4139 7.6998 118.2360 65.8425 31.8274 177.4435 291 A 3.8334 7.8399 120.8254 55.4139 18.1092 179.8766 292 R 4.0901 8.0213 116.6887 59.5238 30.0459 179.5234 293 R 3.9284 7.4482 117.1855 58.7293 29.9030 178.9805 294 L 3.9144 8.2085 119.6159 57.7328 41.4456 179.4279 295 L 3.9723 7.9743 118.6581 57.7696 41.5227 179.4658 296 A 3.9990 7.7941 120.2313 55.0993 18.1871 179.7975 297 I 3.6481 8.0080 118.3668 64.3684 37.1947 178.1373 298 A 4.0047 8.1958 121.9404 55.7219 17.8861 179.9771 299 S 4.1558 7.6268 112.1235 61.5179 63.0146 176.0869 300 E 3.7806 8.3481 121.9349 58.1036 29.3406 177.5077 301 D 4.7490 8.4971 117.4463 53.9259 42.9646 177.9232 302 V 3.9447 7.7985 117.5455 64.5455 32.9995 175.9332 303 G 3.8628 8.9111 109.5467 47.0693 0.0000 174.5898 304 N 4.7207 8.9069 120.5411 53.7878 38.8638 175.7723 305 A 4.1432 8.0711 122.8646 54.7915 18.8034 176.6134 306 D 4.7816 7.9754 115.2015 52.2807 41.8498 173.6983 307 P 4.4708 0.0000 0.0000 64.2503 31.8230 177.9073 308 R 4.1434 8.2320 116.4719 57.3815 30.6957 178.3364 309 A 4.1286 8.1967 121.0181 55.2650 18.1725 179.1086 310 M 3.9083 8.0682 116.1309 59.1899 32.2723 178.4188 311 Q 3.9238 7.9979 117.4359 58.7707 28.8381 178.9055 312 V 3.3635 7.3843 119.0100 65.8147 31.5518 178.0130 313 A 3.9906 7.8818 120.5668 55.1571 18.1277 179.6496 314 L 4.0005 8.2699 117.5860 57.7915 41.6665 179.5950 315 A 3.9690 8.3198 120.8165 54.9118 18.3817 179.3573 316 A 3.9903 8.1667 119.4140 55.2333 18.4540 179.6225 317 W 4.1199 8.2290 126.6078 60.8643 30.8084 177.8477 318 D 4.5382 8.6686 119.0698 57.5850 40.1297 178.5955 319 C 4.1852 8.3754 117.2934 62.7401 28.2762 175.7986 320 F 4.2695 8.2921 121.9788 61.8941 38.7583 177.4060 321 T 4.1410 8.3905 113.9421 66.0951 68.2701 176.1239 322 R 4.3316 7.8315 118.5320 57.5481 31.0599 178.2404 323 V 4.0315 9.0289 116.9530 66.2582 32.6655 176.6256 324 G 3.5234 6.8387 103.2391 44.4281 0.0000 172.7362 325 A 3.5164 7.8092 120.8144 55.0673 18.1248 179.7275 326 Y 4.1466 7.4990 114.6869 61.1948 38.2137 177.7062 327 E 4.1196 8.3220 119.9079 58.8796 29.6833 178.6674 328 G 3.9293 8.3973 106.3332 48.0533 0.0000 175.1087 329 E 4.4342 8.5210 123.2482 58.5742 29.5709 179.9278 330 R 3.9993 7.9305 117.5885 59.2813 30.0781 179.0216 331 A 4.0592 8.4013 120.8358 55.3128 18.3059 179.7945 332 I 3.5631 8.2583 118.4329 64.1422 37.0458 178.4762 333 A 3.8951 8.3261 121.9403 55.2072 18.2265 179.2569 334 Q 3.9232 8.1685 117.7987 59.4330 29.0023 178.5220 335 A 3.9886 8.2279 121.7794 55.2540 18.3216 179.5873 336 I 3.5922 7.9769 118.5639 64.6449 37.1924 178.7772 337 I 3.7226 7.9636 120.6066 64.3611 36.9333 177.6700 338 Y 4.0225 8.2280 120.4775 60.9791 38.4103 178.4319 339 L 4.1070 8.1482 118.3899 57.7930 42.0674 179.3345 340 S 4.4512 8.3627 115.3455 61.6087 62.6763 176.5435 341 V 4.0354 7.5864 111.3068 60.9038 31.9823 176.6066 342 A 3.9874 6.7632 121.9264 50.7263 18.8778 175.7612 343 P 4.4020 0.0000 0.0000 62.7766 31.9655 175.9226 344 K 4.7374 8.1999 119.0144 54.9169 34.5913 176.0275 345 S 4.5330 8.7791 116.8887 57.7093 65.6976 173.5887 346 N 5.2117 9.0919 123.9665 52.2818 37.8448 176.8789 347 A 4.2147 8.2106 124.3920 55.8790 18.2669 180.7475 348 V 3.6812 8.0166 116.4736 66.1295 31.8167 177.1239 349 Y 4.3029 8.3228 119.1695 61.4305 38.6022 178.4565 350 T 3.8895 8.4411 110.1087 64.3985 68.9105 176.4022 351 A 4.2734 8.2657 123.8195 55.1559 18.4181 179.3503 352 F 4.1389 8.4230 119.2358 61.4818 39.4578 177.0074 353 N 3.8418 7.8413 115.9517 56.3944 38.1976 177.4635 354 T 3.6962 7.7605 116.7083 66.5477 68.5067 176.4198 355 A 2.9698 7.2682 122.4954 54.7401 18.3620 