NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.8980 8.3049 120.2886 55.3421 33.5711 174.3941 2 R 4.6108 9.2855 122.0221 53.5144 33.9836 172.8134 3 I 4.9298 8.5009 122.1547 59.4757 41.5690 174.0537 4 G 4.3141 9.0220 113.6976 44.9539 0.0000 170.7565 5 H 5.4521 8.8101 119.8602 54.2446 33.2173 172.5456 6 G 4.3648 8.7382 111.3032 44.7777 0.0000 170.9872 7 F 5.2982 8.5153 120.8621 57.1688 42.4839 172.5920 8 D 4.6191 7.8073 123.3007 53.3795 45.0809 173.8790 9 V 4.8763 7.8269 121.1123 61.8639 35.0123 173.5983 10 H 4.8954 8.9901 122.4581 54.0285 33.3590 172.5690 11 A 4.6783 8.4792 123.7821 51.2327 20.1084 176.9751 12 F 4.9191 8.6965 119.8670 57.6964 40.3148 175.4927 13 G 4.0024 9.9467 107.8864 47.5359 0.0000 174.8852 14 G 4.0532 8.1835 112.0618 44.7543 0.0000 172.0101 15 E 4.6020 8.3778 117.6083 55.0812 31.8460 177.0230 16 G 4.5798 8.3998 109.5925 45.1759 0.0000 170.7283 17 P 5.0360 0.0000 0.0000 61.9405 33.4948 174.9364 18 I 4.6563 8.8017 112.9377 59.2788 41.0587 174.7224 19 I 5.0115 8.1944 123.2825 59.7613 40.0259 174.9137 20 I 4.7862 8.3398 128.0612 60.4041 39.8042 176.0872 21 G 4.0401 10.7183 114.0491 46.4313 0.0000 174.7426 22 G 4.1624 8.8182 110.6198 45.0362 0.0000 175.2527 23 V 3.8607 7.5828 119.3445 62.4724 32.0702 174.9092 24 R 4.7525 8.5232 127.7095 55.6993 30.2418 174.9446 25 I 4.3772 8.7092 129.1425 58.8185 39.0327 173.8094 26 P 4.7791 0.0000 0.0000 63.1874 32.1025 174.9696 27 Y 4.8571 8.3973 122.2872 56.5902 42.3500 174.5140 28 E 3.8010 7.9843 123.6090 59.0825 29.8752 177.5293 29 K 5.0573 6.1481 116.3480 55.0682 35.3445 174.7265 30 G 4.6488 8.0368 106.7139 43.7825 0.0000 171.2673 31 L 5.3441 8.4767 118.9358 52.8288 43.9866 176.5787 32 L 4.3908 9.1840 124.5296 54.6077 42.1357 176.3025 33 A 4.3338 8.1490 122.7706 51.6968 21.4738 175.6772 34 H 4.3478 8.8087 120.5063 59.5780 30.4369 175.6700 35 S 4.7821 7.9101 116.6060 58.5022 63.6003 173.9669 36 D 4.5279 8.1894 121.6020 53.0154 39.4991 176.7651 37 G 3.6014 8.0596 107.1543 46.8947 0.0000 175.6206 38 D 4.9660 7.5870 121.5990 52.6866 38.7230 175.7889 39 V 3.6515 8.0192 124.0823 65.7551 31.5844 176.9816 40 A 3.9132 7.8716 119.5753 55.2275 18.2757 179.4230 41 L 4.0090 8.0171 116.7357 57.6014 41.8217 179.3355 42 H 4.2325 8.3551 116.3943 58.8113 28.6558 177.4193 43 A 3.9668 8.0790 122.6363 55.1411 18.1971 179.3669 44 L 3.8575 8.0648 118.7465 58.5521 42.1212 179.1769 45 T 3.8753 8.1931 115.9198 67.0414 68.4958 176.2470 46 D 4.4332 8.2219 120.2727 57.2535 40.7488 178.8795 47 A 3.9874 7.7585 121.0416 54.9938 18.3771 179.7425 48 L 3.9367 7.8742 117.3725 58.0535 41.7287 179.6336 49 L 4.0748 8.4025 119.4597 57.6742 41.5298 179.7591 50 G 3.6459 8.4850 105.7196 48.0208 0.0000 175.6647 51 A 4.2984 8.2026 123.0535 53.4468 18.4458 178.6518 52 A 3.2685 7.5753 117.0163 51.2094 19.2119 176.8613 53 A 3.6065 7.6124 118.9765 53.5223 16.3875 178.2032 54 L 4.5662 8.3572 117.8397 55.8158 43.7623 176.9140 55 G 3.9737 9.8330 109.8764 43.8939 0.0000 176.1052 56 D 4.6193 8.6038 124.4473 50.8311 42.4516 176.1182 57 I 3.6875 9.4826 119.4835 64.2252 37.6061 177.6591 58 G 3.7772 7.5781 102.8912 46.1231 0.0000 175.0577 59 K 4.1039 7.6338 121.6197 59.1790 32.6162 178.2890 60 L 3.9653 7.3482 117.1769 56.0658 42.4256 177.2859 61 F 4.4225 7.3047 118.1021 53.4998 39.5413 171.5034 62 P 4.3412 0.0000 0.0000 62.8124 31.9028 176.9324 63 D 4.4754 8.9986 122.8108 57.5022 41.2846 177.5177 64 T 4.0151 7.8365 107.8105 63.5968 69.4909 174.3160 65 D 4.3354 8.0985 123.0673 53.3281 41.5417 175.0290 66 P 4.2630 0.0000 0.0000 65.4345 31.4280 178.3342 67 A 3.8531 7.4530 121.1650 54.8377 18.5058 178.0773 68 F 4.6524 7.1584 113.2939 57.6462 38.9820 175.2371 69 K 3.7400 7.5358 123.3190 58.3424 31.0482 176.9758 70 G 3.8720 9.4067 116.2463 44.5756 0.0000 172.3976 71 