NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 P 4.2698 0.0000 0.0000 62.5275 31.7595 173.1670 13 K 3.7937 8.0303 123.6153 58.0459 31.6253 176.4596 14 G 4.1182 8.7901 114.1151 46.1189 0.0000 174.1562 15 V 4.5552 7.3755 115.6932 59.5599 35.0568 177.4272 16 S 4.3382 8.9916 123.1906 57.9805 61.3303 172.3440 17 V 4.5556 8.0233 123.6072 61.9948 31.0903 174.1246 18 E 4.6195 8.9548 126.1180 55.0017 31.7736 175.3331 19 V 4.5861 8.2196 121.0284 61.3501 33.8991 175.1123 20 A 4.5981 8.2925 130.8165 49.7486 20.9818 174.7561 21 P 4.4111 0.0000 0.0000 65.6517 31.2866 177.9482 22 G 4.1437 8.0349 101.1725 45.5723 0.0000 172.3220 23 R 5.2158 7.7515 119.5317 54.7814 34.1333 175.4190 24 V 4.5028 8.0504 117.9429 61.3923 34.6492 173.4831 25 K 4.7855 8.9876 127.1892 54.6547 33.1501 175.9478 26 V 3.9813 8.4939 126.8248 62.3686 32.1154 174.8575 27 K 4.8689 8.4662 128.2061 55.3361 35.2540 176.5409 28 G 4.0680 8.2352 107.6554 46.0084 0.0000 171.5750 29 P 4.4458 0.0000 0.0000 65.8524 31.4190 178.3783 30 K 4.1225 8.1850 116.5054 57.2275 32.8479 177.7205 31 G 3.8931 6.0779 103.4482 45.5359 0.0000 170.0740 32 E 5.1613 8.2555 119.8678 54.4201 32.7954 176.4889 33 L 4.8062 8.7894 124.2614 53.2107 46.3421 175.4950 34 E 4.8550 8.7458 122.3681 54.3542 29.9184 174.3289 35 V 3.9059 8.5857 124.5728 61.6654 32.5686 173.2111 36 P 4.5944 0.0000 0.0000 62.8182 32.1561 175.8183 37 V 4.5520 8.5324 121.4499 60.8569 35.1227 174.9187 38 S 4.1985 8.6545 120.4408 57.8129 63.0608 174.0759 39 P 4.6580 0.0000 0.0000 62.6742 30.2397 177.1190 40 E 4.7890 7.2507 116.1563 54.1384 31.1080 174.8688 41 M 4.4910 6.4219 123.6345 56.2188 36.1953 174.8990 42 R 5.4947 8.0888 127.4059 56.9329 32.6891 174.2688 43 V 4.7309 7.6760 109.0701 59.9688 32.4706 176.0667 44 V 4.1990 8.6806 122.3333 63.2029 34.5649 176.4088 45 V 3.1660 6.9290 122.0524 64.0203 28.2748 172.8141 46 E 4.3559 7.8067 119.1849 55.4354 30.5864 177.2094 47 E 3.9853 8.6790 124.5977 55.4789 27.6209 175.6534 48 G 4.1794 8.4485 108.4600 46.3048 0.0000 174.2403 49 V 4.1773 7.1799 112.9478 60.7630 34.6664 174.0484 50 V 4.2873 8.2070 122.4362 63.2411 33.5242 174.7683 51 R 4.6079 8.3529 126.1079 54.6929 32.5394 175.6177 52 V 4.4693 7.8952 117.4000 61.7678 34.3926 173.3267 53 E 4.8102 8.7582 125.7140 54.3742 32.7825 174.7737 54 R 4.6406 8.0507 118.4797 53.6563 31.5678 174.5251 55 P 4.2192 0.0000 0.0000 65.6792 31.6251 176.9830 56 S 4.7614 7.7593 113.7420 56.5813 64.9115 173.4608 57 D 4.9466 8.2440 118.7892 54.3789 41.4422 176.7102 58 E 4.3225 7.9205 119.0743 55.4138 31.0297 178.1033 59 R 3.8430 8.5283 118.7362 59.9057 30.0400 178.0166 60 R 3.8820 8.0130 117.2460 60.0808 30.0362 178.2324 61 H 4.2335 8.0671 114.8278 59.0579 28.6510 177.6354 62 K 3.8998 7.9141 119.5250 59.9855 31.8463 179.2913 63 S 4.2981 8.1581 115.1153 61.6671 62.8929 176.6805 64 L 3.9268 8.0697 121.6755 56.9968 41.4518 177.3993 65 H 4.4239 8.2311 118.1266 57.3483 30.7324 174.2797 66 G 4.2593 8.7755 118.6708 46.4103 0.0000 175.3525 67 L 3.9184 7.3132 121.5769 58.1163 41.9983 179.0172 68 T 3.8175 8.4041 115.7784 66.5428 68.3581 176.2898 69 R 3.8321 7.9339 119.9668 60.0724 29.9606 178.0512 70 T 3.8184 8.4297 115.3259 66.8154 68.3027 176.2583 71 L 3.9319 7.9504 119.7986 58.1981 41.9897 179.7419 72 I 3.8182 8.2247 119.4559 64.2880 37.1419 178.0185 73 A 3.9936 8.1377 121.7893 55.6529 18.2141 179.5186 74 N 4.3177 8.4854 114.4984 56.2552 38.2683 177.5711 75 A 4.0205 7.7709 121.8328 54.8390 18.6074 