179.6501 356 K 3.5994 7.5783 118.2419 59.4066 32.2350 178.9096 357 Q 3.8580 7.8284 119.8742 59.1938 28.9567 178.1189 358 Q 3.9945 8.2557 119.1290 59.0004 28.5537 178.6332 359 A 4.0768 7.9417 120.7607 55.2402 18.4197 179.5757 360 K 4.0493 7.6469 115.6541 59.1055 32.1796 178.6345 361 D 4.6034 7.5964 117.5147 55.3366 41.7629 177.4560 362 L 4.2614 7.4989 117.8622 53.2598 42.4263 175.1332 363 P 4.1493 0.0000 0.0000 63.0603 31.9906 177.3697 364 D 4.5750 8.0095 121.8473 52.8546 39.1692 175.8764 365 Y 4.3976 7.1544 117.5567 58.1218 38.9840 176.9490 366 D 4.5397 8.6625 122.9529 54.1939 41.5980 176.4812 367 V 3.7520 8.1703 121.6249 61.8927 32.1688 174.3189 368 P 4.2946 0.0000 0.0000 62.3162 31.9689 175.3383 369 P 4.3126 0.0000 0.0000 66.0399 31.3547 177.7252 370 H 4.4744 8.1180 110.7397 56.9172 28.6093 175.5316 371 L 4.4413 7.7948 119.7867 54.9148 42.1538 176.8385 372 R 4.1861 7.6768 118.2698 55.8187 31.2067 175.9924 373 N 4.1248 8.6234 114.0334 54.5473 35.5479 175.3234 374 A 4.5935 7.3117 120.5042 49.6097 19.4321 173.8912 375 P 4.6144 0.0000 0.0000 61.4833 33.4420 175.6769 376 T 4.6751 7.8187 107.2101 59.6945 71.7255 173.6788 377 N 4.4739 8.6034 116.0938 54.0173 37.2680 175.3922 378 L 4.0103 7.3825 120.2079 57.8548 42.5801 178.6525 379 M 4.2767 7.8422 120.6463 57.3948 32.1572 176.9376 380 K 4.3130 7.4056 112.8536 55.3890 35.5267 173.4359 381 E 3.7440 8.8262 124.8841 56.0348 28.8933 174.3536 *403 N 4.4516 8.2126 120.6058 53.4259 39.8211 173.6093 404 Y 4.4945 8.7147 121.5220 57.8874 39.0078 175.5714 405 F 4.6826 8.2049 119.0114 55.0232 40.8116 173.8795 406 P 4.4088 0.0000 0.0000 62.2813 32.1450 175.7921 407 P 4.1904 0.0000 0.0000 65.9596 31.3568 178.7825 408 E 3.8534 7.8307 115.6368 58.6482 29.5677 177.7010 409 L 4.4230 7.8149 117.1455 53.7639 42.1085 175.8245 410 K 4.0089 7.2013 119.7530 58.5979 32.1989 176.6153 411 D 4.6673 8.7827 123.6679 54.3040 38.4620 174.6488 412 T 3.5219 6.7762 116.3745 63.7122 68.6793 173.3352 413 Q 4.2651 8.1630 125.6298 54.5724 31.5838 173.9012 414 Y 4.7735 8.4933 122.3200 58.9929 39.5588 175.1227 415 Y 4.7667 7.7950 120.7111 56.3072 39.1672 175.0560 416 F 4.4257 8.3481 127.3866 53.9459 39.0230 172.9037 417 P 3.9414 0.0000 0.0000 62.8124 31.5486 177.3289 418 T 4.3795 8.5116 111.5883 61.0737 70.2231 173.5287 419 N 4.8744 8.3855 116.2785 53.9169 39.2350 175.4789 420 R 4.6675 7.6470 116.6971 55.2543 34.1006 177.0017 421 G 3.7870 8.5348 109.1960 47.0830 0.0000 175.2167 422 M 4.5969 8.7036 119.7816 56.5793 32.2492 178.0226 423 E 4.1751 8.3169 119.1799 58.4596 29.5934 178.7996 424 I 3.6956 7.6896 120.6658 64.6744 36.7459 178.2583 425 Q 3.9987 8.0101 117.9783 58.9318 28.6013 178.5562 426 I 3.7486 7.5454 120.6965 64.3349 37.1334 178.3063 427 K 3.8605 8.2589 120.3759 59.7063 32.0934 178.4583 428 E 3.9541 8.0798 118.6702 59.3549 29.2794 179.5167 429 K 3.9618 8.1540 119.4856 59.4863 32.1483 178.9817 430 L 4.0041 8.0864 118.3739 57.7165 41.7535 179.1098 431 E 4.0794 8.5413 118.8443 59.4208 29.2526 178.9866 432 R 3.9092 7.6659 117.5463 59.4540 30.1961 177.5325 433 L 4.3977 7.7603 115.4504 56.0484 40.9990 177.0188 434 R 4.1846 7.9227 125.2942 57.0030 30.1810 175.5340 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 251 G 8.35 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 0.00 252 D 7.48 4.30 0.00 2.87 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 0.00 253 R 9.16 3.70 0.00 1.44 1.21 0.00 2.99 0.00 0.00 2.72 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.26 0.00 254 F 8.05 4.87 0.00 3.10 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 0.00 255 