NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1B H 4.5736 8.3033 117.8248 54.5845 30.7674 172.8619 1C H 3.9836 8.5578 115.3496 56.9491 26.1039 172.5731 1D H 4.1727 9.0636 112.5662 57.0843 27.2200 174.3130 1E H 5.0994 8.0502 113.4755 53.8575 32.7397 173.1345 1F H 4.6258 8.9636 116.8583 56.0794 28.8739 174.3821 1G F 4.8084 8.4781 119.7679 57.8458 39.9937 174.3204 2 N 4.6299 8.5098 117.1561 52.3343 39.0067 174.6620 3 L 4.8230 8.0805 123.1663 52.0122 44.2253 174.4745 4 P 4.5268 0.0000 0.0000 61.5381 32.3210 174.4589 5 P 4.3133 0.0000 0.0000 62.9101 32.1551 174.6142 6 G 3.6611 8.5588 104.8257 44.5233 0.0000 171.4818 7 N 4.6377 8.0138 115.0269 51.4979 40.2094 173.5665 8 Y 4.7909 8.0735 113.3224 57.7867 38.6548 176.8834 9 K 4.0399 8.2218 121.0324 59.1964 32.2799 177.3073 10 K 4.5930 7.6587 115.5614 53.7922 34.2199 174.4406 11 P 4.6985 0.0000 0.0000 63.0938 32.8710 175.0224 12 K 5.2100 9.5998 120.1885 54.8376 37.1231 174.9438 13 L 5.0507 9.0675 121.5897 53.1524 44.4471 175.8902 14 L 5.0194 8.6199 123.5284 53.5188 43.4488 174.9905 15 Y 4.8272 9.2461 127.6534 56.5911 40.1016 173.9372 16 C 4.1567 8.7136 129.6738 58.5281 32.1629 174.2218 17 S 4.2869 8.4612 121.4573 60.3288 62.7316 175.3959 18 N 4.2376 8.1104 119.4545 56.3371 38.7842 175.5124 19 G 3.9013 7.6101 102.2526 44.5345 0.0000 173.0547 20 G 3.1354 7.8239 107.2418 45.9982 0.0000 173.3550 21 H 4.5970 7.2597 115.6546 54.0758 31.3843 174.0746 22 F 5.3122 8.8175 120.2463 56.2080 40.6330 175.2530 23 L 4.5467 8.9291 126.3732 55.5466 42.5119 176.1221 24 R 4.8507 9.7987 127.3324 54.5652 33.5234 173.9239 25 I 4.6455 8.1753 126.3920 59.5929 38.7680 175.5342 26 L 4.2665 9.2697 128.5677 52.9905 42.7217 176.3028 27 P 4.1420 0.0000 0.0000 65.9867 31.2576 177.3754 28 D 4.4253 7.9165 114.3220 54.3042 39.6822 176.8627 29 G 4.0679 8.9877 110.0362 45.2924 0.0000 173.5571 30 T 4.4418 8.7326 117.3652 62.8300 69.3389 173.8654 31 V 4.8679 7.9321 123.9771 61.3185 34.5241 174.7485 32 D 4.5732 8.7169 124.9185 53.1695 42.9783 174.0031 33 G 4.4793 8.6627 104.6409 45.4515 0.0000 172.2953 34 T 4.9619 8.9034 116.3740 60.3102 70.9093 174.7676 35 R 4.0209 8.8035 124.5850 57.0686 30.9349 176.2968 36 D 4.6247 8.1753 119.0961 53.2830 40.3432 176.6606 37 R 3.9901 8.7600 128.0211 58.4661 30.3136 177.2003 38 S 4.3918 8.7324 111.1639 58.8759 63.6150 174.0883 39 D 4.3948 7.7842 121.6918 55.1531 41.3072 175.6410 40 Q 4.4945 8.5098 123.3135 56.2892 29.2142 175.6277 41 H 4.9044 9.3184 115.3046 55.4633 29.2985 175.0745 42 I 4.5142 7.1976 110.5852 60.6516 38.7309 175.3994 43 Q 4.2356 7.8038 122.0233 55.6299 29.8123 174.7139 44 L 5.1185 9.0840 124.5197 52.8398 45.5462 175.2359 45 Q 4.7849 9.2866 125.2832 54.7548 30.4702 174.2316 46 L 5.4955 8.7773 126.3257 52.8904 43.9267 175.8789 47 S 4.4763 8.1752 114.5553 57.0398 66.7038 172.2214 48 A 5.6011 8.1837 122.3744 49.8309 20.3425 176.4674 49 E 4.1603 8.9592 123.9619 58.7841 30.2225 176.5803 50 S 4.7895 7.5351 112.2705 55.9908 67.2260 173.3671 51 V 3.8220 8.3635 121.3047 64.8210 31.5333 176.4440 52 G 3.9280 9.1651 114.7322 45.1619 0.0000 172.0162 53 E 5.0550 8.2836 120.4354 54.7591 31.6353 175.6833 54 V 4.9088 9.1417 117.3178 59.7661 36.5916 174.1089 55 Y 5.1613 8.8339 120.1419 56.6207 40.9397 175.3686 56 I 4.4012 8.5450 122.4506 59.6284 40.4731 173.8571 57 K 4.6778 8.7234 129.1427 54.0987 35.0324 175.0485 58 S 4.6418 8.7059 122.9644 58.2695 62.6644 174.9912 59 T 4.0386 8.4140 118.4618 64.8118 68.7561 175.9501 60 E 4.0148 8.4183 122.5725 58.8929 29.8220 177.2658 61 T 4.2970 7.8545 