NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 Q 4.1400 8.3293 121.7016 55.4737 30.9554 176.0312 2 P 4.2210 0.0000 0.0000 61.5697 31.6795 174.9365 3 Q 3.9903 8.5794 125.6778 58.6572 29.2628 178.8071 4 K 3.6916 8.0242 119.0144 59.7523 32.3146 178.0513 5 C 4.8398 7.9597 117.3416 57.6443 45.2819 175.2730 6 Q 3.7828 8.5710 118.2495 57.5913 28.3309 177.3359 7 R 4.4942 8.5467 118.6274 56.3810 31.0962 176.2954 8 E 4.5914 8.0206 115.3627 57.1731 31.6925 177.1124 9 F 5.0531 9.0473 122.8019 59.7718 39.4598 176.4963 10 Q 4.1596 8.1862 116.1513 56.2016 29.4408 175.8343 11 Q 4.1865 8.0564 120.5623 58.1570 28.9059 177.8423 12 E 5.2553 7.7021 112.4454 55.8514 30.9312 176.9572 13 Q 4.5541 7.9147 115.0824 55.8618 30.6565 175.7998 14 H 4.0915 7.4382 117.4261 54.7751 28.8849 174.6092 15 L 4.8316 7.9630 123.8754 54.4335 44.7513 174.7551 16 R 4.8325 8.2607 116.5754 57.2548 37.7400 177.4221 17 A 4.1377 8.2375 121.8079 55.1350 19.0259 180.1855 18 C 4.7579 8.4375 115.0251 59.2506 44.0599 174.6481 19 Q 4.4823 7.6956 115.0037 56.4514 28.9194 176.4722 20 Q 4.3681 7.9798 117.5039 57.3529 32.1712 177.6631 21 W 5.1117 8.0025 117.0448 59.3538 27.9328 178.4957 22 I 2.7327 6.4654 119.9214 63.5680 36.2330 178.2082 23 R 4.0290 7.7079 118.5567 58.5103 29.8899 178.3145 24 Q 4.3986 7.9852 117.3150 57.5564 28.7570 177.4706 25 Q 4.3772 7.9949 118.3634 58.3192 29.1661 175.1674 26 L 4.9221 7.5228 118.5102 53.1591 44.7381 176.3271 27 A 4.7853 8.5946 124.4172 53.2614 18.5052 178.6622 28 G 4.0570 8.0674 105.1401 46.7165 0.0000 173.9663 29 S 4.3921 7.3797 111.8060 55.5313 65.5013 172.2475 30 P 4.1255 0.0000 0.0000 62.5999 32.4166 175.0312 31 F 4.8968 7.7780 114.1908 57.0193 42.0236 172.7899 32 S 4.5347 8.0267 116.0669 59.3422 65.8874 177.7019 33 E 4.4600 8.1668 126.3373 55.8306 32.1429 175.7489 34 N 4.7712 8.3012 116.2043 53.1099 39.8039 174.2437 35 Q 4.5845 8.2316 120.3497 55.3055 31.6557 173.2220 36 W 4.3631 9.1262 131.7848 60.6370 30.1953 175.1741 37 G 4.0970 7.3276 111.8850 45.9293 0.0000 172.6476 38 P 4.7589 0.0000 0.0000 61.1620 30.0631 177.0964 39 Q 3.9700 8.3259 126.6356 59.8102 29.5258 176.8148 40 Q 4.2829 8.1288 116.0729 56.8686 29.9922 175.8585 41 G 4.3370 8.0098 105.9245 44.7309 0.0000 171.2985 42 P 4.4024 0.0000 0.0000 65.7945 32.7085 178.7509 43 S 4.5295 7.7572 115.5988 57.8540 60.8916 172.7979 44 L 4.5901 7.5196 121.3379 55.7505 44.7185 179.1803 45 R 3.7713 7.3793 117.1572 59.0750 28.4247 178.6162 46 E 3.3432 7.9153 118.0293 59.0678 29.4371 179.5933 47 Q 3.9416 7.7070 117.9430 58.8778 29.2119 178.5659 48 C 4.9585 8.8300 121.8316 59.5947 43.5537 174.7007 49 C 4.1015 8.6890 117.9878 59.7021 38.2154 175.1043 50 N 4.7871 7.4709 115.5725 54.7937 39.3565 176.7554 51 E 4.1450 9.2665 120.6890 57.6254 29.4041 178.1044 52 L 4.5695 8.3705 120.0360 56.7407 41.8202 176.9418 53 Y 4.5949 7.7970 119.5211 58.7396 39.1311 176.9263 54 Q 3.9931 8.9025 119.0539 59.1179 28.8192 177.7270 55 E 4.2458 8.1499 116.9059 56.2247 29.1924 176.9304 56 D 4.3680 7.9882 121.2540 53.4473 41.2959 173.6954 57 Q 4.2346 8.1519 117.0727 58.0155 29.4219 177.6500 58 V 4.0012 7.7546 115.0295 64.0110 31.5298 176.4874 59 C 5.1265 7.7557 113.9491 57.5144 42.4285 176.0633 60 V 3.6303 7.1470 117.7351 65.2175 31.0781 174.9546 61 C 5.1391 6.9420 114.8893 56.0460 41.0722 171.9908 62 P 4.2317 0.0000 0.0000 64.1649 31.5759 178.3808 63 T 3.3726 7.7869 