NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1989 8.1727 122.0595 56.3334 34.0968 174.0717 2 V 4.2129 8.2682 127.5894 61.2524 31.8773 173.6890 3 Y 4.2170 9.3897 127.2759 57.8063 39.2150 174.8715 4 D 4.3819 8.6898 122.2980 53.7036 42.4786 176.8631 5 R 3.1170 8.5344 125.6810 60.0537 29.9426 179.3831 6 C 4.3797 8.1171 115.0768 59.5135 34.9830 175.5179 7 E 3.8848 7.9063 121.0694 58.9579 29.1021 178.6715 8 L 3.8061 8.2095 120.3836 57.9983 42.1712 178.4619 9 A 4.0250 7.8325 120.7364 55.6223 18.2739 179.9120 10 R 3.8677 8.1095 116.0550 59.2927 29.6389 179.2363 11 A 4.0241 7.7913 120.6319 55.0175 18.3559 179.7629 12 L 3.8640 8.2488 117.9820 57.5861 41.5894 179.4704 13 K 3.8846 8.2623 119.5219 59.5785 31.9514 178.7668 14 A 4.0630 7.8525 119.5699 54.5082 18.3391 178.7224 15 S 4.5025 7.4293 110.9056 58.0292 63.2243 174.7844 16 G 3.9018 7.6666 109.8344 46.5219 0.0000 174.9895 17 M 3.7887 7.8329 120.9505 56.6538 32.1310 175.8134 18 D 4.5641 7.9244 118.0231 56.6405 40.4952 175.6152 19 G 3.9582 9.1632 115.6364 44.9367 0.0000 170.7949 20 Y 3.9377 8.0531 121.0798 58.4713 38.6000 175.7831 21 A 3.6382 8.8159 129.9471 53.2772 16.0811 177.5862 22 G 3.7721 8.4054 105.0966 47.4169 0.0000 174.2383 23 N 4.6833 7.7726 117.8349 50.7097 39.0766 174.9433 24 S 4.7202 8.3465 118.3111 57.7856 64.1000 175.1168 25 L 4.1890 8.8860 122.9069 58.4328 41.7255 177.6881 26 P 4.4483 0.0000 0.0000 65.4711 31.1644 178.4284 27 N 4.3968 8.0388 115.1727 56.2148 38.5560 177.4926 28 W 4.2013 7.9031 119.8568 59.5291 29.1675 178.7823 29 V 3.7544 7.8808 118.1194 66.0470 30.9240 177.2019 30 C 3.3974 8.0447 118.4867 59.4097 44.4158 175.6282 31 L 4.0430 8.0809 121.3308 58.9543 40.0488 179.4394 32 S 4.3283 8.1013 117.3264 60.4655 62.7136 176.3443 33 K 2.6220 7.9151 122.3722 59.1483 31.7260 178.9047 34 W 4.2693 7.5143 116.9763 58.8884 29.0853 178.3135 35 E 4.3884 8.2089 118.5596 58.3993 29.4301 177.5102 36 S 4.5367 7.6904 109.4818 56.6316 64.5856 173.8423 37 S 3.1220 7.9657 115.9618 60.4245 60.2661 170.9239 38 Y 3.6578 7.3415 112.4692 58.8533 35.6050 169.0830 39 N 5.3561 7.5660 118.0302 51.9083 39.8323 175.9220 40 T 3.8982 8.6415 117.0402 64.2962 69.0759 175.6214 41 Q 4.6198 8.0233 119.2798 55.5771 28.9747 175.1468 42 A 4.4556 7.6976 122.1142 52.0478 19.4898 177.5388 43 T 4.9622 8.2780 110.9958 60.1316 72.4747 173.2179 44 N 4.7548 8.4697 121.9842 52.5962 42.3850 173.3408 45 R 4.5892 8.6527 127.1943 56.1721 31.1615 175.0806 46 N 5.0848 9.1513 123.2130 51.4927 41.1280 175.2545 47 T 3.9809 8.6692 110.4801 65.2318 68.6249 175.9265 48 D 4.5741 8.0009 117.1649 53.2607 38.9390 177.0855 49 G 3.9377 7.9974 109.1529 45.5134 0.0000 174.1658 50 S 4.7258 7.6391 113.9944 57.9024 65.4328 173.3160 51 T 5.0778 8.9252 116.4565 61.9525 72.7525 172.7103 52 D 5.4266 9.0868 124.7747 53.2339 43.4685 175.1238 53 Y 4.9398 8.9984 120.3500 57.5230 41.4549 176.8438 54 G 4.1055 9.0588 112.7934 44.9212 0.0000 173.6552 55 I 3.6005 8.1172 116.5559 62.8546 38.1077 178.2334 56 F 4.8030 7.9778 115.6805 56.5719 40.1008 175.3013 57 Q 3.5385 7.6182 118.8386 57.0929 26.4048 173.4578 58 I 4.2632 8.1602 118.9872 60.8039 39.0299 176.6008 59 N 5.2400 9.1635 126.4725 53.6994 39.8216 175.4568 60 S 4.5949 8.9863 120.0898 60.1405 63.4262 175.2943 61 R 3.7807 8.4943 122.4720 58.9544 30.4407 177.3458 62 Y 4.0506 7.6986 114.9379 58.2643 40.4534 178.0883 63 W 4.7567 8.0254 118.6256 57.5338 30.3022 173.4787 64 C 5.6240 7.8840 109.5802 52.4366 45.0559 172.1678 65 D 4.8977 8.9088 120.3084 52.6864 41.8609 176.0980 66 D 4.7755 8.4515 123.7859 52.1340 40.3607 176.3237 67 G 3.9659 8.6142 107.3700 46.4550 0.0000 174.4267 68 R 4.6008 8.3261 112.3076 55.5805 30.6156 174.5849 69 T 4.4735 7.8208 115.4887 61.2620 69.8716 172.3707 70 P 4.2036 0.0000 0.0000 63.3564 32.4560 176.5778 71 G 