NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8798 8.3544 109.7354 45.0977 0.0000 173.6891 2 S 4.1641 8.5325 119.8354 56.4273 63.1298 171.5136 3 S 4.5120 8.1458 117.7040 57.5228 66.8527 174.8922 4 G 3.7529 8.8785 112.3417 44.5550 0.0000 171.8096 5 S 4.8710 8.2961 111.7487 56.7675 64.9408 174.5314 6 S 4.6860 8.4998 120.4903 58.2363 62.6892 175.6435 7 G 3.6224 7.2808 110.3648 46.2234 0.0000 175.5283 8 R 4.6769 7.3859 118.8765 52.7330 34.4020 174.9756 9 E 4.0224 8.4647 118.4191 56.3559 29.7926 177.7316 10 R 3.9329 8.2590 119.1962 56.5584 29.3726 177.1316 11 R 4.1355 8.0580 122.5333 57.1132 29.8530 178.4067 12 V 2.0000 6.8335 118.0277 64.8138 31.3929 177.8035 13 A 4.0806 7.5245 121.2292 54.1375 18.3950 179.2285 14 S 4.3721 7.1641 111.3422 61.0714 62.4594 175.9396 15 W 4.7406 7.1225 119.3953 57.1733 28.8222 176.2193 16 A 4.7838 8.3601 123.0812 52.6256 20.7079 178.6441 17 V 3.7444 7.4715 114.5978 64.8299 31.5042 175.9624 18 S 4.5054 7.4387 112.0045 56.0942 65.2003 175.9137 19 F 3.9400 8.5937 124.5668 61.4958 39.1271 176.7297 20 E 3.9748 8.6928 117.7775 60.0452 29.1321 179.6702 21 R 4.1696 7.8978 117.4084 58.7156 30.1356 178.6662 22 L 3.8970 8.7450 120.9894 58.1199 41.8282 179.0187 23 L 3.9999 8.0123 117.2752 57.8778 41.9544 178.8238 24 Q 4.0993 7.8400 116.6291 58.5010 29.1778 177.4815 25 D 4.7274 7.7697 120.7901 52.4378 42.1949 175.2932 26 P 4.4031 0.0000 0.0000 65.5183 31.5362 178.9979 27 V 3.7590 8.7691 119.1704 65.7932 31.5982 178.1717 28 G 2.6689 7.7280 106.1563 46.4424 0.0000 175.6496 29 V 3.5177 7.1515 119.6916 65.6352 31.2150 178.0865 30 R 3.9111 7.6120 115.5389 59.5527 28.8977 178.3524 31 Y 3.9852 7.6689 117.8269 59.7157 38.1790 177.3215 32 F 3.1189 7.5809 121.4854 61.2382 39.4394 176.6401 33 S 4.0092 8.4656 112.8078 61.6345 61.8698 175.3124 34 D 4.2891 7.2661 119.1072 57.6714 41.1126 177.8671 35 F 4.1879 8.0110 120.5488 61.6866 39.2652 176.8430 36 L 4.1133 7.4458 118.8618 57.2720 41.5309 179.6043 37 R 3.8321 7.7118 117.8520 59.3707 29.5960 178.2565 38 K 3.9284 7.6835 117.9719 58.6571 32.0620 177.4177 39 E 4.5179 7.5502 113.1267 55.3436 30.0487 175.5175 40 F 3.5609 8.4729 116.1650 59.8429 36.7739 175.8223 41 S 4.7339 8.3320 111.5368 57.9717 63.8317 175.3865 42 E 3.8538 8.4391 123.7670 60.1510 29.1655 178.4545 43 E 4.1510 8.4011 116.7897 59.8811 29.3585 178.7811 44 N 4.2771 8.3698 117.3631 56.5009 38.7108 177.0729 45 I 4.1197 7.8138 119.0732 63.8054 38.1638 177.4301 46 L 4.1181 8.4815 120.4853 57.7669 41.5542 179.3640 47 F 3.2406 8.2866 120.7144 60.7134 39.2390 176.5268 48 W 4.1755 7.9180 126.7585 60.9048 30.1928 177.4516 49 Q 3.9614 8.3739 116.1952 59.2405 28.5874 178.8038 50 A 4.1161 7.6024 121.3333 55.8834 18.3260 178.9217 51 C 3.7929 7.4700 113.9566 63.3420 28.1328 176.1164 52 E 4.2826 7.3257 121.1489 59.3554 28.8588 178.7808 53 Y 3.7813 7.7060 118.3901 60.5777 39.0830 177.0538 54 F 4.2361 8.1920 121.6918 60.5502 39.6844 176.3918 55 N 4.0362 8.7554 118.2503 55.9109 36.6962 176.3181 56 H 3.8242 7.4884 117.3068 57.4257 29.2416 176.4575 57 V 3.3966 6.9967 119.5171 62.1223 31.7313 173.9860 58 P 4.2726 0.0000 0.0000 62.2670 32.1605 177.2336 59 A 3.7564 8.4813 123.3427 55.7276 18.6474 178.5773 60 H 4.0532 8.4284 109.8922 58.9221 27.9440 175.4979 61 D 4.2546 6.7092 123.7328 53.7333 41.1482 176.3862 62 K 3.9380 8.4462 127.0413 59.0628 32.3190 179.1273 63 K 4.0856 7.8919 118.3975 59.9120 32.0208 178.3322 64 E 4.0685 8.4053 118.5954 59.2134 29.4583 179.1738 65 L 3.8468 7.4401 118.2059 58.4171 41.7711 179.2438 66 S 4.1328 8.7093 112.8735 61.8527 62.2438 175.5916 67 Y 4.0555 7.9817 120.8235 61.5021 38.6772 178.6169 68 R 4.2002 8.9010 118.8989 58.5518 30.1296 178.8965 69 A 3.8672 9.1403 120.5479 55.5455 18.5852 179.6592 70 R 3.9373 8.5748 116.6702 59.6705 30.2221 178.4181 71 E 3.8576 8.2368 118.5580 59.8158 29.5327 178.8000 72 I 3.8626 