179.6003 76 V 3.6597 7.5624 116.2631 66.3327 31.6843 178.4392 77 K 4.0922 8.2427 118.2021 59.1035 31.5967 179.5107 78 G 3.8230 7.8474 106.9507 46.3588 0.0000 174.7657 79 V 4.4038 7.2529 114.4293 59.7774 33.8041 176.5488 80 S 5.3374 7.5168 113.8255 58.5365 64.8051 176.9144 81 E 3.5656 7.1781 115.5533 57.2150 26.5732 177.9828 82 G 3.7919 7.7523 108.2881 47.9791 0.0000 176.2356 83 Y 4.8284 6.3558 113.3652 57.6046 37.1061 178.8946 84 S 4.0341 8.9261 124.6159 58.8813 61.6715 165.0000 85 K 3.9532 8.8474 127.9163 55.7696 30.8048 174.3305 86 E 5.2199 8.4596 122.8567 54.5666 33.0863 174.6502 87 L 5.1805 10.3059 121.1652 53.0133 45.1533 175.1171 88 L 5.1092 8.8559 125.9831 53.3948 43.7640 174.9203 89 I 4.6217 8.0708 121.2912 60.2502 38.8433 175.7849 90 K 4.5781 8.3916 126.8812 55.8584 34.8317 173.6643 91 G 3.6125 8.6521 114.1524 45.1753 0.0000 172.9574 92 I 3.6665 8.6075 120.6547 62.9996 36.1942 177.9365 93 G 4.0238 9.4743 120.0224 49.0528 0.0000 173.8199 94 Y 4.3584 8.3964 118.1536 57.4767 38.6611 175.5698 95 R 4.5296 7.6222 120.0409 56.1010 32.0937 173.0988 96 A 5.2468 8.6506 122.0722 50.4140 23.6745 177.6031 97 R 4.5023 9.1975 115.8186 55.2582 29.0282 178.7494 98 L 5.0406 8.1438 119.2896 54.7130 44.8129 171.7697 99 V 4.2925 7.9531 125.8390 61.7235 34.3311 174.5496 100 G 3.8049 8.5680 117.1549 47.2337 0.0000 174.3167 101 R 4.2729 8.5934 121.7491 56.2825 30.8816 176.2570 102 A 4.5060 7.9391 121.1610 51.5329 20.3382 176.1606 103 L 4.8225 8.7015 121.6216 53.3309 44.4899 174.5054 104 E 5.2147 8.7888 127.5595 54.3200 31.8404 174.2447 105 L 5.0430 9.3110 127.4827 54.2205 43.9214 175.3310 106 T 4.5077 8.4555 114.7583 59.6933 70.5015 175.9490 107 V 3.6709 7.8667 121.7452 60.2344 32.7271 174.9151 108 G 3.7110 7.7497 108.1835 45.5522 0.0000 174.6640 109 F 4.4703 7.1081 117.2200 57.4569 39.4126 176.4637 110 S 4.6485 8.7457 116.5280 58.2117 62.2713 173.7633 111 H 4.3661 8.3707 118.3308 55.8523 32.8383 172.5721 112 P 4.7261 0.0000 0.0000 62.5722 33.0773 175.3857 113 V 4.4928 8.1898 117.2422 61.4207 34.7791 174.1945 114 V 4.8505 8.5125 120.3876 59.2567 33.7760 176.0221 115 V 4.4643 8.2343 122.2354 60.7106 30.2521 174.7619 116 E 4.1136 8.4316 121.6816 55.5736 30.3498 175.4839 117 P 4.1400 0.0000 0.0000 61.9529 32.0061 174.8314 118 P 4.4082 0.0000 0.0000 61.7250 32.2587 175.1365 119 E 3.9825 8.4561 120.3257 58.0409 29.7235 177.0952 120 G 4.0040 9.1149 114.2040 44.7687 0.0000 172.2743 121 I 4.6818 7.1272 120.1590 59.6937 39.3357 175.2833 122 T 4.4537 8.7880 123.0704 61.6653 71.6865 172.8794 123 F 5.6791 8.6293 123.9844 56.1862 40.8157 174.9907 124 E 4.7978 9.0757 122.3781 54.1876 33.0425 176.4323 125 V 5.0125 7.8913 119.3552 60.4276 31.7337 173.9747 126 P 4.4098 0.0000 0.0000 65.3023 31.6371 175.9453 127 E 4.7048 7.5160 115.4522 54.5662 33.6876 172.8469 128 P 4.8688 0.0000 0.0000 63.2493 32.0701 176.1770 129 T 4.9095 7.5510 109.9889 61.0547 69.5808 173.5002 130 R 4.8812 7.9322 120.2239 56.1241 34.5848 174.4205 131 V 4.8426 9.3636 123.5659 61.2994 35.7858 174.0896 132 R 4.9862 8.6180 121.1350 54.7404 33.2091 173.6920 133 V 4.9437 8.7493 122.3697 61.7880 32.9881 175.0306 134 S 4.8624 8.9084 124.3920 56.9496 65.2330 173.4039 135 G 4.3564 8.2179 108.2400 46.5318 0.0000 173.9778 136 I 4.2625 8.3755 121.5176 64.7538 38.6440 178.6385 137 D 4.5223 8.5173 119.5593 54.1134 39.4826 175.2017 138 K 4.5824 5.6600 124.9096 56.0429 32.1933 175.0751 139 Q 3.8514 7.9145 120.2729 59.4615 28.8095 179.8304 