117.2889 66.9088 68.6253 175.2115 64 L 3.8457 7.9423 121.9323 58.3400 41.6996 178.6306 65 K 3.5738 8.1993 119.5480 60.3641 31.8468 177.2289 66 Q 3.9924 8.7207 120.1498 58.6709 28.6599 177.6934 67 A 4.0549 8.3687 124.3486 55.0732 18.7763 178.7079 68 A 4.1596 8.2841 119.2472 54.0590 18.7557 179.5613 69 K 3.9953 8.1525 118.6838 58.9668 32.8084 177.4684 70 S 4.9440 8.6323 111.6088 57.0284 62.2025 175.7213 71 V 3.7638 7.2575 119.4823 64.0628 30.4927 175.6477 72 R 4.6100 7.0084 119.9421 56.2975 37.7400 175.0884 73 V 3.7510 7.4833 116.1731 62.5535 32.0354 175.5853 74 Q 4.6118 7.6422 117.1559 55.1033 30.5000 175.2104 75 G 4.3594 8.1681 115.6483 44.4746 0.0000 174.0565 76 Q 4.8995 7.1057 125.2270 55.9059 30.6632 171.8948 77 H 4.6200 8.6331 123.1234 54.3626 31.0673 174.2575 78 G 3.7940 8.1319 108.0039 44.5869 0.0000 171.7283 79 P 4.4649 0.0000 0.0000 62.9719 29.5685 174.8709 80 F 4.8346 8.2620 125.0788 58.9543 46.2931 176.3939 81 Q 3.9010 8.5517 118.9726 59.0555 28.8162 178.1914 82 S 4.2309 8.1900 113.6544 62.8049 62.3279 175.5858 83 T 3.6685 8.1921 115.4823 68.2517 68.0324 176.1578 84 R 3.9673 8.0396 119.4014 59.6323 30.3446 179.1204 85 I 3.6476 8.1930 119.0775 64.8120 37.3813 177.2294 86 Y 4.3200 8.8410 117.2936 60.4000 38.0486 177.3843 87 Q 4.3199 8.3750 118.5769 57.8958 29.2397 176.8988 88 I 4.6383 8.0858 117.7418 61.3161 38.9502 176.0866 89 A 4.8389 8.0911 120.5937 51.9818 19.4291 177.7180 90 K 4.1873 8.1485 117.3516 57.6887 33.2591 177.3061 91 N 4.6993 7.9840 116.8179 53.0066 37.7617 176.7688 92 L 3.9714 7.7874 122.6246 57.7222 41.6930 176.9287 93 P 4.5551 0.0000 0.0000 63.8918 31.6852 177.4959 94 N 4.3712 7.9308 116.6712 55.2529 38.9950 175.9481 95 V 4.1745 7.2393 113.4287 62.8744 32.2870 174.7634 96 C 4.8759 7.4839 116.5640 60.1702 40.8889 174.4440 97 N 4.2135 7.5423 118.6507 55.0451 35.7914 174.0987 98 M 4.3742 8.2320 117.1858 54.0658 32.5929 176.3254 99 K 4.4738 7.6488 120.0057 54.9622 33.0438 175.3847 100 Q 4.0680 8.6664 125.5577 58.5687 29.7869 176.9605 101 I 3.6723 7.8451 116.4560 60.4594 37.6717 175.4121 102 G 4.2745 7.9863 119.5731 46.4113 0.0000 172.2522 103 T 4.1602 7.7817 121.8695 66.2352 69.8434 174.7716 104 C 5.1181 7.7463 112.5855 53.2987 41.6340 173.1455 105 P 4.5638 0.0000 0.0000 62.8742 30.4369 177.0016 106 F 4.8322 7.9968 112.7389 56.4119 40.0394 175.5915 107 I 4.0460 7.8474 124.5802 62.2292 37.6351 175.0637 108 A 4.4141 7.8635 124.1863 51.5691 16.1671 177.0440 109 I 4.2200 7.3056 117.7650 60.3539 37.8465 176.3504 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 Q 8.33 4.14 0.00 1.99 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 7.06 0.00 0.00 0.00 0.00 0.00 2.23 2.40 0.00 2 P 0.00 4.22 0.00 2.37 2.20 0.00 3.70 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.06 0.00 3 Q 8.58 3.99 0.00 2.18 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.79 0.00 0.00 0.00 0.00 0.00 2.43 2.49 0.00 4 K 8.02 3.69 0.00 1.94 1.98 0.00 1.57 0.00 0.00 1.62 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.54 7.81 5 C 7.96 4.84 0.00 2.97 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 6 Q 8.57 3.78 0.00 2.08 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.44 0.00 0.00 0.00 0.00 0.00 2.22 2.34 0.00 7 R 8.55 4.49 0.00 1.82 1.90 0.00 3.22 0.00 0.00 3.23 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.65 0.00 8 E 8.02 4.59 0.00 2.15 