8.6487 119.4870 65.3857 37.3655 177.4300 73 F 4.3069 8.8747 121.5690 61.1738 38.9346 176.3498 74 S 4.0707 8.8749 115.8747 60.1192 62.5075 176.4895 75 K 3.8686 7.6173 120.2828 59.3700 32.4036 177.4238 76 F 4.6076 8.2151 116.5541 57.9041 40.9299 175.0369 77 L 4.2933 7.7335 121.5089 53.7369 41.0181 174.8419 78 C 4.2293 7.3762 122.4337 58.6755 34.2202 173.6262 79 S 4.3180 8.6811 115.5777 60.0849 62.9812 175.1906 80 K 4.4506 7.7661 117.0418 55.4619 32.6146 175.6574 81 A 3.9065 7.9785 122.0171 52.6919 18.5056 178.0288 82 T 3.8817 8.5157 113.8102 64.4571 68.5229 174.7332 83 T 4.4473 7.4390 118.3754 57.8513 69.9943 171.3190 84 P 5.1907 0.0000 0.0000 62.1647 31.9998 177.0769 85 V 4.4726 8.1328 115.3800 59.9939 32.4238 175.6634 86 N 4.1853 8.6738 120.9208 56.8583 38.9591 175.6959 87 I 3.6437 7.4271 116.9459 61.8595 37.7734 174.6018 88 D 4.7780 8.3828 123.5721 53.0449 42.0558 177.3972 89 S 4.5946 8.5685 118.0585 59.4496 62.8114 175.6967 90 Q 4.1363 7.9519 120.3523 57.8142 28.1439 177.5475 91 A 4.3889 8.0584 120.9624 51.5500 18.0147 177.5423 92 Q 3.2111 7.8179 113.3760 57.1929 28.6073 176.3558 93 L 4.0281 7.8226 118.6409 59.9122 41.6258 178.2067 94 A 2.7588 7.6902 117.4758 55.2033 18.3702 178.8416 95 D 4.2843 7.8831 115.2825 57.9286 41.1838 178.1898 96 D 4.6265 8.7939 119.8416 55.2328 40.6872 178.7438 97 V 3.7043 7.6219 115.8447 64.8862 31.9672 178.0050 98 L 4.0799 8.2486 118.2635 57.8989 41.7921 178.8590 99 R 3.8988 7.5864 112.5020 58.4034 29.6389 177.4603 100 A 4.3315 8.3446 128.7277 49.4438 20.2195 174.0931 101 P 4.7392 0.0000 0.0000 63.6849 32.4915 175.1609 102 H 4.7720 8.8065 116.7901 53.4823 32.1276 172.1040 103 P 3.9938 0.0000 0.0000 64.2137 31.1976 177.1919 104 D 4.7809 7.8410 117.5984 55.7202 42.8201 177.3903 105 M 4.0473 8.4532 118.3307 59.1799 32.0711 177.9248 106 F 4.0533 9.2496 116.9780 61.2330 39.2038 178.0278 107 K 4.2162 8.3197 117.7453 59.6810 31.5684 178.3650 108 E 4.0098 8.1967 118.1045 59.3733 29.7725 178.8045 109 Q 4.1749 8.1202 117.2399 59.3478 28.9237 178.6986 110 Q 4.2614 8.3741 120.2775 59.6462 29.0331 178.7861 111 L 4.0616 7.9470 120.4147 58.2408 42.0856 178.5609 112 Q 4.0994 8.1813 118.0267 59.4173 28.6748 179.6532 113 I 3.7737 7.9749 119.6565 64.3753 37.3102 177.7773 114 F 3.6478 8.3773 121.6620 61.6444 39.1647 177.2606 115 N 4.2296 8.5726 115.5792 56.4251 38.4622 176.6212 116 L 4.0016 8.1104 121.2763 59.2637 41.9812 178.9937 117 M 4.2596 8.6106 117.9393 58.4834 31.9201 178.6118 118 K 3.7260 7.6829 118.4356 58.9442 32.1437 177.4288 119 F 5.0134 7.7901 114.5370 57.4829 40.8288 175.7030 120 D 4.7114 8.6320 118.1496 56.2231 41.5070 177.8445 121 S 4.4610 7.9817 112.7099 61.2293 63.1100 175.6591 122 Y 3.9988 8.5065 122.4481 60.9655 38.4850 178.6655 123 T 4.0138 8.0949 110.0878 64.9903 69.0496 176.4387 124 R 3.8736 7.7270 121.3086 58.7105 29.9982 178.8521 125 F 2.9853 7.7877 119.2542 61.2022 39.3356 177.2241 126 L 3.1033 6.7726 116.2474 57.2338 41.4365 179.3002 127 K 4.0606 7.3312 117.9752 58.2232 32.2174 178.0581 128 S 4.4510 7.6905 113.3143 57.0897 63.7876 173.2511 129 P 4.3540 0.0000 0.0000 65.5262 31.0626 178.0616 130 L 3.9479 7.4806 120.1640 58.6935 41.7707 178.1879 131 Y 3.7398 7.7879 118.3653 60.9001 38.4142 178.0976 132 Q 3.8603 7.8345 118.5666 58.7305 28.2837 178.5637 133 E 3.8752 7.9144 119.7593 60.0854 29.6432 179.6187 134 C 3.8661 7.5554 116.2064 62.2856 28.1224 176.2132 135 I 3.3732 7.4016 121.9346 64.3046 36.7145 178.0558 136 L 3.8898 7.8800 118.9342 58.1170 41.4184 179.5392 137 A 4.1234 7.4876 119.9505 54.7605 17.9855 179.4499 138 E 3.7779 7.6460 117.5138 59.4402 29.8920 179.0889 139 V 3.7230 8.0087 118.1620 64.3211 31.7791 177.8791 140 E 4.2162 8.5387 119.5207 59.5429 29.7277 178.8172 141 G 4.3938 7.6117 106.8679 47.0190 0.0000 173.3565 142 R 4.5475 7.6489 116.9984 53.2895 33.3576 175.5456 143 A 4.2977 8.2211 