105.8243 60.9579 70.3062 175.4633 62 G 3.8009 8.4686 110.0565 44.8772 0.0000 173.5770 63 Q 4.4024 7.7435 118.8202 56.1365 30.2392 174.6221 64 Y 4.8555 8.9274 119.3211 55.9269 40.8986 175.1949 65 L 4.4825 9.0742 126.4543 55.2793 43.4569 175.5632 66 A 5.2382 8.6278 126.1794 50.8010 23.2738 174.3664 67 M 5.4588 8.7148 119.2617 53.9834 35.0143 175.4940 68 D 5.5178 9.4855 125.9286 51.4494 41.4346 177.1048 69 T 4.3301 8.5480 108.5157 64.2207 67.6127 174.3813 70 D 4.6395 8.7982 122.0978 53.7499 41.1095 177.2431 71 G 3.1722 8.6893 107.8812 45.9922 0.0000 173.0772 72 L 4.8608 7.3412 116.6639 52.5696 43.3764 176.3967 73 L 5.1635 8.3508 122.8604 55.2064 42.9636 175.3602 74 Y 4.8121 8.5347 117.3346 56.4736 41.8225 173.3754 75 G 4.1820 8.8970 108.9302 45.3062 0.0000 173.3160 76 S 4.9213 9.1977 122.5204 57.2243 63.4484 175.4261 77 Q 4.2699 9.0851 125.7429 58.4148 28.9221 176.6418 78 T 4.7840 7.5896 112.2445 60.5578 72.0153 171.6235 79 P 4.0159 0.0000 0.0000 62.3495 32.1518 175.1723 80 N 5.0713 8.2161 118.0062 50.6839 41.0007 174.9653 81 S 4.2927 8.5907 111.7310 61.0855 62.8790 175.5576 82 E 4.1914 8.5034 119.5327 57.3125 29.4496 177.2781 83 C 4.9947 8.0340 115.8081 59.2383 29.0597 173.3955 84 L 4.3691 6.9544 120.4158 53.6118 42.9725 175.8222 85 F 5.1349 8.8577 121.1990 55.6093 43.6158 174.3954 86 L 4.8453 9.1605 123.4539 53.7429 42.3332 175.6947 87 E 4.1966 8.9630 127.1254 55.7537 30.0123 176.1300 88 R 4.8236 8.5289 125.4690 54.0959 34.6741 174.8633 89 L 4.7634 8.7832 124.4000 55.2443 43.2659 175.7791 90 E 4.6535 8.8901 123.7014 55.2838 33.4483 175.0411 91 E 3.9942 9.6527 124.4815 57.5825 27.2359 174.0384 92 N 4.3224 8.5575 111.3207 54.2385 36.5015 174.3243 93 H 4.7321 8.2116 115.2632 57.4679 35.2665 172.7887 94 Y 4.8231 8.2205 116.3719 56.7389 40.7328 174.1475 95 N 5.5396 9.6156 118.5479 52.0954 40.9976 174.6652 96 T 5.2784 8.8461 112.7964 60.1466 73.1388 172.5691 97 Y 5.0507 8.6538 119.0382 56.5760 41.5993 174.2657 98 I 4.7011 8.4482 126.1011 59.4439 39.3205 175.4810 99 S 4.0762 9.0033 122.9174 58.4070 62.4073 173.9797 100 K 3.8585 8.5178 129.2001 59.3503 32.2254 178.6339 101 A 3.8786 7.7356 120.1564 54.7210 18.6657 177.1133 102 H 4.9240 7.9693 112.3955 54.0779 29.6867 175.9565 103 A 4.0037 7.7973 124.5147 54.9879 18.6651 180.6720 104 E 3.9977 8.0173 113.6313 58.7724 29.9286 178.2683 105 K 4.1894 7.5189 116.6194 55.5462 32.8140 175.8811 106 N 3.7209 7.4104 115.5681 53.8702 36.2904 175.0074 107 W 5.0265 7.5390 117.8985 55.9914 30.8551 177.5793 108 F 5.5038 9.2301 124.3020 55.5841 41.2733 175.8603 109 V 3.9946 8.8042 121.2772 63.1137 32.6346 175.1958 110 G 4.4169 8.4852 111.9659 45.5357 0.0000 171.6852 111 L 5.3261 8.4870 121.7857 52.4646 45.2949 177.0665 112 K 4.1519 9.0136 123.0578 55.4626 32.9085 178.3524 113 K 3.8488 8.4739 119.7607 59.4707 31.9407 177.8926 114 N 4.5324 8.0712 113.8218 52.6796 37.6159 175.8671 115 G 3.5164 8.2122 107.9976 45.5610 0.0000 173.3347 116 S 4.9146 7.8353 114.6944 56.7104 65.3789 173.6340 117 C 4.6788 8.5151 119.2464 60.0458 28.4961 173.3737 118 K 4.3354 8.9657 124.7343 55.6190 33.3205 175.8514 119 R 4.4031 8.3561 124.8819 54.7475 31.4196 176.9627 120 G 3.3873 8.8686 116.1375 48.3257 0.0000 173.9749 121 P 4.0851 0.0000 0.0000 64.5925 31.3774 177.5987 122 R 4.2837 7.7306 115.1453 56.4632 30.3613 176.3629 123 T 5.0951 7.3848 108.3525 60.3101 70.5548 173.8139 124 H 5.0397 8.2675 118.0224 54.6175 32.8440 172.8745 125 Y 4.0565 8.5914 119.8448 59.8736 38.1523 176.8976 126 G 4.0878 9.0608 111.5550 45.4776 0.0000 173.8036 