3.7094 8.5451 112.0185 46.2038 0.0000 172.3672 72 A 4.7483 7.4288 120.1110 50.6938 21.5922 177.3386 73 K 4.1968 8.3737 118.7304 55.5078 33.8858 176.4216 74 N 4.1015 7.9429 115.8933 54.6841 36.7683 174.5167 75 V 3.7746 8.4685 119.3142 65.6142 32.3641 176.3008 76 C 4.5272 8.4857 116.0521 57.2726 40.3818 173.5574 77 G 3.8542 7.8683 106.6909 46.5997 0.0000 173.0979 78 I 4.7065 7.5541 110.6544 58.4085 41.3916 174.1466 79 R 4.6335 8.3458 119.0333 55.6225 30.9382 177.7362 80 C 4.1007 8.7883 119.7665 59.8130 34.2480 176.4750 81 S 3.9864 8.0083 115.5458 61.8162 61.9606 176.2061 82 Q 4.2097 7.7626 118.9329 57.3488 28.5771 177.1925 83 L 4.5064 7.9771 119.2951 54.8420 42.2305 176.7547 84 L 5.4925 7.6687 117.4534 53.8590 42.5968 176.8578 85 T 4.2604 7.4988 109.8335 61.1934 69.6066 175.3345 86 D 4.3277 8.5629 122.3367 56.9383 41.1518 176.4746 87 D 4.6370 7.3529 117.0515 53.5889 41.4866 176.5394 88 L 4.2839 8.4991 125.7804 55.6690 41.9527 178.5666 89 T 3.8390 7.9316 116.9407 66.9698 68.3825 176.0730 90 V 3.5823 7.7425 118.9053 65.7378 31.6485 177.6257 91 A 4.0966 7.9965 120.0521 55.3279 18.2132 179.4128 92 I 3.4090 8.0728 118.5460 64.5342 37.0588 178.5911 93 R 3.6923 7.6446 118.9728 59.5062 29.7701 177.7847 94 C 4.2103 8.3578 118.0172 59.5547 40.0547 175.2383 95 A 3.8707 8.1495 122.7836 55.0996 17.5643 179.6870 96 K 3.4083 7.6091 116.2407 59.5263 32.1865 179.2516 97 R 4.0640 7.5745 118.9598 59.1347 29.8379 178.7219 98 V 2.6738 7.5851 118.3601 65.6880 31.2171 178.0060 99 V 3.9791 7.8681 110.1445 62.7717 31.1944 177.8051 100 L 4.2217 7.6281 118.9202 55.9154 42.1323 176.9844 101 D 4.6601 7.3188 118.8069 53.1963 41.5569 175.3064 102 P 4.2574 0.0000 0.0000 66.1302 31.6440 178.0114 103 N 4.4443 8.2543 114.3307 53.8468 40.0546 176.2600 104 G 3.6759 7.8849 107.8572 47.1713 0.0000 176.6169 105 I 3.7236 7.9412 122.2481 62.9324 37.8384 177.2787 106 G 3.9222 7.4559 106.7962 46.7923 0.0000 174.5377 107 A 3.8749 7.6721 122.8387 53.8048 18.7769 178.3026 108 W 4.6974 7.9168 117.1658 55.3613 30.1460 177.3045 109 V 3.6967 8.6095 124.3583 66.1047 31.0713 177.6869 110 A 4.1419 8.1608 119.1022 54.7009 18.1298 179.5518 111 W 3.9454 8.2593 126.6157 60.8360 30.7711 178.3473 112 R 3.7899 8.0976 116.6075 58.9407 29.5247 178.5015 113 L 3.9491 7.6476 119.2430 57.4543 42.3630 177.6120 114 H 4.4308 7.8441 112.4182 55.4168 29.7522 174.0912 115 C 4.4788 7.2212 117.2779 57.8936 42.0236 174.1222 116 Q 3.3064 6.7779 120.2869 57.1578 28.6793 175.7733 117 N 4.1699 8.5783 122.1603 54.7470 35.9139 173.5512 118 Q 4.5242 7.4713 113.6734 53.9734 32.8433 174.8687 119 D 4.6552 8.5594 118.9119 53.5778 41.2873 175.7803 120 L 4.9400 8.4140 125.7639 54.4612 42.6774 178.1396 121 R 3.9610 8.2877 121.4907 59.5843 29.9028 178.5867 122 S 4.1994 8.0095 110.4600 61.1821 63.1147 174.9892 123 Y 4.2406 8.0833 118.2680 59.9420 37.9379 176.7927 124 V 4.2910 7.7963 110.8898 60.8691 33.8259 175.4618 125 A 4.1111 7.5253 122.5042 54.0380 18.3447 177.9563 126 G 3.9738 8.9437 110.1639 45.8675 0.0000 174.9066 127 C 4.3699 8.2876 117.0527 57.1767 40.6387 173.8232 128 G 3.8042 8.1275 106.7802 47.0572 0.0000 173.9466 129 V 4.0143 7.8765 117.5692 61.1129 32.1302 176.0075 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 K 8.17 4.20 0.00 1.92 1.81 0.00 1.41 0.00 0.00 1.43 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.87 1.16 7.81 2 V 8.27 4.21 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 0.90 0.00 0.00 0.95 0.00 0.00 3 Y 9.39 4.22 0.00 2.95 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 4 D 8.69 4.38 0.00 2.76 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 5 R 8.53 3.12 0.00 1.64 1.80 0.00 3.54 0.00 0.00 3.46 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.79 0.00 6 C 8.12 4.38 0.00 3.11 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 