NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.5550 8.3301 115.5546 58.3429 62.7135 171.9142 2 A 4.6757 7.6994 125.9699 48.3859 23.2933 169.9414 3 V 4.0725 8.2917 111.8960 61.3899 35.5325 170.4252 4 T 4.4266 8.9039 123.2844 63.5546 69.0754 173.8667 5 I 4.3409 8.9800 128.9594 59.8780 39.4175 175.3405 6 T 4.5131 8.4706 124.5558 63.2493 70.0945 173.4822 7 L 4.4555 7.9575 126.1808 52.7401 44.5539 175.3811 8 K 5.0352 9.3143 126.2493 54.1773 34.5216 174.9759 9 T 5.1010 8.0317 116.0364 59.5889 70.9064 174.9889 10 L 3.3956 8.2136 126.2737 58.6072 42.0898 178.2731 11 Q 4.1284 7.9944 114.7094 56.6704 28.6636 175.4917 12 Q 3.5311 8.9958 119.3349 57.2385 27.3950 173.2412 13 Q 4.3105 8.1056 117.6170 54.2264 30.2513 174.0684 14 T 4.4512 8.0823 119.6993 59.9237 69.9774 172.0503 15 F 4.9317 6.7200 115.5852 56.7255 42.0017 173.9241 16 K 4.7332 8.9914 120.5235 56.2578 35.0191 176.0514 17 I 4.3337 8.9045 128.1805 60.7270 39.6338 175.9532 18 R 5.0037 8.7831 118.6076 57.7156 34.1994 175.1049 19 M 3.1229 7.8071 114.9466 56.3346 32.5088 175.2333 20 E 4.7488 8.2469 116.2582 53.9646 33.3010 174.4709 21 P 4.7801 0.0000 0.0000 61.2227 30.0226 174.7080 22 D 4.5229 7.5689 122.2822 54.2964 43.2046 178.2725 23 E 4.0053 7.5880 121.4038 56.7105 30.6236 176.6505 24 T 4.3386 8.8090 116.3944 62.4658 69.2450 175.1756 25 V 3.6375 10.1031 124.2853 65.6227 31.2986 178.1894 26 K 3.9317 8.0775 119.1456 59.7439 31.9769 178.6049 27 V 3.6436 8.1003 118.5947 65.6368 31.4125 177.7372 28 L 3.9992 7.8531 119.8346 57.9467 41.8143 178.8257 29 K 3.9605 8.6714 118.7422 59.8001 32.2099 179.1984 30 E 4.0081 8.0225 118.6969 59.1390 29.2407 179.2812 31 K 3.9886 8.4216 120.3059 59.5502 32.1854 178.9251 32 I 3.8094 7.8409 120.3169 64.1404 36.9171 177.9288 33 E 4.1277 8.1309 120.2200 58.6992 29.2027 178.1754 34 A 4.2331 7.6231 118.9791 53.4085 19.6696 178.6951 35 E 3.7820 8.4617 117.8600 59.1843 29.8584 178.2944 36 K 3.7233 7.3980 117.3310 57.2322 32.8453 174.2964 37 G 3.5835 6.8101 103.0789 44.1299 0.0000 173.6913 38 R 4.6882 8.1962 119.0880 56.1130 30.6973 176.7213 39 D 4.5062 8.3569 118.2871 56.8367 40.9370 178.0395 40 A 4.7199 7.9346 118.1603 52.6331 20.0319 176.4440 41 F 4.5883 8.2233 119.5820 56.4736 38.9298 174.4402 42 P 4.6852 0.0000 0.0000 61.8944 33.9226 175.9805 43 V 4.1440 8.2968 114.2320 64.5244 33.5820 178.1893 44 A 4.0036 8.3123 121.7143 55.0950 18.1067 178.4736 45 G 4.5540 7.7651 101.6349 45.6036 0.0000 173.7447 46 Q 5.3860 8.3339 124.4804 53.8793 28.8070 173.9002 47 K 4.4382 8.1776 124.4670 54.2134 35.3164 175.6425 48 L 4.5805 8.2476 125.6153 53.7196 41.0139 174.6619 49 I 4.2140 8.0851 122.9514 61.7029 37.8081 175.5463 50 Y 4.6169 8.5042 126.1719 57.8860 41.3342 175.8217 51 A 4.5605 7.6699 120.9923 50.8752 19.6903 174.8716 52 G 4.2594 8.3012 117.7186 44.9639 0.0000 172.9756 53 K 4.4339 7.3827 121.0655 54.0951 33.8057 174.9891 54 I 4.1958 7.9251 117.6390 60.3944 38.4409 175.4449 55 L 3.7238 9.1198 126.9825 54.5717 42.6750 177.8760 56 S 4.6616 8.3740 119.6626 58.1296 64.0277 174.1672 57 D 4.9287 8.6048 119.2606 53.5664 39.6385 175.4533 58 D 4.8316 8.3364 116.4958 54.3988 41.6953 175.7577 59 V 4.5264 7.3783 111.0947 59.0707 34.8822 173.1516 60 P 4.2366 0.0000 0.0000 62.4874 31.8041 177.4628 61 I 3.7220 8.1980 120.8891 63.7561 37.9746 176.4897 62 R 4.4141 7.8600 118.5931 56.2988 29.8124 175.9066 63 D 4.4143 8.1373 118.1442 55.9976 41.4807 176.8884 64 Y 4.3240 7.8111 114.2373 57.6551 38.5780 174.8136 65 R 3.7985 8.0300 118.5193 56.9125 28.2190 175.6327 66 I 3.7352 7.5823 115.4495 60.7189 38.0092 175.4649 67 D 4.7780 8.0135 119.9400 52.3767 44.2171 176.5323 68 E 3.7652 9.0018 124.0755 58.3920 29.6290 178.2469 69 K 4.1509 8.1281 116.6334 