A 3.8543 7.6017 123.1927 52.3327 18.8760 176.6186 72 D 4.5706 8.6269 122.1389 54.1352 41.4660 177.1411 73 S 4.0864 9.1160 124.3061 61.5134 62.6395 176.9324 74 R 3.8997 8.4223 121.2413 58.6868 29.7555 178.7870 75 E 3.8709 8.3793 118.9515 59.3899 29.4407 179.2645 76 L 3.2129 7.5677 118.4436 57.2785 41.6280 179.0611 77 L 3.9813 8.0451 120.4498 58.4698 41.9974 179.3534 78 R 4.0898 8.2809 118.1755 59.0798 29.9207 178.7963 79 E 3.9403 8.2485 118.8559 59.4036 29.7774 178.4529 80 A 4.2258 8.4679 120.9845 55.3343 18.2868 179.4626 81 W 4.4219 8.6137 126.7060 60.4198 30.7801 178.2984 82 R 3.6921 8.2411 118.9003 59.5529 29.6782 178.7245 83 R 3.9284 8.4435 118.2049 59.2783 29.8947 179.1927 84 I 3.7247 7.7882 119.6037 64.5197 37.0465 178.5318 85 Q 4.0377 8.0494 120.2635 58.2267 28.1845 178.6532 86 A 3.9491 7.7221 120.9868 54.8532 18.5056 178.9318 87 K 4.1704 7.6020 114.8028 57.2960 32.2311 177.4788 88 G 3.7358 8.1710 106.6766 46.1215 0.0000 173.1984 89 Y 4.8328 7.5702 117.8169 56.8114 39.8000 174.4722 90 T 4.9587 8.1761 110.6399 59.6774 72.6178 172.9500 91 L 4.3229 9.2915 125.8464 55.7784 42.3719 176.1697 92 G 4.0439 9.2561 115.2031 45.9087 0.0000 173.2323 93 N 4.5930 7.1427 116.5787 51.9415 40.0997 172.9244 94 V 4.9605 8.0995 112.3014 59.7889 36.4301 174.3413 95 D 5.0872 9.0102 121.7515 52.8171 44.7457 174.1555 96 V 4.7997 8.7155 125.4160 61.4213 34.9196 174.5578 97 T 4.8899 9.0201 122.9703 61.9021 71.8392 172.9059 98 I 4.2939 8.8313 129.1501 60.4964 38.9683 175.3726 99 I 4.7698 8.6302 128.6044 59.9484 38.4203 174.4454 100 A 4.8337 8.9067 128.7977 50.5488 22.2975 177.0034 101 Q 3.8370 8.9869 122.4204 58.8139 29.6188 175.8171 102 A 4.3307 7.2114 116.6270 50.5195 21.5387 173.6242 103 P 4.3922 0.0000 0.0000 61.6870 32.3496 175.8797 104 K 4.1439 8.3153 119.6030 56.2845 31.7167 176.2458 105 M 4.2452 8.7354 127.5737 58.0045 32.6000 178.5959 106 L 3.8408 8.0547 120.3992 57.8777 42.0283 177.2954 107 P 4.2873 0.0000 0.0000 65.2777 31.5310 176.8873 108 H 4.6270 8.2957 115.3721 56.4554 29.0659 177.0883 109 I 3.6799 7.4565 122.6512 63.7385 37.0375 176.2534 110 P 4.1712 0.0000 0.0000 65.7377 31.2105 178.4119 111 Q 3.7087 7.8780 117.6933 59.1627 28.9820 177.8513 112 M 4.2575 7.9026 121.1838 58.0498 32.0393 179.0500 113 R 3.9678 8.4157 118.3272 58.8611 30.1611 179.4405 114 V 3.5482 7.4265 118.0427 65.8265 31.4478 178.0585 115 F 4.5521 7.9365 117.4872 60.8099 38.7854 177.6095 116 I 3.6580 7.9556 119.0045 64.5658 36.9554 178.4778 117 A 3.9412 7.9971 121.2987 55.0728 17.9841 179.4135 118 E 3.9176 8.1134 117.3224 59.7608 29.4280 178.9419 119 D 4.3700 8.2377 118.5373 57.3228 41.0478 178.5017 120 L 3.5779 7.9429 117.1902 53.4637 42.5057 176.4704 121 G 3.9267 8.2441 107.2768 46.9874 0.0000 172.1001 122 C 4.9317 7.9966 113.1109 56.3019 33.2116 172.9657 123 H 4.7441 8.6270 115.4642 55.0103 29.6460 176.6152 124 M 4.0679 8.5387 120.8532 58.4062 31.9858 178.5015 125 D 4.3943 8.1365 117.0760 56.7785 41.6622 176.2106 126 D 4.7248 8.2049 117.7700 53.9937 41.0417 175.3897 127 V 4.8184 8.0245 120.1237 61.0714 34.1333 174.2670 128 N 5.1397 8.8470 125.3828 51.8205 42.4548 173.0513 129 V 5.0587 8.2805 123.5735 61.2019 35.0383 174.0329 130 K 4.8419 8.9632 124.8813 55.6068 36.6852 174.3293 131 A 5.2455 8.2542 120.4049 51.0944 22.5338 175.0621 132 T 4.6244 8.8897 112.4711 61.4064 71.3215 172.7813 133 T 5.0698 8.6870 116.4512 59.2444 71.8591 173.8745 134 T 4.4162 8.1326 109.0922 61.4702 69.6784 174.2129 135 E 3.8361 8.6069 117.2128 58.6097 27.2891 175.8207 136 K 4.1133 7.8936 112.1858 56.3420 31.0174 176.3838 137 L 4.3379 7.7741 119.8841 54.4777 43.0521 177.6927 138 G 4.0936 8.5618 110.2099 44.9303 0.0000 174.2031 139 F 4.7160 8.7693 114.5322 59.3574 37.4455 177.6546 140 T 4.1290 6.4173 111.5128 64.1187 68.7876 