121.8294 52.0994 19.0680 176.6692 144 L 4.6235 8.1092 119.5805 52.6410 43.1549 176.3422 145 P 4.4972 0.0000 0.0000 62.3612 32.7686 174.5275 146 D 4.6401 8.3047 118.0976 52.9705 41.9487 176.8625 147 S 4.0280 8.0580 121.8218 61.6934 62.6996 176.2668 148 Q 3.9639 8.2270 117.4492 59.1710 28.6504 178.1756 149 Q 4.0319 7.7095 116.1150 58.8787 29.1487 177.4005 150 V 3.6171 7.6348 117.0662 62.4432 31.8168 173.6449 151 P 4.4407 0.0000 0.0000 62.3508 31.9345 176.1375 152 S 4.2552 8.9999 118.2975 61.2136 62.8576 175.3219 153 S 4.2130 7.8943 115.6595 56.7667 63.2130 172.1742 154 P 4.4796 0.0000 0.0000 62.0285 32.1724 176.0901 155 A 4.1927 8.3391 120.1220 52.4938 18.5450 177.3666 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 G 8.35 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 0.00 0.00 0.00 2 S 8.53 4.16 0.00 3.92 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 S 8.15 4.51 0.00 3.93 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 4 G 8.88 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 0.00 0.00 0.00 5 S 8.30 4.87 0.00 3.77 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 S 8.50 4.69 0.00 3.85 3.80 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 7 G 7.28 3.62 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 R 7.39 4.68 0.00 1.77 1.84 0.00 3.25 0.00 0.00 3.25 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.61 0.00 9 E 8.46 4.02 0.00 1.94 1.88 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 2.31 2.28 0.00 10 R 8.26 3.93 0.00 1.70 1.76 0.00 3.23 0.00 0.00 3.16 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.49 0.00 11 R 8.06 4.14 0.00 2.26 2.15 0.00 3.60 0.00 0.00 3.40 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.28 0.00 12 V 6.83 2.00 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 0.56 0.00 0.00 0.63 0.00 0.00 13 A 7.52 4.08 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 14 S 7.16 4.37 0.00 4.10 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 0.00 15 W 7.12 4.74 0.00 3.77 3.15 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 16 A 8.36 4.78 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 17 V 7.47 3.74 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 0.70 0.00 0.00 0.97 0.00 0.00 18 S 7.44 4.51 0.00 3.87 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 F 8.59 3.94 0.00 2.74 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 20 E 8.69 3.97 0.00 2.17 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 0.00 2.53 2.61 0.00 21 R 7.90 4.17 0.00 2.34 2.14 0.00 3.36 0.00 0.00 3.19 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.88 0.00 22 L 8.74 3.90 0.00 1.58 1.60 0.43 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 23 L 8.01 4.00 0.00 1.73 1.72 0.41 0.24 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 24 Q 7.84 4.10 0.00 2.31 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.89 0.00 0.00 0.00 0.00 0.00 2.64 2.53 0.00 25 D 7.77 4.73 0.00 3.02 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 26 P 0.00 4.40 0.00 2.34 2.33 0.00 3.85 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 2.15 2.08 0.00 27 V 8.77 3.76 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 1.37 0.00 0.00 1.15 0.00 0.00 28 G 7.73 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 V 7.15 3.52 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 1.02 0.00 0.00 0.98 0.00 0.00 30 R 7.61 3.91 0.00 1.94 2.28 0.00 2.21 0.00 0.00 2.52 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.79 0.00 31 Y 7.67 3.99 0.00 2.87 3.15 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 32 F 7.58 3.12 0.00 2.56 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 S 8.47 4.01 0.00 3.92 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 34 D 7.27 4.29 0.00 2.64 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 35 F 8.01 4.19 0.00 3.20 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 L 7.45 4.11 0.00 1.75 1.71 1.