58.2278 32.3450 176.3720 70 N 4.9929 8.6277 116.2184 51.0184 41.5580 173.5121 71 F 4.9108 7.4742 115.9817 55.3488 40.7175 175.2774 72 V 4.2700 8.1155 120.9995 61.5534 32.5006 175.9459 73 V 4.4745 8.5547 131.1366 62.3439 28.4686 175.6291 74 V 4.0737 9.1810 124.7362 61.9811 33.0078 176.2144 75 M 4.4301 9.0970 122.5050 53.7850 34.6065 176.3425 76 V 5.1062 7.3804 111.8396 60.7747 31.3889 174.3982 77 T 3.8736 7.8211 115.1215 62.4828 70.2797 176.0029 *160 G 4.0997 8.2573 109.7214 45.7881 0.0000 175.0453 161 S 4.1719 7.8597 114.2456 60.7174 63.2327 176.5290 162 E 4.1649 8.2966 120.6358 59.6419 29.0075 178.8139 163 Y 4.2090 7.9366 119.1095 60.4450 39.0271 177.2518 164 E 3.1371 7.1195 118.0351 59.4880 29.2262 179.3312 165 T 3.8454 8.2718 115.9002 66.8124 68.4047 176.3476 166 M 4.0955 7.5880 120.1934 57.8367 32.1157 178.3494 167 L 4.0201 8.0254 119.6714 58.4473 41.6700 179.7922 168 T 4.1084 7.9018 115.2222 66.2918 68.1601 176.8394 169 E 3.9695 7.6520 119.6992 58.6387 29.7011 178.2851 170 I 4.2456 7.7759 118.4047 63.3655 38.3161 177.4197 171 M 4.0127 8.3632 119.4089 59.4316 31.8076 178.4612 172 S 3.6846 7.5941 113.6059 62.2424 63.0174 176.4665 173 M 4.2168 8.5311 121.0197 56.9623 31.7596 177.0686 174 G 3.8657 8.2310 116.6874 46.0987 0.0000 172.4395 175 Y 4.4157 6.9102 118.0550 57.9694 38.9991 175.7738 176 E 4.4943 8.5137 122.5450 57.0334 30.7505 176.3506 177 R 4.4813 8.4047 116.0318 59.3583 31.8405 178.0553 178 E 4.0957 8.0474 117.5861 59.5523 29.5779 179.6485 179 R 4.0210 7.9948 117.7604 58.8101 30.0872 179.1286 180 V 3.5117 7.6754 118.1694 66.0004 31.4419 178.4211 181 V 3.6323 7.8954 116.8323 64.7526 31.4168 177.4762 182 A 4.0900 8.0678 121.1394 55.0783 18.2539 179.5736 183 A 4.1245 7.9949 119.0763 55.0300 18.5091 179.1068 184 L 4.2573 8.4701 117.1952 55.4991 41.4225 178.4039 185 R 4.3965 7.7966 118.5392 56.8347 30.9935 176.6960 186 A 4.7817 7.9369 117.2777 51.4244 20.2151 176.4583 187 S 4.8118 8.8030 113.2527 58.0246 63.5262 173.9296 188 Y 3.5247 8.2486 117.8924 60.9347 36.7639 168.6103 189 N 4.6935 7.9881 110.2222 52.7552 36.5347 173.6478 190 N 5.0028 7.4003 114.0729 50.4306 41.9601 173.9788 191 P 4.3696 0.0000 0.0000 64.8580 31.1962 177.4432 192 H 4.3984 7.5705 117.9460 58.0894 28.8469 177.3330 193 R 3.4423 8.1737 121.0359 59.3054 30.3615 178.1417 194 A 4.2121 7.5533 120.6106 55.3045 17.8330 179.4697 195 V 3.2332 7.4572 114.6569 66.3687 31.2688 178.4711 196 E 4.0550 7.4070 116.7201 59.1793 29.3997 177.8643 197 Y 4.7881 8.3412 114.6966 58.3842 38.1306 176.5524 198 L 4.2818 7.7026 121.4212 55.4840 42.6497 178.0233 199 L 4.4174 7.4312 117.7567 57.7352 41.7618 178.2915 200 T 4.3934 7.6398 109.8850 64.2997 71.9891 174.7453 *232 L 4.4437 7.8280 121.8751 54.8844 44.1326 178.0642 233 E 3.8883 8.2749 118.4871 58.8266 29.5642 178.0969 234 F 4.1866 8.6194 113.2295 59.7469 37.9059 176.5064 235 L 3.6612 6.0803 119.5606 57.0538 42.0016 178.2900 236 R 2.5100 7.0791 117.1242 58.1207 29.8451 176.8951 237 D 4.6122 7.4755 115.5980 54.1253 42.1641 176.7699 238 Q 4.3054 7.2643 118.8245 54.9164 30.8498 175.1431 239 P 4.3571 0.0000 0.0000 65.8508 31.1370 178.6539 240 Q 3.9526 7.9930 117.1030 59.0289 28.9928 177.8387 241 F 4.0558 8.2046 120.9696 61.4014 39.4625 176.7808 242 Q 4.1254 8.1010 117.7508 59.4183 28.6243 178.9371 243 N 4.4328 8.1388 116.5485 55.8861 38.3468 176.7255 244 M 4.0815 7.9087 118.7305 56.7144 32.5041 176.8904 245 R 4.3049 7.4531 115.7355 56.2904 31.0204 175.9346 246 Q 4.4322 7.9256 118.5099 58.2185 30.4861 177.3890 247 V 3.7862 7.6649 119.7800 64.4359 31.7748 178.4653 248 I 4.4705 7.6295 121.2108 63.5795 36.6892 177.6743 249 Q 4.0779 7.4240 119.7934 58.2083 28.7997 176.6286 250 Q 4.4491 7.8225 117.3232 55.3605 