Y 8.25 4.38 0.00 3.19 3.04 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 0.00 0.00 0.00 256 D 8.03 3.95 0.00 2.67 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 0.00 257 L 7.89 3.83 0.00 2.01 1.92 1.16 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 258 I 8.17 3.75 2.26 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 1.33 0.74 1.07 0.00 0.00 259 S 8.01 3.90 0.00 3.30 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 260 A 7.64 3.56 -0.04 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 0.00 0.00 0.00 0.00 0.00 261 L 7.99 4.03 0.00 1.95 1.93 1.09 1.31 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 0.00 262 H 8.62 4.13 0.00 3.21 3.40 0.00 5.67 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 0.00 263 K 8.17 3.86 0.00 1.86 1.80 0.00 1.63 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.33 1.49 7.81 264 S 8.23 4.19 0.00 4.16 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 0.00 265 V 8.09 3.57 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 1.10 0.00 0.00 1.03 0.00 0.00 266 R 8.29 4.00 0.00 1.80 2.10 0.00 3.26 0.00 0.00 3.20 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 267 G 7.90 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 0.00 268 S 8.38 4.51 0.00 3.99 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 0.00 269 A 8.07 4.72 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 0.00 270 P 0.00 4.41 0.00 2.30 2.35 0.00 3.91 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.93 0.00 271 D 8.09 4.33 0.00 2.72 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 0.00 272 A 8.08 4.04 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 273 A 8.32 4.17 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 274 L 8.28 4.10 0.00 1.98 1.83 0.98 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 275 Y 8.12 3.91 0.00 2.89 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 276 W 8.29 4.28 0.00 3.54 3.37 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 0.00 277 Y 8.55 4.32 0.00 3.09 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 0.00 278 A 8.38 3.67 1.19 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 0.00 279 R 7.89 3.66 0.00 1.96 2.00 0.00 3.00 0.00 0.00 2.75 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.93 0.00 280 I 7.82 3.70 2.04 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.85 0.58 0.00 0.00 281 L 7.60 3.97 0.00 1.58 1.53 0.19 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 282 T 7.90 3.87 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 1.14 0.00 0.00 283 A 7.71 4.48 1.58 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 0.00 0.00 284 G 8.19 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 0.00 0.00 0.00 285 G 7.73 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 0.00 0.00 0.00 286 D 7.83 4.50 0.00 2.60 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 287 P 0.00 4.25 0.00 1.87 2.08 0.00 3.58 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.16 0.00 288 L 7.78 3.16 0.00 1.37 1.01 0.61 -1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 289 Y 7.47 3.95 0.00 2.95 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 0.00 290 V 7.70 3.41 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 0.88 0.00 0.00 1.14 0.00 0.00 291 A 7.84 3.83 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 292 R 8.02 4.09 0.00 1.92 1.99 0.00 3.21 0.00 0.00 3.36 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.77 0.00 293 R 7.45 3.93 0.00 1.72 1.81 0.00 2.31 0.00 0.00 2.80 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.41 0.00 294 L 8.21 3.91 0.00 1.79 1.68 0.77 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 295 L 7.97 3.97 0.00 1.96 1.74 1.04 0.72 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 0.00 296 A 7.79 4.00 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 0.00 297 I 8.01 3.65 1.94 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 1.22 0.55 0.91 0.00 0.00 298 A 8.20 4.