7 E 7.91 3.88 0.00 2.01 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 0.00 2.46 2.32 0.00 8 L 8.21 3.81 0.00 1.71 1.67 0.43 1.28 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 9 A 7.83 4.02 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 10 R 8.11 3.87 0.00 2.04 2.00 0.00 3.13 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.93 0.00 11 A 7.79 4.02 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 L 8.25 3.86 0.00 1.67 1.62 1.03 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.26 3.88 0.00 1.98 2.00 0.00 1.55 0.00 0.00 1.68 0.00 0.00 3.05 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.45 1.52 7.81 14 A 7.85 4.06 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 15 S 7.43 4.50 0.00 3.73 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 16 G 7.67 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 M 7.83 3.79 0.00 1.12 1.95 0.00 0.00 0.00 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.24 0.00 18 D 7.92 4.56 0.00 2.68 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 19 G 9.16 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 0.00 0.00 0.00 20 Y 8.05 3.94 0.00 3.27 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 21 A 8.82 3.64 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 G 8.41 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 0.00 0.00 0.00 23 N 7.77 4.68 0.00 2.97 2.26 0.00 0.00 6.77 7.67 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 24 S 8.35 4.72 0.00 4.07 4.06 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 25 L 8.89 4.19 0.00 2.07 1.83 1.08 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 26 P 0.00 4.45 0.00 2.29 2.43 0.00 3.65 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.29 0.00 27 N 8.04 4.40 0.00 2.73 2.54 0.00 0.00 6.86 7.85 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 28 W 7.90 4.20 0.00 3.52 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 29 V 7.88 3.75 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 1.33 0.00 0.00 1.12 0.00 0.00 30 C 8.04 3.40 0.00 2.15 3.02 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 31 L 8.08 4.04 0.00 2.05 2.10 0.71 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 32 S 8.10 4.33 0.00 4.00 3.85 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 33 K 7.92 2.62 0.00 1.65 1.50 0.00 1.64 0.00 0.00 0.61 0.00 0.00 2.65 0.00 0.00 2.52 0.00 0.00 0.00 0.00 0.63 0.98 7.81 34 W 7.51 4.27 0.00 3.28 3.18 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 35 E 8.21 4.39 0.00 2.10 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 2.66 2.66 0.00 36 S 7.69 4.54 0.00 4.09 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 37 S 7.97 3.12 0.00 3.98 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 38 Y 7.34 3.66 0.00 3.24 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 39 N 7.57 5.36 0.00 2.87 2.84 0.00 0.00 6.99 7.10 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 40 T 8.64 3.90 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 1.42 0.00 0.00 41 Q 8.02 4.62 0.00 2.25 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.88 0.00 0.00 0.00 0.00 0.00 2.49 2.33 0.00 42 A 7.70 4.46 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 43 T 8.28 4.96 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 1.13 0.00 0.00 44 N 8.47 4.75 0.00 2.84 2.72 0.00 0.00 6.89 7.62 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 45 R 8.65 4.59 0.00 1.81 1.78 0.00 3.31 0.00 0.00 3.22 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.71 0.00 46 N 9.15 5.08 0.00 2.79 2.74 0.00 0.00 6.98 7.93 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 47 T 8.67 3.98 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 48 D 8.00 4.57 0.00 2.79 2.81 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 