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 2.23 2.28 0.00 9 F 9.05 5.05 0.00 3.14 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 10 Q 8.19 4.16 0.00 2.29 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.75 0.00 0.00 0.00 0.00 0.00 2.29 2.27 0.00 11 Q 8.06 4.19 0.00 2.14 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 7.48 0.00 0.00 0.00 0.00 0.00 2.38 2.50 0.00 12 E 7.70 5.26 0.00 2.03 1.93 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 2.02 2.14 0.00 13 Q 7.91 4.55 0.00 1.96 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.63 6.95 0.00 0.00 0.00 0.00 0.00 2.20 2.33 0.00 14 H 7.44 4.09 0.00 2.91 2.73 0.00 5.71 0.00 0.00 0.00 0.00 7.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 L 7.96 4.83 0.00 1.66 1.61 1.20 0.79 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 16 R 8.26 4.83 0.00 1.83 1.79 0.00 3.31 0.00 0.00 3.15 7.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.69 0.00 17 A 8.24 4.14 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 18 C 8.44 4.76 0.00 3.21 3.25 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 19 Q 7.70 4.48 0.00 2.20 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.64 0.00 0.00 0.00 0.00 0.00 2.42 2.58 0.00 20 Q 7.98 4.37 0.00 2.14 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.03 6.92 0.00 0.00 0.00 0.00 0.00 2.37 2.22 0.00 21 W 8.00 5.11 0.00 3.58 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 22 I 6.47 2.73 1.30 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 0.54 0.00 0.00 23 R 7.71 4.03 0.00 2.09 1.96 0.00 3.16 0.00 0.00 3.09 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 24 Q 7.99 4.40 0.00 2.53 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.90 0.00 0.00 0.00 0.00 0.00 2.46 2.44 0.00 25 Q 7.99 4.38 0.00 2.28 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.56 0.00 0.00 0.00 0.00 0.00 2.69 2.75 0.00 26 L 7.52 4.92 0.00 1.69 1.67 1.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 27 A 8.59 4.79 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 28 G 8.07 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 0.00 0.00 0.00 29 S 7.38 4.39 0.00 3.77 3.58 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 30 P 0.00 4.13 0.00 2.05 1.93 0.00 3.61 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.86 0.00 31 F 7.78 4.90 0.00 3.06 2.97 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 32 S 8.03 4.53 0.00 3.84 3.70 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 33 E 8.17 4.46 0.00 2.15 1.97 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 2.32 2.35 0.00 34 N 8.30 4.77 0.00 2.73 2.76 0.00 0.00 6.60 7.70 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 35 Q 8.23 4.58 0.00 2.04 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 7.02 0.00 0.00 0.00 0.00 0.00 2.18 2.36 0.00 36 W 9.13 4.36 0.00 3.49 3.12 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 37 G 7.33 4.10 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 0.00 38 P 0.00 4.76 0.00 2.45 2.50 0.00 4.00 0.00 0.00 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.32 0.00 39 Q 8.33 3.97 0.00 2.15 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 7.07 0.00 0.00 0.00 0.00 0.00 2.67 2.45 0.00 40 Q 8.13 4.28 0.00 2.07 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.15 0.00 0.00 0.00 0.00 0.00 2.33 2.30 0.00 41 G 8.01 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 0.00 0.00 0.00 0.00 42 P 0.00 4.40 0.00 2.19 2.23 0.00 3.79 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.11 0.00 43 S 7.76 4.53 0.00 3.88 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 44 L 7.52 4.59 0.00 1.68 1.72 1.21 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 45 R 7.38 3.77 0.00 1.51 1.55 0.00 2.42 0.00 0.00 2.25 7.