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 299 S 7.63 4.16 0.00 3.95 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 0.00 300 E 8.35 3.78 0.00 1.32 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 2.00 1.47 0.00 301 D 8.50 4.75 0.00 2.76 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 0.00 302 V 7.80 3.94 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 1.18 0.00 0.00 0.96 0.00 0.00 303 G 8.91 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 0.00 0.00 0.00 304 N 8.91 4.72 0.00 3.03 2.97 0.00 0.00 6.71 7.35 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 0.00 305 A 8.07 4.14 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 306 D 7.98 4.78 0.00 2.69 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 307 P 0.00 4.47 0.00 2.10 2.11 0.00 3.77 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.13 0.00 308 R 8.23 4.14 0.00 2.14 1.97 0.00 3.19 0.00 0.00 3.21 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.61 0.00 309 A 8.20 4.13 1.49 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 0.00 0.00 310 M 8.07 3.91 0.00 2.07 2.07 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 2.64 2.60 0.00 311 Q 8.00 3.92 0.00 2.23 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.69 0.00 0.00 0.00 0.00 0.00 2.41 2.38 0.00 312 V 7.38 3.36 1.73 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 0.59 0.00 0.00 0.11 0.00 0.00 313 A 7.88 3.99 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 0.00 314 L 8.27 4.00 0.00 1.65 1.65 0.84 0.88 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 0.00 315 A 8.32 3.97 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 0.00 316 A 8.17 3.99 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 0.00 317 W 8.23 4.12 0.00 3.46 3.20 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 0.00 318 D 8.67 4.54 0.00 2.96 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 0.00 319 C 8.38 4.19 0.00 3.28 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 0.00 320 F 8.29 4.27 0.00 3.14 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 0.00 321 T 8.39 4.14 4.59 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 1.32 0.00 0.00 322 R 7.83 4.33 0.00 1.92 1.98 0.00 3.17 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.81 0.00 323 V 9.03 4.03 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 0.83 0.00 0.00 0.95 0.00 0.00 324 G 6.84 3.52 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 0.00 325 A 7.81 3.52 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 326 Y 7.50 4.15 0.00 3.08 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 0.00 327 E 8.32 4.12 0.00 2.12 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 2.41 2.48 0.00 328 G 8.40 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 0.00 329 E 8.52 4.43 0.00 2.39 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 0.00 2.38 2.41 0.00 330 R 7.93 4.00 0.00 2.08 2.04 0.00 3.53 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.77 0.00 331 A 8.40 4.06 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 0.00 0.00 332 I 8.26 3.56 2.02 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.77 0.54 0.00 0.00 333 A 8.33 3.90 1.55 