49 G 8.00 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 0.00 0.00 0.00 50 S 7.64 4.73 0.00 3.96 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 51 T 8.93 5.08 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.00 0.00 52 D 9.09 5.43 0.00 2.69 2.78 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 53 Y 9.00 4.94 0.00 2.99 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 54 G 9.06 4.11 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 0.00 0.00 0.00 55 I 8.12 3.60 1.60 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 2.06 -0.24 0.00 0.00 56 F 7.98 4.80 0.00 3.28 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 57 Q 7.62 3.54 0.00 2.44 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.99 6.84 0.00 0.00 0.00 0.00 0.00 2.57 2.72 0.00 58 I 8.16 4.26 2.10 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.95 1.06 0.00 0.00 59 N 9.16 5.24 0.00 3.01 3.08 0.00 0.00 6.98 7.68 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 60 S 8.99 4.59 0.00 4.05 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 0.00 61 R 8.49 3.78 0.00 1.67 1.77 0.00 2.76 0.00 0.00 2.85 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.96 0.00 62 Y 7.70 4.05 0.00 1.43 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 W 8.03 4.76 0.00 3.56 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 64 C 7.88 5.62 0.00 3.09 3.07 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 65 D 8.91 4.90 0.00 2.71 2.66 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 0.00 0.00 0.00 0.00 66 D 8.45 4.78 0.00 2.79 2.52 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 67 G 8.61 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 0.00 0.00 0.00 68 R 8.33 4.60 0.00 1.90 1.96 0.00 3.12 0.00 0.00 3.25 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.83 0.00 69 T 7.82 4.47 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 70 P 0.00 4.20 0.00 2.15 2.04 0.00 3.89 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 1.95 1.94 0.00 71 G 8.55 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 72 A 7.43 4.75 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 73 K 8.37 4.20 0.00 1.76 1.76 0.00 1.79 0.00 0.00 1.58 0.00 0.00 3.09 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.31 1.23 7.81 74 N 7.94 4.10 0.00 2.85 2.71 0.00 0.00 6.87 7.71 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 75 V 8.47 3.77 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 0.99 0.00 0.00 0.77 0.00 0.00 76 C 8.49 4.53 0.00 3.44 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 G 7.87 3.85 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 0.00 0.00 0.00 78 I 7.55 4.71 1.87 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 1.46 1.32 0.98 0.00 0.00 79 R 8.35 4.63 0.00 1.84 1.82 0.00 3.26 0.00 0.00 3.14 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.72 0.00 80 C 8.79 4.10 0.00 2.05 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 81 S 8.01 3.99 0.00 4.04 4.13 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 0.00 0.00 0.00 0.00 82 Q 7.76 4.21 0.00 2.22 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.85 0.00 0.00 0.00 0.00 0.00 2.40 2.39 0.00 83 L 7.98 4.51 0.00 1.80 1.83 1.03 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 84 L 7.67 5.49 0.00 1.76 1.76 1.10 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 85 T 7.50 4.26 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 86 D 8.56 4.33 0.00 2.72 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 87 D 7.35 4.64 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 88 L 8.50 4.28 0.00 1.72 1.62 0.72 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 89 T 7.93 3.84 4.34 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 1.19 0.00 0.00 90 V 7.74 3.58 