140 K 4.0251 8.1996 118.7267 59.3486 32.3781 179.0730 141 V 3.6994 7.7727 118.1062 66.0060 31.3473 177.7214 142 G 3.9513 8.5340 105.0777 49.0580 0.0000 174.5355 143 Q 4.0775 8.1467 120.4366 57.5458 28.5711 178.4248 144 V 3.7088 8.5553 119.6551 66.5007 31.7619 178.4804 145 A 4.0961 8.6490 120.4750 55.2517 18.1936 179.5536 146 A 4.0439 8.3727 120.4893 55.0479 18.3560 179.2714 147 N 4.1734 8.3558 113.1553 57.1262 38.7625 177.0414 148 I 3.7930 7.9567 120.8074 64.2632 36.7581 178.2327 149 R 3.7182 8.0001 119.0191 59.4104 29.4636 178.5173 150 A 3.9630 8.0164 120.0307 55.5718 18.4864 179.3441 151 I 3.9048 7.3596 117.3724 64.0335 38.6072 176.5962 152 R 4.6917 7.5779 116.1295 55.0837 31.9590 173.8670 153 K 4.2875 8.0589 121.1292 55.0136 33.5109 175.3569 154 P 4.2077 0.0000 0.0000 61.8607 30.2461 176.9521 155 S 3.5039 7.2885 111.2983 57.0635 63.3677 174.5988 156 A 3.5506 7.7216 127.0574 56.9364 16.9379 176.9530 157 Y 3.6161 9.2029 118.0998 59.4038 37.8961 167.9971 158 H 4.2356 8.0179 125.1925 55.7283 30.5112 173.1948 159 E 4.6593 8.3556 131.6871 56.8958 33.8530 178.3928 160 K 4.2652 8.6929 122.8787 54.5283 35.3883 175.6751 161 G 4.2656 8.2315 104.6589 45.3710 0.0000 172.0621 162 I 4.5707 8.0124 119.9259 60.9386 37.6716 175.7056 163 Y 4.4489 8.9215 124.6147 56.4865 40.3925 176.1365 164 Y 4.4621 8.9503 119.4304 58.7162 38.3407 177.6098 165 A 5.6235 7.7658 133.0688 52.9245 20.5292 176.6980 166 G 4.1218 7.9190 107.4728 45.3666 0.0000 172.9682 167 E 4.8276 8.3240 117.4026 53.5602 33.3251 175.1286 168 P 4.7536 0.0000 0.0000 63.6725 29.1651 176.0651 169 V 3.4523 7.2783 118.3267 61.4478 32.6397 176.8229 170 R 3.7545 8.8125 125.1997 60.2622 30.2510 177.1407 *171 L 4.1415 7.6909 120.5908 54.5071 41.6082 178.6729 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 P 0.00 4.27 0.00 2.05 2.09 0.00 3.66 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 1.91 2.11 0.00 13 K 8.03 3.79 0.00 2.00 1.99 0.00 1.70 0.00 0.00 1.81 0.00 0.00 2.95 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.38 1.43 7.81 14 G 8.79 4.12 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 0.00 0.00 0.00 15 V 7.38 4.56 2.12 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 0.73 0.00 0.00 0.97 0.00 0.00 16 S 8.99 4.34 0.00 3.77 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 17 V 8.02 4.56 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 0.97 0.00 0.00 0.93 0.00 0.00 18 E 8.95 4.62 0.00 1.95 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 2.46 2.39 0.00 19 V 8.22 4.59 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.96 0.00 0.00 20 A 8.29 4.60 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 21 P 0.00 4.41 0.00 2.05 2.15 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 2.03 2.11 0.00 22 G 8.03 4.14 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 0.00 0.00 0.00 23 R 7.75 5.22 0.00 1.76 1.86 0.00 3.16 0.00 0.00 3.39 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.59 0.00 24 V 8.05 4.50 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 0.72 0.00 0.00 0.96 0.00 0.00 25 K 8.99 4.79 0.00 1.73 1.81 0.00 1.66 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.38 1.36 7.81 26 V 8.49 3.98 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 0.93 0.00 0.00 27 K 8.47 4.87 0.00 1.75 1.68 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.82 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.52 1.64 7.81 28 G 8.24 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 