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 0.00 0.00 334 Q 8.17 3.92 0.00 2.18 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 2.40 2.44 0.00 335 A 8.23 3.99 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 0.00 336 I 7.98 3.59 1.92 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.46 0.91 0.00 0.00 337 I 7.96 3.72 2.06 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 1.45 1.12 0.95 0.00 0.00 338 Y 8.23 4.02 0.00 3.17 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 339 L 8.15 4.11 0.00 1.69 1.76 0.98 1.19 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 0.00 340 S 8.36 4.45 0.00 4.04 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 0.00 341 V 7.59 4.04 2.02 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 0.71 0.00 0.00 0.89 0.00 0.00 342 A 6.76 3.99 1.15 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 0.00 0.00 343 P 0.00 4.40 0.00 2.19 2.06 0.00 3.62 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.97 0.00 344 K 8.20 4.74 0.00 1.74 1.86 0.00 1.80 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.33 1.32 7.81 345 S 8.78 4.53 0.00 3.83 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 0.00 346 N 9.09 5.21 0.00 3.12 3.09 0.00 0.00 6.62 7.07 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 0.00 347 A 8.21 4.21 1.58 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 0.00 0.00 348 V 8.02 3.68 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 1.09 0.00 0.00 0.90 0.00 0.00 349 Y 8.32 4.30 0.00 3.14 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 0.00 350 T 8.44 3.89 4.33 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 1.42 0.00 0.00 351 A 8.27 4.27 1.71 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 0.00 0.00 352 F 8.42 4.14 0.00 3.04 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 0.00 353 N 7.84 3.84 0.00 2.71 2.62 0.00 0.00 7.06 7.04 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 0.00 354 T 7.76 3.70 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 1.34 0.00 0.00 355 A 7.27 2.97 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 356 K 7.58 3.60 0.00 0.94 1.41 0.00 1.36 0.00 0.00 1.17 0.00 0.00 2.87 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.22 1.20 7.81 357 Q 7.83 3.86 0.00 2.18 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.57 0.00 0.00 0.00 0.00 0.00 2.30 2.55 0.00 358 Q 8.26 3.99 0.00 2.29 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.55 0.00 0.00 0.00 0.00 0.00 2.46 2.58 0.00 359 A 7.94 4.08 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 0.00 360 K 7.65 4.05 0.00 1.89 1.84 0.00 1.63 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.62 7.81 361 D 7.60 4.60 0.00 2.67 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 362 L 7.50 4.26 0.00 1.67 1.60 1.06 1.02 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 0.00 363 P 0.00 4.15 0.00 1.02 1.71 0.00 3.43 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.99 0.00 364 D 8.01 4.57 0.00 2.60 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 365 Y 7.15 4.40 0.00 3.05 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 0.00 366 D 8.66 4.54 0.00 2.72 2.65 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 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0.00 4.61 0.00 2.19 2.09 0.00 3.71 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 1.98 1.95 0.00 376 T 7.82 4.68 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 1.20 0.00 0.00 377 N 8.60 4.47 0.00 2.68 2.83 0.00 0.00 6.88 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 0.00 378 L 7.38 4.01 0.00 1.76 1.50 0.90 0.66 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 0.00 379 M 7.84 4.28 0.00 2.16 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 2.56 2.52 0.00 380 K 7.41 4.31 0.00 1.84 1.76 0.00 1.53 0.00 0.00 1.63 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.31 1.37 7.81 381 E 8.83 3.74 0.00 1.94 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 2.30 2.33 0.00 *403 N 8.21 4.45 0.00 2.71 2.73 0.00 0.00 7.