NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.8004 8.3549 109.7184 43.6213 0.0000 174.3221 3 N 4.1471 9.4915 119.5727 51.8809 36.4485 175.1905 4 F 4.2640 8.3567 118.0178 60.3744 38.3165 176.2822 5 S 3.4484 7.0250 113.2383 60.5507 62.6901 175.9753 6 Q 4.0802 7.7157 120.5602 57.6409 28.9027 176.9589 7 A 4.5922 8.0355 120.5360 51.6012 19.5393 175.5457 8 C 5.4711 7.3677 113.0822 55.4843 45.6533 172.0652 9 Y 4.7771 8.3766 118.3100 56.7756 40.4979 174.1478 10 N 4.4462 9.0038 113.7748 54.3767 36.1044 175.1397 11 S 4.7876 8.1266 112.3698 59.1210 63.8347 173.5795 12 A 4.7745 8.9643 122.6560 50.9095 22.9844 175.1000 13 I 5.0346 8.3834 120.3933 59.4324 40.0830 175.4217 14 Q 4.4370 8.6825 124.1751 55.1291 31.7954 175.2823 15 G 3.8356 8.4067 113.1001 47.0206 0.0000 173.9480 16 S 4.7332 8.6503 119.7681 57.5909 63.4643 172.6373 17 V 4.6395 7.9785 123.0846 61.7711 33.0534 174.2464 18 L 5.0696 8.6808 130.8885 54.2696 43.4997 175.1820 19 T 5.1149 8.5951 116.6850 60.3967 71.7627 173.0903 20 S 4.8062 8.7377 116.3493 57.9914 66.8851 173.1845 21 T 4.8722 8.3148 120.8702 62.0470 70.2083 173.0860 22 C 5.4928 9.0906 124.1383 54.5797 44.0903 173.5759 23 I 4.4269 8.5072 123.0560 61.5586 38.4061 175.3269 24 R 4.8696 8.9436 127.9909 54.4360 32.3338 177.6891 25 T 3.9533 8.5260 112.4461 64.5068 68.8515 175.1590 26 N 4.4882 8.0389 117.4428 53.2709 37.6466 175.2929 27 G 4.1143 8.2064 107.8134 45.7014 0.0000 174.6073 28 G 4.0518 8.6326 111.0921 45.1435 0.0000 171.7559 29 Y 5.4342 7.5438 117.1792 55.8091 41.6551 174.0961 30 N 5.1679 9.3792 118.4304 52.1373 42.8581 172.9439 31 T 5.0004 8.6361 116.1977 60.8793 70.5520 173.8520 32 S 4.8871 9.0101 119.7885 57.1801 67.2917 172.4105 33 S 5.2251 8.3654 112.8014 57.1887 66.1863 173.2461 34 I 4.5589 8.5547 120.3243 59.5938 41.8800 173.7651 35 D 4.8927 8.7554 128.6142 53.1895 40.6829 176.7378 36 L 4.2448 9.0023 128.7512 57.0259 42.0082 179.2731 37 N 4.5852 8.6449 117.8047 55.9124 38.9913 176.8130 38 S 4.1757 7.7806 111.9191 60.6565 63.2130 174.9744 39 V 4.4591 7.8015 110.6455 60.4407 33.6214 175.5846 40 I 4.6398 7.8407 121.7805 59.2500 40.3894 173.8672 41 E 4.9902 9.1620 127.1268 53.5003 32.7300 174.4140 42 N 4.8197 8.8484 124.8055 52.8329 39.7424 174.8618 43 V 4.0332 8.8959 128.7860 61.6490 31.3535 174.8372 44 D 4.2126 9.7657 128.6813 55.0392 39.5005 174.5206 45 G 3.9686 8.6875 106.7776 44.6443 0.0000 174.3396 46 S 4.6863 7.6778 116.4667 56.4233 64.5416 173.3121 47 L 4.5104 8.2460 125.8404 54.7456 41.9321 176.7379 48 K 4.5355 8.8489 122.3565 54.2521 36.9757 176.2450 49 W 4.8408 8.4978 122.3670 56.7315 30.7005 175.9213 50 Q 3.8330 10.1255 116.2264 56.7163 25.1789 174.0173 51 G 4.0460 7.5751 105.3620 46.7015 0.0000 172.3938 52 S 4.7141 8.1706 114.2832 58.7120 67.3377 174.1622 53 N 4.5985 9.3916 115.8964 53.8328 36.2209 176.7603 54 F 4.2229 8.0373 116.8909 59.9338 37.7815 177.4217 55 I 3.2620 6.9606 120.2198 63.0736 37.8038 176.7859 56 E 4.1098 7.7922 119.3558 58.8625 29.4785 177.6065 57 T 4.6964 8.1437 107.4496 61.1028 69.6212 172.3923 58 C 5.7222 8.1743 117.7172 55.8666 45.4229 172.8490 59 R 4.6921 8.9184 116.7359 55.2825 32.5366 174.1574 60 N 4.3888 8.7516 112.7983 54.5278 35.8470 175.1902 61 T 4.4577 7.7198 106.8461 62.3340 70.0845 174.7072 62 Q 4.6616 9.0578 121.7630 54.5589 34.0325 173.1147 63 L 4.9864 8.5414 123.4657 53.9736 43.6646 175.2794 64 A 4.5580 9.2916 128.6942 50.8444 21.0815 176.5304 65 G 3.7605 8.7331 111.3240 47.0489 0.0000 174.5039 66 S 4.5131 8.6878 115.7103 60.0419 63.6541 175.0334 67 S 4.8774 7.8380 111.0470 58.1271 66.1244 172.6259 68 E 4.9241 8.3607 123.3175 55.0357 31.1746 174.3996 69 L 4.8431 8.8503 129.8090 54.3859 