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 37 R 7.71 3.83 0.00 1.79 2.00 0.00 2.99 0.00 0.00 3.07 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.40 0.00 38 K 7.68 3.93 0.00 1.49 1.76 0.00 1.73 0.00 0.00 1.73 0.00 0.00 3.31 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.63 1.49 7.81 39 E 7.55 4.52 0.00 1.99 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 2.04 2.20 0.00 40 F 8.47 3.56 0.00 3.01 3.19 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 41 S 8.33 4.73 0.00 3.90 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 E 8.44 3.85 0.00 1.95 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 2.40 2.36 0.00 43 E 8.40 4.15 0.00 2.45 2.43 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 2.45 2.50 0.00 44 N 8.37 4.28 0.00 2.98 3.02 0.00 0.00 6.67 8.17 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 45 I 7.81 4.12 2.21 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.40 1.05 0.00 0.00 46 L 8.48 4.12 0.00 1.98 1.98 1.12 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 47 F 8.29 3.24 0.00 1.98 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 48 W 7.92 4.18 0.00 3.65 3.45 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 49 Q 8.37 3.96 0.00 2.36 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.73 0.00 0.00 0.00 0.00 0.00 2.89 3.04 0.00 50 A 7.60 4.12 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 51 C 7.47 3.79 0.00 2.77 2.91 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 52 E 7.33 4.28 0.00 1.16 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 0.00 1.88 1.89 0.00 53 Y 7.71 3.78 0.00 2.97 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 54 F 8.19 4.24 0.00 3.03 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 55 N 8.76 4.04 0.00 3.04 3.19 0.00 0.00 6.57 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 56 H 7.49 3.82 0.00 3.03 3.23 0.00 5.87 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 V 7.00 3.40 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 0.53 0.00 0.00 0.73 0.00 0.00 58 P 0.00 4.27 0.00 2.12 2.09 0.00 3.54 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.88 0.00 59 A 8.48 3.76 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 60 H 8.43 4.05 0.00 3.23 3.45 0.00 5.54 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 D 6.71 4.25 0.00 2.41 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 K 8.45 3.94 0.00 1.80 1.83 0.00 1.78 0.00 0.00 1.82 0.00 0.00 3.15 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.69 1.46 7.81 63 K 7.89 4.09 0.00 1.84 1.90 0.00 1.56 0.00 0.00 1.82 0.00 0.00 3.03 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.56 1.67 7.81 64 E 8.41 4.07 0.00 2.02 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 2.32 2.42 0.00 65 L 7.44 3.85 0.00 1.83 1.79 0.87 0.10 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 66 S 8.71 4.13 0.00 4.02 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 67 Y 7.98 4.06 0.00 3.27 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 68 R 8.90 4.20 0.00 2.39 2.17 0.00 3.51 0.00 0.00 3.34 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 69 A 9.14 3.87 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 70 R 8.57 3.94 0.00 1.78 2.01 0.00 3.33 0.00 0.00 3.09 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.79 0.00 71 E 8.24 3.86 0.00 2.08 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 2.40 2.45 0.00 72 I 8.65 3.86 2.09 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 1.55 0.64 1.20 0.00 0.00 73 F 8.87 4.31 0.00 3.29 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 74 S 8.87 4.07 0.00 3.97 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 75 K 7.62 3.87 0.00 1.75 0.75 0.00 1.63 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.25 