NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4766 8.3049 120.3260 55.5112 33.0731 175.8068 2 N 5.0809 8.4891 123.1521 50.1487 39.6025 175.6671 3 S 4.3772 8.2076 115.0696 60.9270 64.1949 175.6292 4 E 4.1829 8.1479 117.5288 57.3984 29.2280 178.0051 5 I 4.0319 7.4538 120.4261 63.2587 37.3639 177.5766 6 E 4.0100 7.7997 119.0933 58.7591 29.2821 178.8885 7 L 3.5609 7.7438 119.4573 57.0586 41.6393 177.3659 8 P 3.3624 0.0000 0.0000 66.0887 31.1621 178.8212 9 V 3.0456 6.7961 109.6798 62.9236 31.3997 178.6028 10 Q 3.7755 7.6584 119.5315 59.2148 29.0087 178.3713 11 K 4.0955 7.2717 119.5566 59.4374 31.9667 179.5337 12 Q 4.2499 8.0266 118.4824 58.7181 28.4275 178.2148 13 L 4.0846 7.7830 121.1020 58.2159 42.0886 178.7461 14 E 3.9052 8.1479 118.0904 59.6491 29.5080 179.4404 15 A 4.1358 8.2828 120.3684 55.0174 18.1506 179.0723 16 Y 3.8799 8.1559 118.1919 60.6106 38.9748 177.2940 17 N 4.1598 7.4442 115.5256 54.5410 38.0916 176.4743 18 A 4.1226 8.0196 121.1529 51.8910 19.2788 176.8328 19 R 3.7654 7.8889 114.4339 57.8312 27.0208 177.3324 20 D 4.9376 8.1229 119.0254 52.4997 41.4954 177.4943 21 I 3.8194 8.1036 126.1668 63.7804 37.2194 177.4535 22 D 4.2966 8.1817 118.5915 57.4227 40.7561 178.0161 23 A 4.2606 8.0757 120.6063 54.7510 18.5276 178.7039 24 F 4.3304 8.4108 117.5319 60.2768 39.8855 175.7736 25 M 4.1841 8.1054 116.4672 56.6095 33.2625 177.0428 26 A 3.8950 7.8318 121.5952 55.2780 18.6784 178.4918 27 W 4.4394 7.9864 113.3699 57.1686 29.1643 176.5475 28 W 4.8680 8.0227 118.5773 55.1113 30.3630 175.9598 29 A 4.3777 8.6236 123.1679 51.7241 18.8415 178.7039 30 D 4.3958 8.7559 119.8680 56.5156 41.5785 177.3996 31 D 5.0031 7.8734 116.4094 52.8298 39.7063 175.4824 32 C 5.0654 7.6111 119.9813 60.0835 32.0856 173.2780 33 Q 4.7371 8.8154 124.4813 55.6023 30.7252 174.3651 34 Y 5.2688 8.8335 122.8508 56.7218 41.4919 173.5194 35 Y 5.2324 8.9836 124.3698 56.3343 41.3567 174.8311 36 A 4.0522 8.4761 122.8997 49.3376 22.6081 175.7585 37 F 4.2571 7.3785 121.4093 58.5875 39.2820 173.5652 38 P 3.9828 0.0000 0.0000 65.0198 31.7297 177.5067 39 A 4.6198 7.3149 123.2786 49.7015 19.3889 173.4027 40 T 4.4059 8.8499 115.7269 60.7116 70.5509 173.8478 41 L 3.7439 8.3115 129.1058 54.9108 41.3723 176.4752 42 L 4.1778 8.6848 127.7965 56.7515 42.2431 178.1217 43 A 4.7177 7.8208 121.2819 50.7768 21.4927 176.2752 44 G 4.3431 8.9395 114.3931 44.1581 0.0000 173.1750 45 N 4.3248 7.5846 118.1616 51.1696 38.8783 175.1510 46 A 3.9379 8.0535 121.4007 55.1736 18.3514 180.0289 47 A 3.8746 7.7636 118.6539 55.4081 18.4346 179.7155 48 E 4.0175 8.1420 116.4928 59.0913 29.5495 179.3258 49 I 3.2165 7.0328 119.0197 64.0099 37.0155 178.5429 50 R 3.6807 7.5310 116.7875 59.3512 29.3622 178.9238 51 V 3.4312 7.1566 118.1864 65.3151 30.9890 177.6999 52 R 4.3673 7.6163 119.6283 59.3781 29.8364 178.1704 53 H 4.1757 7.8344 115.3569 58.4906 28.4996 177.7921 54 I 3.4229 7.5383 121.4879 64.2386 36.6774 177.7861 55 E 4.1095 8.0331 119.0178 59.5422 29.0879 179.4729 56 R 4.4560 7.5194 119.6729 58.7390 29.9964 177.9858 57 F 4.2316 8.3281 115.6648 58.9016 39.0181 177.2651 58 K 4.3045 7.6808 117.7034 