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.97 0.00 46 E 7.92 3.34 0.00 1.93 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 2.31 2.28 0.00 47 Q 7.71 3.94 0.00 2.26 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.93 0.00 0.00 0.00 0.00 0.00 2.43 2.40 0.00 48 C 8.83 4.96 0.00 3.27 3.38 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 49 C 8.69 4.10 0.00 2.83 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 50 N 7.47 4.79 0.00 2.97 2.88 0.00 0.00 6.59 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 51 E 9.27 4.14 0.00 2.16 2.36 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 2.36 2.22 0.00 52 L 8.37 4.57 0.00 1.90 2.12 1.09 0.91 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 53 Y 7.80 4.59 0.00 3.18 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 54 Q 8.90 3.99 0.00 2.22 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.79 0.00 0.00 0.00 0.00 0.00 2.56 2.37 0.00 55 E 8.15 4.25 0.00 2.17 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 0.00 2.40 2.36 0.00 56 D 7.99 4.37 0.00 2.83 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 57 Q 8.15 4.23 0.00 2.11 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.90 6.84 0.00 0.00 0.00 0.00 0.00 2.79 2.42 0.00 58 V 7.75 4.00 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 0.93 0.00 0.00 0.97 0.00 0.00 59 C 7.76 5.13 0.00 3.14 3.25 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 60 V 7.15 3.63 2.36 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 0.97 0.00 0.00 1.42 0.00 0.00 61 C 6.94 5.14 0.00 3.08 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 62 P 0.00 4.23 0.00 2.14 2.25 0.00 3.67 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.96 0.00 63 T 7.79 3.37 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 0.57 0.00 0.00 64 L 7.94 3.85 0.00 1.88 1.62 1.05 0.57 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 65 K 8.20 3.57 0.00 1.58 1.83 0.00 1.66 0.00 0.00 1.60 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.48 1.66 7.81 66 Q 8.72 3.99 0.00 2.06 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.51 0.00 0.00 0.00 0.00 0.00 2.64 2.65 0.00 67 A 8.37 4.05 1.58 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 68 A 8.28 4.16 1.09 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 69 K 8.15 4.00 0.00 1.88 1.98 0.00 1.74 0.00 0.00 1.73 0.00 0.00 3.07 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.49 1.45 7.81 70 S 8.63 4.94 0.00 3.91 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 71 V 7.26 3.76 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 0.76 0.00 0.00 0.87 0.00 0.00 72 R 7.01 4.61 0.00 1.84 1.93 0.00 3.39 0.00 0.00 3.19 7.