127 Q 4.3749 7.6023 118.7999 54.7808 30.0527 177.0761 128 K 3.5920 8.3244 119.5870 58.5344 32.8698 179.2153 129 A 4.0436 8.1859 121.5004 53.9231 18.2497 178.5523 130 I 4.5419 6.7561 105.7388 60.3987 38.4848 175.5379 131 L 4.3531 7.3366 123.3084 54.1496 42.3888 175.7252 132 F 5.5199 9.5378 123.3089 55.5831 42.8457 174.9250 133 L 5.2604 9.2466 122.0466 52.3207 44.2037 174.2089 134 P 5.0950 0.0000 0.0000 62.6522 32.6181 175.7420 135 L 4.9108 9.0978 122.5967 52.3419 45.2683 174.0776 136 P 4.7094 0.0000 0.0000 62.0961 32.2903 176.7887 137 V 3.8357 8.0352 116.2042 61.6833 31.0508 176.1405 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 1B H 8.30 4.57 0.00 3.12 3.56 0.00 5.75 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1C H 8.56 3.98 0.00 3.42 3.35 0.00 5.85 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1D H 9.06 4.17 0.00 3.23 3.31 0.00 5.64 0.00 0.00 0.00 0.00 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1E H 8.05 5.10 0.00 3.36 3.24 0.00 5.66 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 1F H 8.96 4.63 0.00 3.34 3.43 0.00 5.66 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1G F 8.48 4.81 0.00 2.90 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 2 N 8.51 4.63 0.00 2.93 2.78 0.00 0.00 6.87 6.74 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 3 L 8.08 4.82 0.00 1.48 1.41 0.60 0.37 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 4 P 0.00 4.53 0.00 2.18 2.13 0.00 3.68 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 1.96 1.92 0.00 5 P 0.00 4.31 0.00 2.17 2.06 0.00 3.72 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 1.96 1.94 0.00 6 G 8.56 3.66 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 0.00 0.00 0.00 7 N 8.01 4.64 0.00 2.66 2.68 0.00 0.00 5.87 7.55 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 8 Y 8.07 4.79 0.00 3.05 3.26 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 9 K 8.22 4.04 0.00 1.89 1.92 0.00 1.69 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.52 1.56 7.81 10 K 7.66 4.59 0.00 1.75 1.73 0.00 1.75 0.00 0.00 1.76 0.00 0.00 3.06 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.41 7.81 11 P 0.00 4.70 0.00 2.09 2.16 0.00 3.64 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.98 0.00 12 K 9.60 5.21 0.00 1.64 1.84 0.00 1.74 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.44 1.50 7.81 13 L 9.07 5.05 0.00 1.54 1.37 0.44 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 14 L 8.62 5.02 0.00 1.61 1.66 0.37 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 15 Y 9.25 4.83 0.00 3.34 3.13 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 16 C 8.71 4.16 0.00 2.45 2.51 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 0.00 0.00 0.00 0.00 17 S 8.46 4.29 0.00 3.96 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 18 N 8.11 4.24 0.00 2.63 2.68 0.00 0.00 6.75 7.98 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 19 G 7.61 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 20 G 7.82 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 0.00 0.00 0.00 21 H 7.26 4.60 0.00 3.00 3.14 0.00 5.81 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 F 8.82 5.31 0.00 3.13 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 23 L 8.93 4.55 0.00 1.73 1.59 0.96 0.32 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 24 R 9.80 4.85 0.00 1.87 2.05 0.00 3.30 0.00 0.00 3.26 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.79 0.00 25 I 8.18 4.65 1.84 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 1.17 0.70 