43.5622 175.0799 70 A 5.2656 8.9814 127.9291 50.4948 22.3549 174.7114 71 A 5.0547 8.7685 121.2062 51.4505 24.0113 174.6949 72 E 5.1457 9.1769 118.2436 55.0900 32.2360 175.3250 73 C 5.5604 9.3304 121.8081 54.8795 44.4784 173.4889 74 K 4.2812 8.3709 122.2046 55.8662 32.4951 177.5511 75 T 4.1295 8.7476 115.5458 60.7455 69.8273 175.7226 76 R 3.7477 8.9383 120.9469 59.3192 29.9626 178.0769 77 A 4.2191 7.8344 117.4568 52.2645 18.4236 176.9162 78 Q 3.6194 8.1556 114.5121 57.3058 26.5877 173.2617 79 Q 4.8312 7.6917 115.0927 54.1316 32.4907 174.7675 80 F 5.0238 8.8063 119.9205 56.7114 40.4694 175.6698 81 V 4.6774 8.6895 114.9928 59.6796 36.1208 174.8030 82 S 5.0439 8.6196 118.3280 58.4815 64.0427 173.5474 83 T 4.8521 8.8891 117.3286 60.8981 71.1489 172.2688 84 K 5.1455 8.3006 123.1686 55.8358 36.0585 174.9581 85 I 4.4655 8.4948 120.3014 59.6572 42.1835 173.6344 86 N 4.9582 8.8868 127.3809 52.3643 38.5412 175.5569 87 L 4.6484 9.1359 128.1112 57.8727 42.0868 179.5139 88 D 4.6422 8.7948 118.3319 56.5958 40.9985 178.2115 89 D 4.3031 8.3645 119.1901 57.3246 41.0286 176.8666 90 H 4.4409 7.6120 111.4301 54.6599 32.3560 173.0688 91 I 4.7711 8.3301 121.0111 60.0925 38.4424 174.9807 92 A 5.3573 9.2794 128.4221 50.0231 22.8451 174.2650 93 A 5.1195 8.6029 120.3093 50.2690 21.4149 176.2502 94 I 4.2520 8.7527 123.9969 60.2051 39.2001 175.5173 95 D 4.1048 9.9999 127.2234 55.1862 39.4524 174.1834 96 G 4.0328 8.6782 104.0995 45.2816 0.0000 173.4529 97 T 4.6137 7.6436 116.7547 61.1399 71.1197 173.3243 98 L 4.7162 8.3511 126.8800 54.8953 42.3890 176.8114 99 K 4.7438 9.0937 121.9551 54.8879 37.0267 174.7609 100 Y 4.8026 8.6995 124.7200 57.3280 39.7846 174.2490 101 E 4.4220 8.3537 125.9725 54.2594 32.4080 175.9154 102 L 3.9225 8.2204 125.0201 55.0021 42.2204 175.7985 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 2 G 8.35 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 3 N 9.49 4.15 0.00 2.91 2.86 0.00 0.00 7.11 7.26 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 4 F 8.36 4.26 0.00 3.37 3.42 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 5 S 7.03 3.45 0.00 3.65 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 6 Q 7.72 4.08 0.00 2.16 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.29 0.00 7 A 8.04 4.59 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 8 C 7.37 5.47 0.00 3.08 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 Y 8.38 4.78 0.00 3.13 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 10 N 9.00 4.45 0.00 2.85 2.97 0.00 0.00 6.93 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 S 8.13 4.79 0.00 3.89 3.99 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 12 A 8.96 4.77 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 I 8.38 5.03 1.99 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.76 0.99 0.00 0.00 14 Q 8.68 4.44 0.00 2.15 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.85 0.00 0.00 0.00 0.00 0.00 2.34 2.42 0.00 15 G 8.41 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 0.00 0.00 0.00 16 S 8.65 4.73 0.00 4.10 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 V 7.98 4.64 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 0.90 0.00 0.00 0.93 0.00 0.00 18 L 8.68 5.07 0.00 1.78 1.44 0.98 -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 19 T 8.60 5.11 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 20 S 8.74 4.81 0.00 3.98 3.73 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 21 T 8.31 4.87 3.37 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 0.97 0.00 0.00 22 C 9.09 5.49 0.00 2.97 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 23 I 8.51 4.43 2.01 