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.69 0.00 73 V 7.48 3.75 2.25 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 0.93 0.00 0.00 0.99 0.00 0.00 74 Q 7.64 4.61 0.00 1.98 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 7.15 0.00 0.00 0.00 0.00 0.00 2.13 2.22 0.00 75 G 8.17 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 76 Q 7.11 4.90 0.00 2.02 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.98 0.00 0.00 0.00 0.00 0.00 2.09 2.12 0.00 77 H 8.63 4.62 0.00 3.08 3.29 0.00 6.13 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 78 G 8.13 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 79 P 0.00 4.46 0.00 2.21 2.13 0.00 3.81 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 2.02 1.96 0.00 80 F 8.26 4.83 0.00 3.08 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 81 Q 8.55 3.90 0.00 2.19 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.87 6.08 0.00 0.00 0.00 0.00 0.00 2.47 2.57 0.00 82 S 8.19 4.23 0.00 3.85 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 83 T 8.19 3.67 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 1.13 0.00 0.00 84 R 8.04 3.97 0.00 1.97 1.98 0.00 3.38 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.79 0.00 85 I 8.19 3.65 2.26 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 1.61 0.76 1.01 0.00 0.00 86 Y 8.84 4.32 0.00 3.39 3.32 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 87 Q 8.37 4.32 0.00 2.34 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.72 0.00 0.00 0.00 0.00 0.00 2.43 2.48 0.00 88 I 8.09 4.64 1.98 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 1.61 0.95 1.15 0.00 0.00 89 A 8.09 4.84 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 90 K 8.15 4.19 0.00 0.79 1.77 0.00 1.61 0.00 0.00 1.75 0.00 0.00 3.10 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.09 1.11 7.81 91 N 7.98 4.70 0.00 3.06 3.15 0.00 0.00 6.47 7.02 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 92 L 7.79 3.97 0.00 2.09 1.86 1.45 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 93 P 0.00 4.56 0.00 2.23 2.33 0.00 3.75 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.10 0.00 94 N 7.93 4.37 0.00 2.81 2.87 0.00 0.00 6.78 7.61 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 95 V 7.24 4.17 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 0.70 0.00 0.00 0.88 0.00 0.00 96 C 7.48 4.88 0.00 2.99 2.93 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 97 N 7.54 4.21 0.00 2.63 2.67 0.00 0.00 7.01 7.63 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 98 M 8.23 4.37 0.00 2.05 2.17 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.47 0.00 99 K 7.65 4.47 0.00 1.73 1.74 0.00 1.83 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.40 1.46 7.81 100 Q 8.67 4.07 0.00 2.09 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.90 0.00 0.00 0.00 0.00 0.00 2.34 2.30 0.00 101 I 7.85 3.67 1.89 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 1.36 0.82 0.93 0.00 0.00 102 G 7.99 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 0.00 103 T 7.78 4.16 4.28 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 1.24 0.00 0.00 104 C 7.75 5.12 0.00 3.07 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 0.00 105 P 0.00 4.56 0.00 2.24 2.19 0.00 3.83 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 2.03 1.99 0.00 106 F 8.00 4.83 0.00 3.29 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 0.00 107 I 7.85 4.05 1.74 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 1.19 0.30 0.55 0.00 0.00 108 A 7.86 4.41 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 0.00 109 I 7.31 4.22 1.98 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 1.75 0.83 1.03 0.00 0.00