0.88 0.00 0.00 26 L 9.27 4.27 0.00 1.87 1.52 0.91 0.61 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 27 P 0.00 4.14 0.00 2.00 2.13 0.00 3.55 0.00 0.00 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.96 0.00 28 D 7.92 4.43 0.00 2.77 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 29 G 8.99 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 30 T 8.73 4.44 4.37 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 1.22 0.00 0.00 31 V 7.93 4.87 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 0.86 0.00 0.00 0.94 0.00 0.00 32 D 8.72 4.57 0.00 2.86 2.74 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 0.00 0.00 0.00 33 G 8.66 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 T 8.90 4.96 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 1.36 0.00 0.00 35 R 8.80 4.02 0.00 1.81 1.89 0.00 3.15 0.00 0.00 3.03 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.37 0.00 36 D 8.18 4.62 0.00 2.76 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 37 R 8.76 3.99 0.00 2.11 2.04 0.00 3.35 0.00 0.00 3.30 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.36 0.00 38 S 8.73 4.39 0.00 3.97 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 39 D 7.78 4.39 0.00 2.81 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 40 Q 8.51 4.49 0.00 1.90 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 7.12 0.00 0.00 0.00 0.00 0.00 2.25 2.25 0.00 41 H 9.32 4.90 0.00 3.30 3.48 0.00 5.77 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 7.20 4.51 1.83 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.46 1.02 0.00 0.00 43 Q 7.80 4.24 0.00 2.02 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.89 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 44 L 9.08 5.12 0.00 1.43 1.41 0.80 0.53 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 45 Q 9.29 4.78 0.00 2.09 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.77 0.00 0.00 0.00 0.00 0.00 2.27 2.37 0.00 46 L 8.78 5.50 0.00 1.70 1.39 0.93 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 47 S 8.18 4.48 0.00 3.88 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 48 A 8.18 5.60 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 49 E 8.96 4.16 0.00 1.80 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 2.29 2.42 0.00 50 S 7.54 4.79 0.00 3.91 3.74 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 0.00 0.00 0.00 51 V 8.36 3.82 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 0.94 0.00 0.00 1.04 0.00 0.00 52 G 9.17 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 E 8.28 5.06 0.00 2.12 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 2.23 2.32 0.00 54 V 9.14 4.91 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 0.72 0.00 0.00 1.16 0.00 0.00 55 Y 8.83 5.16 0.00 2.95 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 56 I 8.55 4.40 1.70 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.56 0.66 0.00 0.00 57 K 8.72 4.68 0.00 1.09 1.35 0.00 1.24 0.00 0.00 0.61 0.00 0.00 2.69 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.00 0.96 7.81 58 S 8.71 4.64 0.00 3.86 3.63 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 59 T 8.41 4.04 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 1.16 0.00 0.00 60 E 8.42 4.01 0.00 1.96 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 2.19 2.34 0.00 61 T 7.85 4.30 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 1.24 0.00 0.00 62 G 8.47 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 63 Q 7.74 4.40 0.00 2.01 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.88 