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 1.31 0.87 1.04 0.00 0.00 24 R 8.94 4.87 0.00 1.88 1.87 0.00 3.17 0.00 0.00 3.19 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.58 0.00 25 T 8.53 3.95 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 1.23 0.00 0.00 26 N 8.04 4.49 0.00 2.83 2.98 0.00 0.00 6.28 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 27 G 8.21 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 28 G 8.63 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 29 Y 7.54 5.43 0.00 2.95 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 30 N 9.38 5.17 0.00 2.80 2.82 0.00 0.00 7.27 8.05 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 31 T 8.64 5.00 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 1.27 0.00 0.00 32 S 9.01 4.89 0.00 3.85 3.98 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 0.00 0.00 0.00 0.00 33 S 8.37 5.23 0.00 3.82 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 34 I 8.55 4.56 1.85 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.34 0.86 0.00 0.00 35 D 8.76 4.89 0.00 2.79 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 36 L 9.00 4.24 0.00 2.04 1.81 0.95 0.39 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 37 N 8.64 4.59 0.00 2.69 2.81 0.00 0.00 6.78 6.91 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 38 S 7.78 4.18 0.00 3.92 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 39 V 7.80 4.46 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 -0.32 0.00 0.00 1.13 0.00 0.00 40 I 7.84 4.64 1.67 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.29 1.00 0.19 0.00 0.00 41 E 9.16 4.99 0.00 1.94 1.75 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 2.20 2.25 0.00 42 N 8.85 4.82 0.00 2.85 2.78 0.00 0.00 6.85 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 43 V 8.90 4.03 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.92 0.00 0.00 44 D 9.77 4.21 0.00 2.77 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 45 G 8.69 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 46 S 7.68 4.69 0.00 3.99 3.72 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 47 L 8.25 4.51 0.00 1.28 1.17 0.64 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 48 K 8.85 4.54 0.00 1.55 1.63 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.80 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.52 7.81 49 W 8.50 4.84 0.00 3.22 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 50 Q 10.13 3.83 0.00 2.31 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.66 0.00 0.00 0.00 0.00 0.00 2.42 2.38 0.00 51 G 7.58 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 52 S 8.17 4.71 0.00 3.84 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 53 N 9.39 4.60 0.00 2.96 3.08 0.00 0.00 7.19 8.46 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 54 F 8.04 4.22 0.00 3.16 3.43 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 0.00 55 I 6.96 3.26 1.13 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 1.04 0.47 0.71 0.00 0.00 56 E 7.79 4.11 0.00 2.09 1.96 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 2.29 2.16 0.00 57 T 8.14 4.70 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 58 C 8.17 5.72 0.00 3.12 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 59 R 8.92 4.69 0.00 1.84 2.01 0.00 2.60 0.00 0.00 2.46 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.52 0.00 60 N 8.75 4.39 0.00 2.88 2.91 0.00 0.00 6.94 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 T 7.72 4.46 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 1.44 0.00 0.00 62 Q 9.06 4.66 0.00 2.