30.2732 174.9631 251 N 4.6649 8.0229 116.5941 51.7216 39.7238 172.7715 252 P 4.4588 0.0000 0.0000 64.3362 31.5315 177.3863 253 A 4.1564 7.8345 120.3680 54.1958 18.7696 179.0258 254 L 4.0071 7.8042 117.2762 57.0147 41.7317 178.7422 255 L 3.8935 7.3490 121.2498 57.7413 42.1374 177.3804 256 P 4.1949 0.0000 0.0000 65.8117 31.3172 177.9888 257 A 3.9879 7.7345 120.8661 54.8042 18.2309 179.6661 258 L 3.9312 8.4945 117.6237 57.7585 41.6771 179.1611 259 L 4.0205 8.0167 119.4006 57.7648 41.8911 177.9575 260 Q 4.3140 7.7903 116.9389 57.2198 29.3327 174.9692 261 Q 4.3649 7.6555 118.9321 57.6624 30.4477 177.0596 262 L 3.9443 7.5725 120.0623 58.2739 42.6192 179.6664 263 G 3.6135 8.2520 106.7931 47.9610 0.0000 173.5865 264 Q 4.4827 7.4264 119.6895 55.8822 28.9427 175.4109 265 E 4.4300 8.3182 118.4257 55.5583 31.7473 175.8498 266 N 4.9108 7.9477 116.8113 51.0099 39.9322 173.7087 267 P 4.4170 0.0000 0.0000 65.4028 31.4023 178.3258 268 Q 3.9177 8.1894 117.3650 58.5443 28.8037 177.4715 269 L 4.5313 8.1003 120.0651 56.8654 42.5704 177.7903 270 L 3.7878 7.9160 120.5646 58.3835 41.6830 179.0936 271 Q 3.9957 7.8843 116.2025 58.3329 28.6924 177.3548 272 Q 4.2601 7.7267 120.1287 58.1145 30.1843 176.7691 273 I 3.6827 8.3671 120.6151 64.4702 37.5728 177.4167 274 S 4.1186 7.6236 114.0091 60.9337 62.7420 175.3765 275 R 4.4950 7.8481 117.5593 56.3598 31.4547 176.6486 276 H 5.1236 8.6368 116.7028 54.8782 29.3095 175.7720 277 Q 4.1992 8.0656 124.9933 59.3793 28.5966 178.8464 278 E 4.0401 8.1273 119.2117 59.5595 29.5556 178.9955 279 Q 4.0826 8.0654 117.6333 58.5759 28.6701 178.1881 280 F 4.0968 8.6228 121.4897 61.5434 39.5907 177.0446 281 I 4.0790 7.8268 117.6366 64.4837 37.0040 178.2506 282 Q 4.3620 8.1024 117.9357 57.2595 28.5995 176.0117 283 M 4.1052 7.3227 119.6936 53.9258 31.9973 174.8902 *317 T 4.2200 7.9677 116.4914 60.5881 69.9755 172.6764 318 P 4.4994 0.0000 0.0000 64.4280 31.2244 177.3049 319 Q 4.3854 7.8061 117.8109 58.4756 29.7022 177.4806 320 E 4.3195 8.1640 118.8170 58.9438 29.6689 178.7821 321 K 3.8034 8.2074 119.9627 59.6839 31.8325 178.4931 322 E 3.9931 7.8987 117.3327 59.2203 29.2141 178.9674 323 A 3.8324 8.0168 120.6406 54.1782 18.2779 179.6698 324 I 3.7046 7.2195 118.3421 64.0332 37.4626 177.8101 325 E 3.9592 8.5641 118.7840 59.4224 29.1279 179.3760 326 R 3.8392 7.6525 119.3014 59.1412 30.1552 178.2899 327 L 4.0068 7.5210 118.6714 57.9345 41.5483 179.5268 328 K 4.4656 8.7551 119.1558 58.4695 31.2358 177.7524 329 A 4.2814 7.5052 120.1588 53.8828 18.9179 179.1872 330 L 3.9363 7.9334 117.2066 56.4329 41.6556 176.7559 331 G 3.1029 6.2281 108.3233 44.8643 0.0000 173.9690 332 F 4.8812 7.1048 120.7336 55.8733 40.2496 174.9142 333 P 4.7614 0.0000 0.0000 62.6611 31.8587 173.0823 334 E 4.5116 8.1601 112.5304 57.4358 32.7119 178.6823 335 S 4.1731 8.1700 112.8830 62.0665 62.6525 176.6973 336 L 4.1000 7.9381 121.1738 56.4702 41.4723 178.8162 337 V 3.8073 8.1668 119.0580 65.3047 31.5754 177.4675 338 I 3.6204 7.7332 117.4002 64.3888 37.9948 177.1961 339 Q 4.1911 7.9932 120.1179 58.8803 28.8802 177.5049 340 A 4.1392 7.6994 121.4037 55.4031 18.3901 178.3013 341 Y 4.4526 7.7846 117.4383 60.7337 39.9550 177.7891 342 F 4.4021 7.3593 117.6663 57.0113 36.7100 174.6701 343 A 4.1555 7.0727 125.6932 53.3276 19.3868 177.3281 344 C 4.6663 7.6077 113.0210 59.7327 33.8962 175.7661 345 E 4.5716 7.7380 116.7683 55.7537 29.9857 176.5941 346 K 4.0468 8.2038 116.3361 57.3874 30.7444 175.5298 347 N 4.8711 7.4669 115.1284 52.4233 40.2597 175.2177 348 E 4.7215 8.7978 119.5478 56.9802 30.5883 175.6954 349 N 4.9091 8.0409 115.9744 55.0272 40.9639 176.3171 350 L 3.9794 8.3430 117.4166 58.0830 42.0232 179.5949 351 A 4.3856 8.3017 120.2359 55.3481 