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 404 Y 8.71 4.49 0.00 2.97 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 0.00 405 F 8.20 4.68 0.00 3.19 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 0.00 406 P 0.00 4.41 0.00 1.93 1.88 0.00 3.98 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.28 0.00 407 P 0.00 4.19 0.00 2.06 2.06 0.00 3.46 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 2.06 2.10 0.00 408 E 7.83 3.85 0.00 1.16 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 2.18 2.25 0.00 409 L 7.81 4.42 0.00 1.74 1.36 1.27 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 410 K 7.20 4.01 0.00 1.84 1.68 0.00 1.82 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.44 7.81 411 D 8.78 4.67 0.00 2.80 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 412 T 6.78 3.52 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 0.46 0.00 0.00 413 Q 8.16 4.27 0.00 1.81 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.88 0.00 0.00 0.00 0.00 0.00 1.16 1.96 0.00 414 Y 8.49 4.77 0.00 3.14 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 0.00 415 Y 7.79 4.77 0.00 2.85 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 0.00 416 F 8.35 4.43 0.00 3.04 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 0.00 417 P 0.00 3.94 0.00 2.04 1.79 0.00 3.38 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.69 0.00 418 T 8.51 4.38 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 0.00 419 N 8.39 4.87 0.00 2.72 2.87 0.00 0.00 6.64 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 0.00 420 R 7.65 4.67 0.00 1.79 1.79 0.00 3.28 0.00 0.00 3.18 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.65 0.00 421 G 8.53 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 0.00 0.00 0.00 422 M 8.70 4.60 0.00 2.08 2.33 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.64 0.00 423 E 8.32 4.18 0.00 2.25 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 2.47 2.52 0.00 424 I 7.69 3.70 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 1.59 0.98 0.92 0.00 0.00 425 Q 8.01 4.00 0.00 2.16 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.88 0.00 0.00 0.00 0.00 0.00 2.46 2.52 0.00 426 I 7.55 3.75 2.08 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.80 1.08 0.00 0.00 427 K 8.26 3.86 0.00 1.87 1.98 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.43 1.45 7.81 428 E 8.08 3.95 0.00 2.25 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 2.34 2.41 0.00 429 K 8.15 3.96 0.00 1.84 1.97 0.00 1.65 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.49 7.81 430 L 8.09 4.00 0.00 1.62 1.72 1.05 0.87 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 0.00 431 E 8.54 4.08 0.00 2.02 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 2.33 2.54 0.00 432 R 7.67 3.91 0.00 1.85 2.29 0.00 3.38 0.00 0.00 3.29 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.69 0.00 433 L 7.76 4.40 0.00 1.84 1.77 0.95 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 434 R 7.92 4.18 0.00 2.11 1.87 0.00 3.53 0.00 0.00 3.25 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 * Residues marked with a * may have inaccurate shift predictions.