6.72 0.00 0.00 0.00 0.00 0.00 2.40 2.33 0.00 64 Y 8.93 4.86 0.00 2.91 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 65 L 9.07 4.48 0.00 1.58 1.43 0.78 0.37 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 66 A 8.63 5.24 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 M 8.71 5.46 0.00 2.25 2.26 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.75 0.00 68 D 9.49 5.52 0.00 3.00 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 69 T 8.55 4.33 4.35 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 1.32 0.00 0.00 70 D 8.80 4.64 0.00 2.87 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 71 G 8.69 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 0.00 0.00 0.00 72 L 7.34 4.86 0.00 2.00 1.60 0.89 0.55 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 73 L 8.35 5.16 0.00 1.58 1.62 0.91 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 74 Y 8.53 4.81 0.00 3.12 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 G 8.90 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 76 S 9.20 4.92 0.00 3.80 3.87 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 77 Q 9.09 4.27 0.00 2.16 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.53 0.00 0.00 0.00 0.00 0.00 2.44 2.38 0.00 78 T 7.59 4.78 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 1.17 0.00 0.00 79 P 0.00 4.02 0.00 1.60 0.49 0.00 3.55 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.38 0.00 80 N 8.22 5.07 0.00 2.92 2.94 0.00 0.00 6.00 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 S 8.59 4.29 0.00 3.95 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 82 E 8.50 4.19 0.00 2.33 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 0.00 2.35 2.34 0.00 83 C 8.03 4.99 0.00 3.12 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 84 L 6.95 4.37 0.00 1.40 1.27 0.82 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 85 F 8.86 5.13 0.00 3.03 3.09 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 0.00 0.00 0.00 0.00 86 L 9.16 4.85 0.00 1.55 1.64 0.95 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 87 E 8.96 4.20 0.00 2.12 1.91 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 2.21 1.88 0.00 88 R 8.53 4.82 0.00 1.79 1.80 0.00 3.08 0.00 0.00 2.94 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 89 L 8.78 4.76 0.00 1.52 1.61 1.03 0.74 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 90 E 8.89 4.65 0.00 2.26 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 2.29 2.45 0.00 91 E 9.65 3.99 0.00 2.40 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 2.29 2.39 0.00 92 N 8.56 4.32 0.00 2.83 2.87 0.00 0.00 6.83 8.16 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 93 H 8.21 4.73 0.00 2.91 2.96 0.00 5.73 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 8.22 4.82 0.00 3.01 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 95 N 9.62 5.54 0.00 3.07 2.70 0.00 0.00 6.93 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 96 T 8.85 5.28 4.45 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 1.31 0.00 0.00 97 Y 8.65 5.05 0.00 2.78 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 98 I 8.45 4.70 1.77 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.20 0.54 0.65 0.00 0.00 99 S 9.00 4.08 0.00 4.03 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 0.00 100 K 8.52 3.86 0.00 1.64 1.61 0.00 1.52 0.00 0.00 1.47 0.00 0.00 2.77 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.22 1.11 7.81 101 A 7.74 3.88 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 0.00 102 H 