0.00 0.00 0.00 0.00 1.18 1.63 7.81 76 F 8.22 4.61 0.00 3.21 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 L 7.73 4.29 0.00 0.89 1.41 1.20 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 78 C 7.38 4.23 0.00 2.51 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 S 8.68 4.32 0.00 4.01 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 K 7.77 4.45 0.00 1.68 1.78 0.00 1.64 0.00 0.00 1.70 0.00 0.00 3.08 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.31 1.43 7.81 81 A 7.98 3.91 1.18 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 0.00 0.00 0.00 0.00 0.00 0.00 82 T 8.52 3.88 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 1.16 0.00 0.00 83 T 7.44 4.45 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 1.27 0.00 0.00 84 P 0.00 5.19 0.00 2.17 2.07 0.00 3.38 0.00 0.00 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.93 0.00 85 V 8.13 4.47 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 0.71 0.00 0.00 0.35 0.00 0.00 86 N 8.67 4.19 0.00 2.64 2.85 0.00 0.00 7.06 7.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 I 7.43 3.64 1.56 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.36 0.96 0.00 0.00 88 D 8.38 4.78 0.00 2.68 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 89 S 8.57 4.59 0.00 3.92 4.03 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 0.00 0.00 0.00 90 Q 7.95 4.14 0.00 2.10 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.06 7.02 0.00 0.00 0.00 0.00 0.00 2.39 2.32 0.00 91 A 8.06 4.39 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 Q 7.82 3.21 0.00 2.22 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.45 6.86 0.00 0.00 0.00 0.00 0.00 2.28 2.30 0.00 93 L 7.82 4.03 0.00 1.67 1.61 0.78 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 94 A 7.69 2.76 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 D 7.88 4.28 0.00 2.81 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 96 D 8.79 4.63 0.00 2.88 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 97 V 7.62 3.70 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 0.99 0.00 0.00 0.58 0.00 0.00 98 L 8.25 4.08 0.00 1.68 1.69 0.76 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 99 R 7.59 3.90 0.00 1.99 2.05 0.00 3.07 0.00 0.00 3.26 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.58 0.00 100 A 8.34 4.33 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 P 0.00 4.74 0.00 2.50 2.29 0.00 3.80 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 2.08 2.07 0.00 102 H 8.81 4.77 0.00 3.25 3.40 0.00 5.67 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 P 0.00 3.99 0.00 2.06 2.03 0.00 3.34 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 1.87 1.93 0.00 104 D 7.84 4.78 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 0.00 105 M 8.45 4.05 0.00 2.42 2.23 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.77 0.00 106 F 9.25 4.05 0.00 3.32 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 0.00 107 K 8.32 4.22 0.00 1.94 1.90 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.59 1.69 7.81 108 E 8.20 4.01 0.00 2.17 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 2.39 0.00 109 Q 8.12 4.17 0.00 2.21 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.79 0.00 0.00 0.00 0.00 0.00 2.45 2.38 0.00 110 Q 8.37 4.26 0.00 2.12 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.12 6.38 0.00 0.00 0.00 0.00 0.00 2.43 2.07 0.00 111 L 7.95 4.06 0.00 1.93 2.01 0.97 0.62 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 0.00 112 Q 8.18 4.10 0.00 2.35 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.59 0.00 0.00 0.00 0.00 0.00 2.44 2.85 0.00 113 I 7.97 3.77 2.33 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.94 1.12 0.00 0.00 114 F 8.38 3.65 0.00 3.23 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 N 8.57 4.23 0.00 3.01 3.21 0.00 0.00 6.86 6.19 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 0.00 116 L 8.11 4.00 0.00 1.92 1.93 1.