0.00 0.00 0.00 29 P 0.00 4.45 0.00 2.04 2.12 0.00 4.02 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.11 0.00 30 K 8.19 4.12 0.00 1.78 1.98 0.00 1.83 0.00 0.00 1.72 0.00 0.00 2.89 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.42 1.37 7.81 31 G 6.08 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 0.00 0.00 0.00 32 E 8.26 5.16 0.00 1.94 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 2.17 2.30 0.00 33 L 8.79 4.81 0.00 1.60 1.48 0.99 0.69 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 34 E 8.75 4.85 0.00 1.81 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 2.20 2.26 0.00 35 V 8.59 3.91 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 0.95 0.00 0.00 0.93 0.00 0.00 36 P 0.00 4.59 0.00 2.12 2.03 0.00 3.76 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 1.99 1.96 0.00 37 V 8.53 4.55 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 0.76 0.00 0.00 0.96 0.00 0.00 38 S 8.65 4.20 0.00 3.88 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 39 P 0.00 4.66 0.00 2.08 2.04 0.00 3.68 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 40 E 7.25 4.79 0.00 1.89 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 2.23 2.37 0.00 41 M 6.42 4.49 0.00 1.90 1.74 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 2.61 2.52 0.00 42 R 8.09 5.49 0.00 1.85 1.90 0.00 3.28 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.39 0.00 43 V 7.68 4.73 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 0.96 0.00 0.00 0.93 0.00 0.00 44 V 8.68 4.20 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 0.93 0.00 0.00 45 V 6.93 3.17 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 0.82 0.00 0.00 1.05 0.00 0.00 46 E 7.81 4.36 0.00 2.16 2.12 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 2.35 2.29 0.00 47 E 8.68 3.99 0.00 2.28 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 0.00 2.26 2.28 0.00 48 G 8.45 4.18 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 0.00 49 V 7.18 4.18 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 0.63 0.00 0.00 0.97 0.00 0.00 50 V 8.21 4.29 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 51 R 8.35 4.61 0.00 1.82 1.85 0.00 3.26 0.00 0.00 3.15 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.58 0.00 52 V 7.90 4.47 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 0.80 0.00 0.00 0.93 0.00 0.00 53 E 8.76 4.81 0.00 1.99 1.76 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 2.29 2.19 0.00 54 R 8.05 4.64 0.00 1.82 1.77 0.00 3.10 0.00 0.00 3.19 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.47 0.00 55 P 0.00 4.22 0.00 2.18 2.17 0.00 3.55 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 1.67 1.81 0.00 56 S 7.76 4.76 0.00 3.99 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 57 D 8.24 4.95 0.00 2.62 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 58 E 7.92 4.32 0.00 1.89 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 2.36 2.25 0.00 59 R 8.53 3.84 0.00 1.91 1.91 0.00 3.25 0.00 0.00 3.33 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.78 0.00 60 R 8.01 3.88 0.00 1.79 1.98 0.00 3.12 0.00 0.00 3.32 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.70 0.00 61 H 8.07 4.23 0.00 3.17 3.30 0.00 5.67 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 62 K 7.91 3.90 0.00 1.84 1.94 0.00 1.78 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.50 1.62 7.81 63 S 8.16 4.30 0.00 4.13 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 