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 1.07 0.00 0.00 0.94 0.00 0.00 91 A 8.00 4.10 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 92 I 8.07 3.41 1.87 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.83 0.65 0.00 0.00 93 R 7.64 3.69 0.00 1.94 2.07 0.00 3.07 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.59 0.00 94 C 8.36 4.21 0.00 3.06 3.07 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 95 A 8.15 3.87 0.70 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 0.00 0.00 96 K 7.61 3.41 0.00 1.58 1.29 0.00 1.27 0.00 0.00 0.82 0.00 0.00 2.30 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.30 0.95 7.81 97 R 7.57 4.06 0.00 1.88 2.09 0.00 3.24 0.00 0.00 3.18 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.86 0.00 98 V 7.59 2.67 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 -0.28 0.00 0.00 -0.61 0.00 0.00 99 V 7.87 3.98 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 1.09 0.00 0.00 1.45 0.00 0.00 100 L 7.63 4.22 0.00 1.78 1.78 1.04 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 101 D 7.32 4.66 0.00 2.99 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 0.00 102 P 0.00 4.26 0.00 2.02 2.13 0.00 3.68 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 2.03 2.13 0.00 103 N 8.25 4.44 0.00 2.69 2.81 0.00 0.00 7.03 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 0.00 104 G 7.88 3.68 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 0.00 0.00 0.00 105 I 7.94 3.72 1.30 0.00 0.00 -0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.23 -0.46 0.00 0.00 106 G 7.46 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 0.00 107 A 7.67 3.87 0.77 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 0.00 0.00 108 W 7.92 4.70 0.00 3.63 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 0.00 109 V 8.61 3.70 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 1.10 0.00 0.00 1.00 0.00 0.00 110 A 8.16 4.14 1.60 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 0.00 0.00 111 W 8.26 3.95 0.00 3.42 3.49 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 0.00 112 R 8.10 3.79 0.00 2.07 2.02 0.00 3.36 0.00 0.00 3.44 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.11 0.00 113 L 7.65 3.95 0.00 1.75 1.40 0.83 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 114 H 7.84 4.43 0.00 2.27 2.28 0.00 5.86 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 0.00 115 C 7.22 4.48 0.00 2.02 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 0.00 116 Q 6.78 3.31 0.00 0.93 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.80 0.00 0.00 0.00 0.00 0.00 2.10 2.03 0.00 117 N 8.58 4.17 0.00 2.78 2.82 0.00 0.00 6.87 7.69 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 0.00 118 Q 7.47 4.52 0.00 2.06 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 2.39 2.51 0.00 119 D 8.56 4.66 0.00 2.63 2.62 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 0.00 120 L 8.41 4.94 0.00 1.87 1.88 0.95 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 121 R 8.29 3.96 0.00 2.01 1.99 0.00 3.37 0.00 0.00 3.41 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.62 0.00 122 S 8.01 4.20 0.00 3.84 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 Y 8.08 4.24 0.00 3.23 3.17 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 0.00 124 V 7.80 4.29 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 0.94 0.00 0.00 1.04 0.00 0.00 125 A 7.53 4.11 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 0.00 126 G 8.94 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 0.00 0.00 0.00 127 C 8.29 4.37 0.00 3.10 3.17 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 0.00 128 G 8.13 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 0.00 129 V 7.88 4.01 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 0.76 0.00 0.00 0.96 0.00 0.00