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 117 M 8.61 4.26 0.00 2.52 2.25 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.74 0.00 118 K 7.68 3.73 0.00 1.48 1.33 0.00 1.54 0.00 0.00 1.37 0.00 0.00 2.99 0.00 0.00 2.65 0.00 0.00 0.00 0.00 0.30 0.82 7.81 119 F 7.79 5.01 0.00 3.15 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 D 8.63 4.71 0.00 2.85 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 0.00 121 S 7.98 4.46 0.00 4.10 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 Y 8.51 4.00 0.00 2.88 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 0.00 123 T 8.09 4.01 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 124 R 7.73 3.87 0.00 2.24 2.24 0.00 3.43 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.98 0.00 125 F 7.79 2.99 0.00 2.00 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 0.00 126 L 6.77 3.10 0.00 1.56 1.13 0.84 -0.26 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 0.00 127 K 7.33 4.06 0.00 1.74 1.86 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.05 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.67 1.58 7.81 128 S 7.69 4.45 0.00 4.07 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 P 0.00 4.35 0.00 2.30 2.36 0.00 3.79 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 2.12 2.05 0.00 130 L 7.48 3.95 0.00 2.06 1.88 1.22 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 131 Y 7.79 3.74 0.00 1.50 2.44 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 0.00 132 Q 7.83 3.86 0.00 2.15 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.40 0.00 0.00 0.00 0.00 0.00 2.43 2.55 0.00 133 E 7.91 3.88 0.00 2.03 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 2.62 2.57 0.00 134 C 7.56 3.87 0.00 2.78 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 0.00 135 I 7.40 3.37 1.81 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.75 0.87 0.00 0.00 136 L 7.88 3.89 0.00 1.74 1.69 0.89 0.83 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 0.00 137 A 7.49 4.12 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 E 7.65 3.78 0.00 1.82 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 2.20 2.26 0.00 139 V 8.01 3.72 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 0.79 0.00 0.00 0.89 0.00 0.00 140 E 8.54 4.22 0.00 2.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 141 G 7.61 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 R 7.65 4.55 0.00 1.76 1.85 0.00 3.21 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.56 0.00 143 A 8.22 4.30 1.26 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 0.00 144 L 8.11 4.62 0.00 1.79 1.81 1.12 1.03 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 0.00 145 P 0.00 4.50 0.00 2.29 2.17 0.00 3.84 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.03 0.00 146 D 8.30 4.64 0.00 2.65 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 S 8.06 4.03 0.00 2.95 3.57 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 0.00 148 Q 8.23 3.96 0.00 2.26 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.76 0.00 0.00 0.00 0.00 0.00 2.31 2.29 0.00 149 Q 7.71 4.03 0.00 2.05 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.76 0.00 0.00 0.00 0.00 0.00 2.39 2.32 0.00 150 V 7.63 3.62 2.33 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 0.90 0.00 0.00 1.10 0.00 0.00 151 P 0.00 4.44 0.00 2.23 2.06 0.00 3.87 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 2.01 1.97 0.00 152 S 9.00 4.26 0.00 4.01 4.08 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 0.00 153 S 7.89 4.21 0.00 4.01 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 0.00 154 P 0.00 4.48 0.00 2.22 2.15 0.00 3.77 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.98 0.00 155 A 8.34 4.19 1.26 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