19.1149 179.4219 352 A 3.7300 8.1211 117.2710 55.1794 18.7673 178.7652 353 N 4.1197 8.6744 116.3583 57.0898 38.9557 176.9132 354 F 4.3461 8.0497 114.0525 59.3498 37.9412 177.0092 355 L 3.1102 6.9622 120.9322 56.8688 41.5602 178.3058 356 L 4.0130 8.1734 119.0530 56.8887 41.5945 178.9680 357 S 4.2725 7.7521 114.0903 60.9101 63.0193 176.0491 358 Q 4.2127 7.6974 119.5318 57.9671 28.7177 176.7743 359 N 4.5900 7.6034 117.1562 55.5415 39.5584 174.7109 360 F 4.0726 8.1878 123.0866 57.6950 39.0818 175.5878 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 S 8.33 4.55 0.00 3.90 3.88 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 2 A 7.70 4.68 1.22 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 0.00 0.00 3 V 8.29 4.07 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 0.70 0.00 0.00 0.92 0.00 0.00 4 T 8.90 4.43 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 1.31 0.00 0.00 5 I 8.98 4.34 1.89 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 1.48 1.06 0.86 0.00 0.00 6 T 8.47 4.51 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 1.28 0.00 0.00 7 L 7.96 4.46 0.00 1.40 1.29 1.00 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 8 K 9.31 5.04 0.00 1.88 1.70 0.00 1.52 0.00 0.00 1.61 0.00 0.00 2.86 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.86 0.51 7.81 9 T 8.03 5.10 4.80 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 1.86 0.00 0.00 10 L 8.21 3.40 0.00 1.55 1.76 0.93 0.71 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 11 Q 7.99 4.13 0.00 2.24 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.20 0.00 0.00 0.00 0.00 0.00 2.51 2.47 0.00 12 Q 9.00 3.53 0.00 2.07 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.84 0.00 0.00 0.00 0.00 0.00 2.21 2.27 0.00 13 Q 8.11 4.31 0.00 2.27 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.06 6.40 0.00 0.00 0.00 0.00 0.00 2.28 2.34 0.00 14 T 8.08 4.45 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 1.08 0.00 0.00 15 F 6.72 4.93 0.00 3.10 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 16 K 8.99 4.73 0.00 1.68 1.80 0.00 1.77 0.00 0.00 1.73 0.00 0.00 2.75 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.36 1.51 7.81 17 I 8.90 4.33 1.97 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.25 0.97 0.00 0.00 18 R 8.78 5.00 0.00 1.85 1.83 0.00 3.34 0.00 0.00 3.36 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.60 0.00 19 M 7.81 3.12 0.00 2.26 2.08 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.56 0.00 20 E 8.25 4.75 0.00 2.01 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 2.28 2.25 0.00 21 P 0.00 4.78 0.00 2.17 2.10 0.00 3.90 0.00 0.00 3.69 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 22 D 7.57 4.52 0.00 2.64 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 23 E 7.59 4.01 0.00 2.10 1.92 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 2.33 2.35 0.00 24 T 8.81 4.34 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 25 V 10.10 3.64 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 1.15 0.00 0.00 1.11 0.00 0.00 26 K 8.08 3.93 0.00 1.92 1.81 0.00 1.80 0.00 0.00 1.76 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.71 1.44 7.81 27 V 8.10 3.64 2.22 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 1.07 0.00 0.00 0.99 0.00 0.00 28 L 7.85 4.00 0.00 1.79 1.80 0.95 0.57 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 29 K 8.67 3.96 0.00 1.99 1.88 0.00 1.76 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.57 1.70 7.81 30 E 8.02 4.01 0.00 2.17 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 0.00 2.35 2.49 0.00 31 K 8.42 3.99 0.00 2.03 1.97 0.00 1.53 0.00 0.00 1.66 0.00 0.00 3.06 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.56 7.81 