7.97 4.92 0.00 2.78 2.13 0.00 5.64 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 A 7.80 4.00 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 0.00 104 E 8.02 4.00 0.00 2.06 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.18 0.00 105 K 7.52 4.19 0.00 0.89 1.60 0.00 1.26 0.00 0.00 1.73 0.00 0.00 2.97 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.31 1.09 7.81 106 N 7.41 3.72 0.00 2.90 2.77 0.00 0.00 6.90 8.60 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 0.00 107 W 7.54 5.03 0.00 3.28 3.09 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 0.00 0.00 0.00 0.00 108 F 9.23 5.50 0.00 2.84 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 V 8.80 3.99 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 0.66 0.00 0.00 0.59 0.00 0.00 110 G 8.49 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.49 5.33 0.00 1.48 1.44 1.01 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 112 K 9.01 4.15 0.00 1.96 1.68 0.00 1.64 0.00 0.00 1.61 0.00 0.00 2.89 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.41 1.47 7.81 113 K 8.47 3.85 0.00 1.70 1.85 0.00 1.70 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.56 1.46 7.81 114 N 8.07 4.53 0.00 2.80 2.88 0.00 0.00 6.10 7.00 0.00 0.00 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 G 8.21 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 S 7.84 4.91 0.00 3.89 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 0.00 117 C 8.52 4.68 0.00 2.88 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 0.00 118 K 8.97 4.34 0.00 1.71 1.72 0.00 1.75 0.00 0.00 1.59 0.00 0.00 2.82 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.39 1.34 7.81 119 R 8.36 4.40 0.00 1.78 1.63 0.00 3.14 0.00 0.00 3.24 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.53 0.00 120 G 8.87 3.39 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 0.00 121 P 0.00 4.09 0.00 1.87 2.13 0.00 3.03 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.31 0.00 122 R 7.73 4.28 0.00 1.82 1.93 0.00 3.30 0.00 0.00 3.24 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.63 0.00 123 T 7.38 5.10 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 1.38 0.00 0.00 124 H 8.27 5.04 0.00 3.22 3.28 0.00 5.63 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 Y 8.59 4.06 0.00 3.14 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 0.00 126 G 9.06 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 Q 7.60 4.37 0.00 1.95 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.94 6.77 0.00 0.00 0.00 0.00 0.00 2.33 2.47 0.00 128 K 8.32 3.59 0.00 1.80 1.65 0.00 1.60 0.00 0.00 1.72 0.00 0.00 2.82 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.34 1.32 7.81 129 A 8.19 4.04 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 0.00 130 I 6.76 4.54 1.58 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.29 0.61 0.00 0.00 131 L 7.34 4.35 0.00 1.20 0.81 0.19 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 132 F 9.54 5.52 0.00 3.35 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 0.00 133 L 9.25 5.26 0.00 1.76 1.67 1.02 0.82 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 0.00 134 P 0.00 5.10 0.00 2.18 2.22 0.00 3.83 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.11 0.00 135 L 9.10 4.91 0.00 1.62 1.60 1.12 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 136 P 0.00 4.71 0.00 1.94 1.99 0.00 3.69 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 2.03 2.13 0.00 137 V 8.04 3.84 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 0.57 0.00 0.00 0.94 0.00 0.00