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.89 0.00 0.00 0.00 0.00 0.00 2.29 2.49 0.00 63 L 8.54 4.99 0.00 1.68 1.61 1.10 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 64 A 9.29 4.56 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 65 G 8.73 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 S 8.69 4.51 0.00 3.82 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 S 7.84 4.88 0.00 3.95 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 68 E 8.36 4.92 0.00 2.19 2.05 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 2.25 2.41 0.00 69 L 8.85 4.84 0.00 1.76 1.38 0.99 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 70 A 8.98 5.27 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 71 A 8.77 5.05 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 72 E 9.18 5.15 0.00 1.98 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 0.00 2.26 2.28 0.00 73 C 9.33 5.56 0.00 3.03 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 74 K 8.37 4.28 0.00 1.33 1.39 0.00 1.43 0.00 0.00 1.59 0.00 0.00 2.80 0.00 0.00 2.83 0.00 0.00 0.00 0.00 0.30 0.56 7.81 75 T 8.75 4.13 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 1.27 0.00 0.00 76 R 8.94 3.75 0.00 1.77 2.02 0.00 3.14 0.00 0.00 3.21 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 77 A 7.83 4.22 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 78 Q 8.16 3.62 0.00 2.20 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.72 6.62 0.00 0.00 0.00 0.00 0.00 2.35 2.43 0.00 79 Q 7.69 4.83 0.00 1.99 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.75 6.87 0.00 0.00 0.00 0.00 0.00 2.28 2.29 0.00 80 F 8.81 5.02 0.00 2.93 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 81 V 8.69 4.68 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 0.78 0.00 0.00 1.00 0.00 0.00 82 S 8.62 5.04 0.00 3.77 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 83 T 8.89 4.85 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 1.25 0.00 0.00 84 K 8.30 5.15 0.00 1.71 1.68 0.00 1.83 0.00 0.00 1.63 0.00 0.00 2.67 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.28 1.41 7.81 85 I 8.49 4.47 1.55 0.00 0.00 -0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 1.25 0.48 0.00 0.00 86 N 8.89 4.96 0.00 2.84 3.01 0.00 0.00 7.17 6.66 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 87 L 9.14 4.65 0.00 2.25 1.99 1.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 88 D 8.79 4.64 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 89 D 8.36 4.30 0.00 2.71 2.41 0.00 0.00 0.00 0.00 0.00 0.00 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 H 7.61 4.44 0.00 1.46 2.25 0.00 5.60 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 I 8.33 4.77 2.01 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.16 0.64 0.00 0.00 92 A 9.28 5.36 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 93 A 8.60 5.12 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.75 4.25 1.88 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 1.20 0.95 0.92 0.00 0.00 95 D 10.00 4.10 0.00 2.72 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 96 G 8.68 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 0.00 0.00 0.00 97 T 7.64 4.61 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 98 L 8.35 4.72 0.00 1.51 1.53 0.81 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 99 K 9.09 4.74 0.00 1.62 1.66 0.00 1.70 0.00 0.00 1.60 0.00 0.00 2.78 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.53 1.54 7.81 100 Y 8.70 4.80 0.00 2.95 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 0.00 101 E 8.35 4.42 0.00 1.54 1.61 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 2.13 2.11 0.00 102 L 8.22 3.92 0.00 1.53 1.48 0.90 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00