176.9711 141 G 3.6079 7.9377 108.9613 46.8857 0.0000 174.7823 142 R 4.5243 8.3722 118.0713 55.5054 30.3355 176.9512 143 G 4.1622 8.1694 107.0658 46.5778 0.0000 175.1213 144 E 4.3024 9.1353 122.5392 58.4829 29.4727 176.7107 145 G 3.6922 7.4477 105.5557 45.1985 0.0000 171.3806 146 I 4.6181 7.7421 118.8095 59.2773 40.6205 175.1674 147 A 5.1162 8.4527 125.7890 50.6671 23.1273 174.4168 148 C 4.9035 8.1663 117.3264 58.4618 35.5850 172.7080 149 E 5.3451 9.1188 124.2350 54.9899 33.3928 174.5851 150 A 5.0280 8.2379 120.3832 51.3621 23.2148 175.8770 151 V 5.0565 8.8907 112.4823 59.7848 36.3761 174.6776 152 A 5.1233 8.6966 122.8854 50.4216 23.3533 174.8747 153 L 5.0785 9.0117 121.9090 53.3858 45.0459 175.6146 154 L 5.2424 9.3514 126.1817 53.1903 45.0504 176.8212 155 I 4.2640 8.9626 120.9069 61.6036 37.6856 175.7262 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 M 8.30 4.90 0.00 1.96 2.11 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.75 0.00 2 R 9.29 4.61 0.00 1.75 1.86 0.00 3.36 0.00 0.00 3.54 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.79 0.00 3 I 8.50 4.93 1.89 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 1.30 1.47 0.92 0.00 0.00 4 G 9.02 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 0.00 0.00 0.00 0.00 5 H 8.81 5.45 0.00 3.13 3.14 0.00 5.68 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 G 8.74 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 7 F 8.52 5.30 0.00 3.05 2.92 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 8 D 7.81 4.62 0.00 2.69 2.42 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 9 V 7.83 4.88 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 0.77 0.00 0.00 1.03 0.00 0.00 10 H 8.99 4.90 0.00 2.97 3.02 0.00 5.66 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 A 8.48 4.68 1.21 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 0.00 0.00 12 F 8.70 4.92 0.00 3.11 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 G 9.95 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 14 G 8.18 4.05 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 0.00 0.00 0.00 15 E 8.38 4.60 0.00 1.91 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 2.34 2.24 0.00 16 G 8.40 4.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 P 0.00 5.04 0.00 2.21 2.13 0.00 3.75 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 1.98 1.98 0.00 18 I 8.80 4.66 1.94 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.19 1.15 0.00 0.00 19 I 8.19 5.01 1.85 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 1.35 1.30 0.91 0.00 0.00 20 I 8.34 4.79 1.85 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.30 0.88 0.00 0.00 21 G 10.72 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 G 8.82 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 0.00 0.00 0.00 0.00 23 V 7.58 3.86 2.20 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 0.90 0.00 0.00 0.96 0.00 0.00 24 R 8.52 4.75 0.00 1.90 1.89 0.00 3.30 0.00 0.00 3.25 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.67 0.00 25 I 8.71 4.38 1.82 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.36 0.83 0.00 0.00 26 P 0.00 4.78 0.00 2.12 2.09 0.00 3.78 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 2.04 2.01 0.00 27 Y 8.40 4.86 0.00 2.97 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 28 E 7.98 3.80 0.00 1.40 1.68 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 2.08 1.47 0.00 29 K 6.15 5.06 0.00 1.76 1.71 0.00 1.01 0.00 0.00 2.44 0.00 0.00 2.85 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.74 0.62 7.81 30 G 8.04 4.