32 I 7.84 3.81 2.24 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 1.70 0.87 1.30 0.00 0.00 33 E 8.13 4.13 0.00 2.06 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.38 0.00 34 A 7.62 4.23 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 35 E 8.46 3.78 0.00 1.91 1.74 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 1.99 1.47 0.00 36 K 7.40 3.72 0.00 0.93 1.15 0.00 1.26 0.00 0.00 1.24 0.00 0.00 2.76 0.00 0.00 2.69 0.00 0.00 0.00 0.00 0.30 0.33 7.81 37 G 6.81 3.58 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 0.00 38 R 8.20 4.69 0.00 1.73 1.86 0.00 3.26 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.82 0.00 39 D 8.36 4.51 0.00 2.67 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 A 7.93 4.72 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 41 F 8.22 4.59 0.00 3.05 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 42 P 0.00 4.69 0.00 2.18 2.11 0.00 3.68 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 1.93 0.00 43 V 8.30 4.14 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 0.91 0.00 0.00 0.96 0.00 0.00 44 A 8.31 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 45 G 7.77 4.55 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 0.00 46 Q 8.33 5.39 0.00 2.02 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.94 6.62 0.00 0.00 0.00 0.00 0.00 2.36 2.24 0.00 47 K 8.18 4.44 0.00 1.68 1.66 0.00 1.69 0.00 0.00 1.80 0.00 0.00 2.79 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.56 7.81 48 L 8.25 4.58 0.00 1.74 1.57 0.95 0.66 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 49 I 8.09 4.21 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 1.43 0.85 0.91 0.00 0.00 50 Y 8.50 4.62 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 51 A 7.67 4.56 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 G 8.30 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 53 K 7.38 4.43 0.00 1.77 1.63 0.00 1.73 0.00 0.00 1.88 0.00 0.00 2.93 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.40 7.81 54 I 7.93 4.20 1.71 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 1.33 0.56 0.89 0.00 0.00 55 L 9.12 3.72 0.00 1.37 0.94 0.74 -0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 56 S 8.37 4.66 0.00 3.98 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 57 D 8.60 4.93 0.00 2.76 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 58 D 8.34 4.83 0.00 2.64 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 59 V 7.38 4.53 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 0.88 0.00 0.00 1.07 0.00 0.00 60 P 0.00 4.24 0.00 2.16 2.28 0.00 3.62 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 2.10 1.91 0.00 61 I 8.20 3.72 1.91 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 1.19 0.69 0.99 0.00 0.00 62 R 7.86 4.41 0.00 1.78 1.87 0.00 3.32 0.00 0.00 3.15 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.65 0.00 63 D 8.14 4.41 0.00 2.61 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 Y 7.81 4.32 0.00 3.09 3.12 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 65 R 8.03 3.80 0.00 1.97 2.08 0.00 3.31 0.00 0.00 3.24 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.72 0.00 66 I 7.58 3.74 1.61 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.06 1.53 0.27 0.00 0.00 67 D 8.01 4.78 0.00 2.82 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 68 E 9.00 3.77 0.00 1.92 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 2.32 2.33 0.00 69 K 8.13 4.15 0.00 1.81 1.88 0.00 1.75 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.47 1.49 7.81 70 N 8.63 4.99 0.00 2.89 2.65 0.00 0.00 6.91 7.11 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 71 F 7.47 4.91 0.00 2.93 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 