64 L 8.07 3.93 0.00 1.85 1.74 0.96 0.85 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 65 H 8.23 4.42 0.00 3.13 3.41 0.00 5.98 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 G 8.78 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 67 L 7.31 3.92 0.00 1.68 1.88 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 68 T 8.40 3.82 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 1.21 0.00 0.00 69 R 7.93 3.83 0.00 1.80 1.96 0.00 3.15 0.00 0.00 3.28 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.74 0.00 70 T 8.43 3.82 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 71 L 7.95 3.93 0.00 1.79 1.77 0.92 1.15 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 72 I 8.22 3.82 2.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.19 0.91 0.00 0.00 73 A 8.14 3.99 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 74 N 8.49 4.32 0.00 2.95 2.89 0.00 0.00 6.99 8.39 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 75 A 7.77 4.02 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 76 V 7.56 3.66 2.29 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 1.05 0.00 0.00 0.96 0.00 0.00 77 K 8.24 4.09 0.00 1.84 1.82 0.00 1.72 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.44 7.81 78 G 7.85 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 79 V 7.25 4.40 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 0.89 0.00 0.00 1.01 0.00 0.00 80 S 7.52 5.34 0.00 3.88 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 81 E 7.18 3.57 0.00 2.00 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 0.00 2.08 2.09 0.00 82 G 7.75 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 83 Y 6.36 4.83 0.00 3.02 2.27 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 84 S 8.93 4.03 0.00 4.01 4.12 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 85 K 8.85 3.95 0.00 1.99 1.91 0.00 1.82 0.00 0.00 2.00 0.00 0.00 3.07 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.36 1.36 7.81 86 E 8.46 5.22 0.00 2.12 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 2.21 2.29 0.00 87 L 10.31 5.18 0.00 1.63 1.73 0.94 0.71 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 88 L 8.86 5.11 0.00 1.72 1.56 0.91 0.78 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 89 I 8.07 4.62 1.95 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.66 0.94 0.00 0.00 90 K 8.39 4.58 0.00 1.51 1.60 0.00 1.58 0.00 0.00 1.55 0.00 0.00 2.78 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.16 0.77 7.81 91 G 8.65 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 92 I 8.61 3.67 1.93 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.82 0.94 0.00 0.00 93 G 9.47 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 8.40 4.36 0.00 3.29 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 95 R 7.62 4.53 0.00 2.19 2.04 0.00 2.72 0.00 0.00 3.28 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.36 0.00 96 A 8.65 5.25 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 97 R 9.20 4.50 0.00 1.86 1.27 0.00 3.19 0.00 0.00 3.15 7.