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.48 5.34 0.00 1.52 1.54 0.89 0.63 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 32 L 9.18 4.39 0.00 1.61 1.64 1.01 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 33 A 8.15 4.33 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 H 8.81 4.35 0.00 3.29 3.39 0.00 5.87 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 S 7.91 4.78 0.00 4.21 3.86 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 36 D 8.19 4.53 0.00 2.78 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 37 G 8.06 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 D 7.59 4.97 0.00 2.76 2.47 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.02 3.65 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 0.89 0.00 0.00 0.92 0.00 0.00 40 A 7.87 3.91 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 L 8.02 4.01 0.00 1.68 1.72 0.97 1.12 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 42 H 8.36 4.23 0.00 3.39 3.31 0.00 5.65 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 A 8.08 3.97 1.34 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 0.00 0.00 0.00 44 L 8.06 3.86 0.00 1.79 1.85 0.86 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 45 T 8.19 3.88 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 1.33 0.00 0.00 46 D 8.22 4.43 0.00 2.90 2.73 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 0.00 0.00 0.00 47 A 7.76 3.99 1.44 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 0.00 0.00 48 L 7.87 3.94 0.00 1.96 1.88 0.85 0.58 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 49 L 8.40 4.07 0.00 1.64 1.69 0.88 0.77 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 50 G 8.48 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 A 8.20 4.30 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 52 A 7.58 3.27 1.06 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 0.00 0.00 53 A 7.61 3.61 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 54 L 8.36 4.57 0.00 1.57 1.64 0.91 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 55 G 9.83 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 56 D 8.60 4.62 0.00 3.03 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 57 I 9.48 3.69 2.00 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.50 0.87 0.00 0.00 58 G 7.58 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 0.00 0.00 0.00 59 K 7.63 4.10 0.00 1.80 1.91 0.00 1.76 0.00 0.00 1.75 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.33 1.41 7.81 60 L 7.35 3.97 0.00 0.35 0.13 0.75 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 61 F 7.30 4.42 0.00 2.33 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 62 P 0.00 4.34 0.00 2.45 2.14 0.00 4.08 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 2.27 2.18 0.00 63 D 9.00 4.48 0.00 2.64 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 T 7.84 4.02 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 1.21 0.00 0.00 65 D 8.10 4.34 0.00 2.87 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 66 P 0.00 4.26 0.00 2.20 2.28 0.00 3.66 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 1.97 1.92 0.00 67 A 7.45 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 F 7.16 4.65 0.00 3.23 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 69 K 7.54 3.74 0.00 1.81 1.78 0.00 1.81 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.43 1.43 7.81 70 G 9.41 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 0.00 0.00 0.00 71 A 7.60 3.85 1.34 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 0.00 0.00 0.00 72 D 8.63 4.57 0.00 2.63 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 73 S 9.12 4.09 0.00 3.97 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 74 R 8.42 3.90 0.00 1.95 1.96 0.00 2.68 0.00 0.00 2.82 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.54 0.00 75 E 8.38 3.87 0.00 2.19 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 2.27 2.28 0.00 76 L 7.57 3.21 0.00 1.60 1.14 0.69 -0.37 