72 V 8.12 4.27 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 0.98 0.00 0.00 0.81 0.00 0.00 73 V 8.55 4.47 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 0.82 0.00 0.00 1.26 0.00 0.00 74 V 9.18 4.07 2.15 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 0.89 0.00 0.00 1.05 0.00 0.00 75 M 9.10 4.43 0.00 2.01 2.10 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 2.51 2.46 0.00 76 V 7.38 5.11 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 0.26 0.00 0.00 0.29 0.00 0.00 77 T 7.82 3.87 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 *160 G 8.26 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 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0.00 194 A 7.55 4.21 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 0.00 195 V 7.46 3.23 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 1.18 0.00 0.00 0.95 0.00 0.00 196 E 7.41 4.05 0.00 1.85 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 2.34 2.43 0.00 197 Y 8.34 4.79 0.00 2.69 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 0.00 198 L 7.70 4.28 0.00 1.05 0.13 0.43 0.92 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 0.00 199 L 7.43 4.42 0.00 1.71 1.81 1.12 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 200 T 7.64 4.39 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 1.23 0.00 0.00 *232 L 7.83 4.44 0.00 1.84 1.74 1.07 0.93 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 0.00 233 E 8.27 3.89 0.00 2.13 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 2.35 2.38 0.00 234 F 8.62 4.19 0.00 3.30 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 0.00 235 L 6.08 3.66 0.00 0.27 1.31 0.97 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 236 R 7.08 2.51 0.00 1.31 1.61 0.00 3.22 0.00 0.00 2.99 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 1.10 0.00 237 D 7.48 4.61 0.00 2.72 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 0.00 238 Q 7.26 4.31 0.00 2.29 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.94 0.00 0.00 0.00 0.00 0.00 2.40 2.50 0.00 239 P 0.00 4.36 0.00 2.28 2.32 0.00 3.72 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.07 0.00 240 Q 7.99 3.95 0.00 2.09 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 7.42 0.00 0.00 0.00 0.00 0.00 2.39 2.45 0.00 241 F 8.20 4.06 0.00 3.11 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 0.00 242 Q 8.10 4.13 0.00 2.34 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.68 0.00 0.00 0.00 0.00 0.00 2.42 2.53 0.00 243 N 8.14 4.43 0.00 3.08 2.84 0.00 0.00 6.63 8.41 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 0.00 244 M 7.91 4.08 0.00 1.49 2.02 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.44 0.00 245 R 7.45 4.30 0.00 1.55 1.95 0.00 3.46 0.00 0.00 3.18 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.78 0.00 246 Q 7.93 4.43 0.00 2.22 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.59 0.00 0.00 0.00 0.00 0.00 2.25 2.32 0.00 247 V 7.66 3.79 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 0.71 0.00 0.00 0.92 0.00 0.00 248 I 7.63 4.47 1.98 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.39 0.89 0.00 0.00 249 Q 7.42 4.08 0.00 2.11 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.76 0.00 0.00 0.00 0.00 0.00 2.38 2.42 0.00 250 Q 7.82 4.45 0.00 2.01 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.60 0.00 0.00 0.00 0.00 0.00 2.24 2.39 0.00 251 N 8.02 4.66 0.00 2.76 2.63 0.00 0.00 7.01 7.86 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 0.00 252 P 0.00 4.46 0.00 2.30 2.28 0.00 3.73 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.02 0.00 253 A 7.83 4.16 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 0.00 254 L 7.80 4.01 0.00 