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.52 0.00 98 L 8.14 5.04 0.00 1.69 1.64 0.99 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 99 V 7.95 4.29 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 0.94 0.00 0.00 0.94 0.00 0.00 100 G 8.57 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 0.00 0.00 0.00 101 R 8.59 4.27 0.00 1.77 1.90 0.00 3.13 0.00 0.00 3.19 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 102 A 7.94 4.51 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 0.00 103 L 8.70 4.82 0.00 1.70 1.44 0.81 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 104 E 8.79 5.21 0.00 2.08 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 2.28 2.28 0.00 105 L 9.31 5.04 0.00 1.64 1.69 0.90 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 106 T 8.46 4.51 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 1.18 0.00 0.00 107 V 7.87 3.67 1.85 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 0.77 0.00 0.00 0.80 0.00 0.00 108 G 7.75 3.71 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 0.00 109 F 7.11 4.47 0.00 3.30 2.90 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 0.00 110 S 8.75 4.65 0.00 4.02 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 0.00 111 H 8.37 4.37 0.00 3.02 3.25 0.00 5.85 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 P 0.00 4.73 0.00 2.06 2.04 0.00 3.48 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.89 0.00 113 V 8.19 4.49 2.28 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 0.96 0.00 0.00 0.97 0.00 0.00 114 V 8.51 4.85 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 0.75 0.00 0.00 0.95 0.00 0.00 115 V 8.23 4.46 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 0.91 0.00 0.00 0.96 0.00 0.00 116 E 8.43 4.11 0.00 2.05 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 2.32 2.30 0.00 117 P 0.00 4.14 0.00 1.64 0.57 0.00 3.82 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 1.79 1.81 0.00 118 P 0.00 4.41 0.00 2.21 2.19 0.00 3.57 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 2.00 1.94 0.00 119 E 8.46 3.98 0.00 1.91 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 2.29 0.00 120 G 9.11 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 0.00 121 I 7.13 4.68 1.85 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.63 0.62 0.00 0.00 122 T 8.79 4.45 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 1.20 0.00 0.00 123 F 8.63 5.68 0.00 2.90 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 0.00 124 E 9.08 4.80 0.00 1.92 1.85 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 2.27 2.41 0.00 125 V 7.89 5.01 2.10 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 1.23 0.00 0.00 0.98 0.00 0.00 126 P 0.00 4.41 0.00 2.23 2.21 0.00 3.75 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.03 0.00 127 E 7.52 4.70 0.00 2.06 1.87 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 2.24 2.38 0.00 128 P 0.00 4.87 0.00 2.22 2.28 0.00 3.80 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 2.03 1.90 0.00 129 T 7.55 4.91 4.49 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 1.22 0.00 0.00 130 R 7.93 4.88 0.00 1.75 1.83 0.00 3.08 0.00 0.00 3.27 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 131 V 9.36 4.84 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 0.91 0.00 0.00 0.88 0.00 0.00 132 R 8.62 4.99 0.00 2.06 1.99 0.00 2.86 0.00 0.00 3.16 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.63 0.00 133 V 8.75 4.94 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 1.20 0.00 0.00 134 S 8.91 4.86 0.00 3.26 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 0.00 135 G 8.22 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 I 8.38 4.26 1.91 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 1.29 0.71 0.99 0.00 0.00 137 D 8.52 4.52 0.00 2.65 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 0.00 0.00 