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 77 L 8.05 3.98 0.00 1.80 1.82 0.92 1.22 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 78 R 8.28 4.09 0.00 2.02 2.04 0.00 3.18 0.00 0.00 3.11 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.86 0.00 79 E 8.25 3.94 0.00 2.11 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 2.62 2.69 0.00 80 A 8.47 4.23 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 81 W 8.61 4.42 0.00 3.50 3.31 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 82 R 8.24 3.69 0.00 2.03 2.12 0.00 3.16 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 83 R 8.44 3.93 0.00 2.01 1.97 0.00 3.18 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 2.03 0.00 84 I 7.79 3.72 1.91 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.99 0.89 0.00 0.00 85 Q 8.05 4.04 0.00 1.83 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 86 A 7.72 3.95 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 K 7.60 4.17 0.00 2.02 2.25 0.00 1.94 0.00 0.00 2.33 0.00 0.00 3.15 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.51 1.52 7.81 88 G 8.17 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 0.00 0.00 0.00 89 Y 7.57 4.83 0.00 2.97 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 90 T 8.18 4.96 4.38 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 1.26 0.00 0.00 91 L 9.29 4.32 0.00 1.69 1.69 0.60 0.78 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 92 G 9.26 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 N 7.14 4.59 0.00 2.93 2.88 0.00 0.00 5.81 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 94 V 8.10 4.96 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 0.69 0.00 0.00 0.86 0.00 0.00 95 D 9.01 5.09 0.00 2.69 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 96 V 8.72 4.80 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 0.89 0.00 0.00 0.90 0.00 0.00 97 T 9.02 4.89 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 1.21 0.00 0.00 98 I 8.83 4.29 1.84 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.70 0.86 0.00 0.00 99 I 8.63 4.77 1.91 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.87 0.84 0.00 0.00 100 A 8.91 4.83 1.15 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 0.00 0.00 101 Q 8.99 3.84 0.00 2.15 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.80 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 102 A 7.21 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 0.00 103 P 0.00 4.39 0.00 2.16 2.02 0.00 3.42 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 1.83 1.68 0.00 104 K 8.32 4.14 0.00 1.73 1.81 0.00 1.66 0.00 0.00 1.70 0.00 0.00 3.05 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.41 1.51 7.81 105 M 8.74 4.25 0.00 2.09 2.08 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.44 0.00 106 L 8.05 3.84 0.00 1.73 1.66 0.90 0.92 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 0.00 107 P 0.00 4.29 0.00 2.06 2.08 0.00 3.88 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 1.68 1.96 0.00 108 H 8.30 4.63 0.00 3.25 3.34 0.00 5.62 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 0.00 109 I 7.46 3.68 1.96 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.67 0.92 0.00 0.00 110 P 0.00 4.17 0.00 2.08 2.05 0.00 3.62 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 2.06 2.10 0.00 111 Q 7.88 3.71 0.00 1.99 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.90 0.00 0.00 0.00 0.00 0.00 2.14 1.77 0.00 112 M 7.90 4.26 0.00 2.09 2.22 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.63 0.00 113 R 8.42 3.97 0.00 1.94 1.95 0.00 3.09 0.00 0.00 3.06 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.75 0.00 114 V 7.43 3.55 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 1.00 0.00 0.00 0.91 0.00 0.00 115 F 7.94 4.55 0.00 3.31 2.89 