1.93 1.70 0.91 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 255 L 7.35 3.89 0.00 1.84 1.67 0.93 0.89 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 0.00 256 P 0.00 4.19 0.00 2.28 2.27 0.00 3.78 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.02 0.00 257 A 7.73 3.99 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 0.00 258 L 8.49 3.93 0.00 1.86 1.68 0.94 0.44 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 0.00 259 L 8.02 4.02 0.00 1.60 1.80 0.63 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 260 Q 7.79 4.31 0.00 2.18 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.54 0.00 0.00 0.00 0.00 0.00 2.28 2.45 0.00 261 Q 7.66 4.36 0.00 2.09 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.60 0.00 0.00 0.00 0.00 0.00 2.25 2.32 0.00 262 L 7.57 3.94 0.00 1.75 1.63 0.96 0.98 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 0.00 263 G 8.25 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 264 Q 7.43 4.48 0.00 2.09 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.72 0.00 0.00 0.00 0.00 0.00 2.29 2.25 0.00 265 E 8.32 4.43 0.00 2.17 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 2.24 2.25 0.00 266 N 7.95 4.91 0.00 2.94 2.96 0.00 0.00 7.01 8.29 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 0.00 267 P 0.00 4.42 0.00 2.27 2.32 0.00 3.76 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.07 0.00 268 Q 8.19 3.92 0.00 2.18 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.37 6.94 0.00 0.00 0.00 0.00 0.00 2.04 2.32 0.00 269 L 8.10 4.53 0.00 2.08 1.81 1.16 0.78 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 0.00 270 L 7.92 3.79 0.00 2.00 1.68 0.90 0.50 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 0.00 271 Q 7.88 4.00 0.00 2.20 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.48 0.00 0.00 0.00 0.00 0.00 2.59 2.37 0.00 272 Q 7.73 4.26 0.00 2.17 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.76 0.00 0.00 0.00 0.00 0.00 2.17 1.90 0.00 273 I 8.37 3.68 1.96 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 1.25 0.75 0.91 0.00 0.00 274 S 7.62 4.12 0.00 4.04 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 0.00 275 R 7.85 4.49 0.00 1.87 2.07 0.00 3.19 0.00 0.00 3.26 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.64 0.00 276 H 8.64 5.12 0.00 3.31 3.40 0.00 5.67 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 277 Q 8.07 4.20 0.00 2.22 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.17 6.81 0.00 0.00 0.00 0.00 0.00 2.31 2.43 0.00 278 E 8.13 4.04 0.00 2.07 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 2.42 2.42 0.00 279 Q 8.07 4.08 0.00 2.33 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.87 0.00 0.00 0.00 0.00 0.00 2.45 2.48 0.00 280 F 8.62 4.10 0.00 3.16 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 0.00 281 I 7.83 4.08 2.03 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.03 0.98 0.00 0.00 282 Q 8.10 4.36 0.00 2.36 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.88 0.00 0.00 0.00 0.00 0.00 2.42 2.43 0.00 283 M 7.32 4.11 0.00 1.81 2.14 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.40 0.00 *317 T 7.97 4.22 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 1.26 0.00 0.00 318 P 0.00 4.50 0.00 2.27 2.23 0.00 3.79 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.07 0.00 319 Q 7.81 4.39 0.00 2.14 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.98 7.00 0.00 0.00 0.00 0.00 0.00 2.41 2.41 0.00 320 E 8.16 4.32 0.00 2.21 2.34 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 2.74 2.60 0.00 321 K 8.21 3.80 0.00 2.02 1.82 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.50 7.81 322 E 7.90 3.99 0.00 2.30 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 