0.00 138 K 5.66 4.58 0.00 1.99 1.86 0.00 1.73 0.00 0.00 1.58 0.00 0.00 2.84 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.23 1.11 7.81 139 Q 7.91 3.85 0.00 2.20 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.71 0.00 0.00 0.00 0.00 0.00 2.45 2.57 0.00 140 K 8.20 4.03 0.00 1.85 1.84 0.00 1.72 0.00 0.00 1.73 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.53 1.70 7.81 141 V 7.77 3.70 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 1.14 0.00 0.00 1.00 0.00 0.00 142 G 8.53 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 Q 8.15 4.08 0.00 2.38 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.61 0.00 0.00 0.00 0.00 0.00 2.41 2.54 0.00 144 V 8.56 3.71 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 1.05 0.00 0.00 145 A 8.65 4.10 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 0.00 146 A 8.37 4.04 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 0.00 147 N 8.36 4.17 0.00 2.95 2.98 0.00 0.00 6.92 7.45 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 0.00 148 I 7.96 3.79 2.06 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 1.77 0.92 0.84 0.00 0.00 149 R 8.00 3.72 0.00 1.55 1.80 0.00 2.44 0.00 0.00 2.25 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.50 0.00 150 A 8.02 3.96 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 0.00 151 I 7.36 3.90 1.98 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 1.62 0.86 1.11 0.00 0.00 152 R 7.58 4.69 0.00 1.91 1.82 0.00 3.17 0.00 0.00 3.21 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.62 0.00 153 K 8.06 4.29 0.00 1.75 1.67 0.00 1.64 0.00 0.00 1.88 0.00 0.00 2.85 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.37 1.32 7.81 154 P 0.00 4.21 0.00 1.76 0.49 0.00 3.19 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.33 0.00 155 S 7.29 3.50 0.00 4.01 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 0.00 156 A 7.72 3.55 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 0.00 157 Y 9.20 3.62 0.00 2.75 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 H 8.02 4.24 0.00 3.22 3.30 0.00 5.82 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 E 8.36 4.66 0.00 2.12 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 2.02 2.07 0.00 160 K 8.69 4.27 0.00 1.46 0.85 0.00 1.52 0.00 0.00 1.18 0.00 0.00 3.06 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.10 1.22 7.81 161 G 8.23 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 0.00 0.00 0.00 0.00 162 I 8.01 4.57 1.83 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.87 0.94 0.00 0.00 163 Y 8.92 4.45 0.00 3.03 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 0.00 164 Y 8.95 4.46 0.00 2.98 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 0.00 165 A 7.77 5.62 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 0.00 166 G 7.92 4.12 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 0.00 0.00 0.00 167 E 8.32 4.83 0.00 1.96 1.85 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 2.23 2.30 0.00 168 P 0.00 4.75 0.00 2.38 2.35 0.00 3.85 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.98 0.00 169 V 7.28 3.45 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 0.80 0.00 0.00 0.97 0.00 0.00 170 R 8.81 3.75 0.00 1.85 2.07 0.00 3.36 0.00 0.00 3.24 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.62 0.00 *171 L 7.69 4.14 0.00 1.41 1.48 0.92 0.72 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 * Residues marked with a * may have inaccurate shift predictions.