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 0.00 116 I 7.96 3.66 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.77 0.83 0.00 0.00 117 A 8.00 3.94 1.40 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 0.00 0.00 0.00 118 E 8.11 3.92 0.00 2.44 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.62 0.00 119 D 8.24 4.37 0.00 2.71 2.73 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 0.00 0.00 0.00 120 L 7.94 3.58 0.00 1.29 0.96 0.59 -0.05 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 0.00 121 G 8.24 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 0.00 122 C 8.00 4.93 0.00 3.26 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 0.00 123 H 8.63 4.74 0.00 3.26 3.26 0.00 5.64 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 0.00 124 M 8.54 4.07 0.00 2.06 2.12 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.68 0.00 125 D 8.14 4.39 0.00 2.61 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.20 4.72 0.00 2.88 2.64 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 0.00 0.00 0.00 0.00 127 V 8.02 4.82 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 0.70 0.00 0.00 0.86 0.00 0.00 128 N 8.85 5.14 0.00 2.83 2.69 0.00 0.00 6.14 8.14 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 0.00 129 V 8.28 5.06 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 0.87 0.00 0.00 0.91 0.00 0.00 130 K 8.96 4.84 0.00 1.81 1.84 0.00 1.30 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.53 1.37 7.81 131 A 8.25 5.25 1.17 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 0.00 132 T 8.89 4.62 4.23 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 1.20 0.00 0.00 133 T 8.69 5.07 4.23 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 1.28 0.00 0.00 134 T 8.13 4.42 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 1.13 0.00 0.00 135 E 8.61 3.84 0.00 2.11 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 2.25 2.39 0.00 136 K 7.89 4.11 0.00 1.91 1.94 0.00 1.82 0.00 0.00 0.61 0.00 0.00 3.04 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.34 1.36 7.81 137 L 7.77 4.34 0.00 1.82 1.56 0.92 0.72 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 0.00 138 G 8.56 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 0.00 139 F 8.77 4.72 0.00 3.43 3.34 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 0.00 140 T 6.42 4.13 4.05 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 0.62 0.00 0.00 141 G 7.94 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 0.00 142 R 8.37 4.52 0.00 1.89 2.05 0.00 3.31 0.00 0.00 3.27 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.88 0.00 143 G 8.17 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 0.00 0.00 0.00 0.00 144 E 9.14 4.30 0.00 2.43 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 2.45 2.41 0.00 145 G 7.45 3.69 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 0.00 0.00 0.00 146 I 7.74 4.62 1.68 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.46 0.89 0.00 0.00 147 A 8.45 5.12 1.17 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 0.00 148 C 8.17 4.90 0.00 2.86 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 0.00 149 E 9.12 5.35 0.00 1.96 1.90 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 2.68 2.42 0.00 150 A 8.24 5.03 1.20 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 0.00 0.00 151 V 8.89 5.06 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 1.00 0.00 0.00 152 A 8.70 5.12 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 0.00 153 L 9.01 5.08 0.00 1.69 1.51 0.94 0.94 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 0.00 154 L 9.35 5.24 0.00 1.63 1.72 0.58 0.89 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 0.00 155 I 8.96 4.26 1.98 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.99 0.96 0.00 0.00