0.00 2.31 2.32 0.00 323 A 8.02 3.83 0.55 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 0.00 324 I 7.22 3.70 1.82 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.98 0.91 0.00 0.00 325 E 8.56 3.96 0.00 2.15 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.48 0.00 326 R 7.65 3.84 0.00 2.07 1.89 0.00 3.06 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.62 0.00 327 L 7.52 4.01 0.00 1.89 1.87 0.98 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 328 K 8.76 4.47 0.00 1.86 1.84 0.00 1.82 0.00 0.00 1.56 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.59 7.81 329 A 7.51 4.28 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 0.00 330 L 7.93 3.94 0.00 1.23 1.12 0.94 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 331 G 6.23 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 0.00 0.00 0.00 332 F 7.10 4.88 0.00 3.17 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 0.00 333 P 0.00 4.76 0.00 2.21 2.15 0.00 3.85 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 2.02 1.99 0.00 334 E 8.16 4.51 0.00 2.00 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 2.28 2.26 0.00 335 S 8.17 4.17 0.00 4.11 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 336 L 7.94 4.10 0.00 1.73 1.75 0.94 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 337 V 8.17 3.81 2.30 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 1.09 0.00 0.00 0.99 0.00 0.00 338 I 7.73 3.62 1.88 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 1.57 1.25 0.98 0.00 0.00 339 Q 7.99 4.19 0.00 2.23 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.54 0.00 0.00 0.00 0.00 0.00 2.49 2.60 0.00 340 A 7.70 4.14 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 0.00 341 Y 7.78 4.45 0.00 2.76 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 0.00 342 F 7.36 4.40 0.00 3.13 2.83 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 0.00 343 A 7.07 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 0.00 344 C 7.61 4.67 0.00 2.88 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 0.00 345 E 7.74 4.57 0.00 2.05 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 2.28 2.25 0.00 346 K 8.20 4.05 0.00 1.84 1.86 0.00 1.82 0.00 0.00 1.81 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 0.67 1.26 7.81 347 N 7.47 4.87 0.00 2.68 2.84 0.00 0.00 6.91 7.58 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 0.00 348 E 8.80 4.72 0.00 1.94 1.93 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 2.16 2.33 0.00 349 N 8.04 4.91 0.00 2.74 2.81 0.00 0.00 7.05 6.76 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 0.00 350 L 8.34 3.98 0.00 1.72 1.78 0.93 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 351 A 8.30 4.39 1.54 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 0.00 0.00 352 A 8.12 3.73 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 0.00 353 N 8.67 4.12 0.00 2.71 2.95 0.00 0.00 7.11 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 0.00 354 F 8.05 4.35 0.00 3.40 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 0.00 355 L 6.96 3.11 0.00 1.11 1.27 0.63 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 356 L 8.17 4.01 0.00 1.58 1.61 0.82 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 357 S 7.75 4.27 0.00 3.97 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 0.00 358 Q 7.70 4.21 0.00 2.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.91 0.00 0.00 0.00 0.00 0.00 2.45 2.84 0.00 359 N 7.60 4.59 0.00 2.63 2.98 0.00 0.00 7.27 6.96 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 0.00 360 F 8.19 4.07 0.00 3.10 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 * Residues marked with a * may have inaccurate shift predictions.