57.8353 31.9982 177.0643 59 E 4.0832 7.6471 120.3148 55.4941 29.4031 176.1471 60 P 4.2832 0.0000 0.0000 65.0859 31.6791 176.9033 61 D 4.4722 7.9146 117.1988 53.6186 40.0656 175.4214 62 L 4.0954 7.1971 123.0970 55.1484 42.6072 175.8704 63 Y 4.3266 8.3817 127.5909 56.4523 42.1108 173.6772 64 G 4.1503 8.2333 115.3927 45.2130 0.0000 172.6647 65 E 4.3756 8.7396 130.0368 53.8768 30.3255 174.9681 66 L 4.2572 8.4029 129.5764 55.5780 42.5246 175.6408 67 L 4.6163 8.6851 125.0764 56.3518 43.3126 176.9663 68 T 4.9049 7.5329 113.9313 62.0260 73.2859 172.8606 69 R 5.6791 8.3991 120.3161 53.9582 32.3264 174.6031 70 V 4.6135 8.5224 115.4195 59.3883 36.0183 174.3097 71 I 4.7947 8.2537 122.3176 59.5433 40.8759 175.0579 72 V 4.1799 8.8867 130.6397 61.4845 32.7571 177.9731 73 G 3.9634 8.6238 120.5369 46.5634 0.0000 172.0818 74 N 4.7763 9.1808 121.1664 52.2588 38.0479 174.1248 75 V 4.9678 7.7607 118.8637 61.4387 34.8292 174.3851 76 V 4.8168 8.6085 126.3554 61.2367 35.0389 174.2921 77 I 4.4879 8.8338 129.0660 60.1982 38.4642 174.8265 78 D 4.8575 9.0646 129.3872 53.4197 42.0245 175.7753 79 H 5.3721 9.1909 126.3308 54.7303 30.9979 173.4711 80 E 5.1745 8.9541 123.2641 54.7681 33.9501 174.8288 81 T 4.8308 8.5084 116.3083 61.7558 71.1075 174.4489 82 V 4.3719 8.8104 128.9594 62.1945 32.0516 175.2917 83 T 4.2074 9.0045 126.8084 64.1121 69.2401 174.0362 84 R 5.0911 7.8617 126.1406 53.3822 34.0477 174.3294 85 N 5.0384 8.8340 117.5018 52.3955 40.1628 173.9683 86 F 5.2484 8.4630 122.7403 55.0067 40.9319 175.6225 87 P 4.5191 0.0000 0.0000 64.4959 31.3654 176.8351 88 E 4.4755 8.3823 116.1538 56.1217 31.6018 177.6600 89 G 4.3652 7.0622 108.9132 45.6743 0.0000 174.0841 90 K 3.5479 8.0373 127.1636 55.4436 32.0890 175.9763 91 G 3.1813 8.3062 105.2220 45.0944 0.0000 172.3425 92 E 4.7337 8.0973 118.8833 55.0641 31.2406 175.3376 93 V 4.9033 8.3888 118.2199 58.5219 34.7045 174.7608 94 D 5.0554 8.8087 126.0055 53.8840 41.7939 175.4632 95 V 4.7877 8.9322 124.0680 60.9120 35.1021 174.5410 96 A 4.6580 8.8526 128.2613 50.6109 20.8886 175.5062 97 C 4.7698 8.9789 121.0237 59.5626 29.4642 172.9304 98 I 4.8056 8.3325 125.4081 59.6873 39.7610 174.0996 99 Y 4.8998 8.9944 126.0014 56.0198 42.2309 174.1121 100 E 5.0336 8.9013 122.2081 54.5888 32.7712 174.4390 101 V 4.6421 8.7175 127.9479 61.1742 33.0125 174.5615 102 E 4.5929 8.8220 128.7958 55.4831 32.0689 175.2691 103 N 4.2808 9.8789 121.7376 54.3691 36.0250 175.4994 104 G 4.0643 8.7033 106.4643 45.2638 0.0000 174.2965 105 R 4.8130 7.4244 118.3492 53.8275 33.3164 174.9299 106 I 4.0190 8.2110 121.6306 61.7472 37.3326 176.8142 107 A 4.1434 9.0653 131.1295 54.5342 19.5251 177.3081 108 K 4.9973 7.6590 112.2672 55.1194 37.1037 175.4721 109 A 4.3643 8.5215 123.9230 50.1410 23.0406 175.2565 110 W 5.6222 9.0251 120.7873 54.9292 33.4722 174.3946 111 F 5.6068 8.5817 115.4159 55.1466 41.3810 173.4470 112 K 4.7003 8.9339 119.9118 55.1755 35.3362 174.9473 113 I 4.1022 8.1053 126.0848 60.3385 37.5429 175.6957 114 G 3.7358 9.0859 117.0962 47.9724 0.0000 173.0782 115 E 4.9994 7.6671 116.5910 53.6894 33.2522 171.5176 116 P 4.8935 0.0000 0.0000 62.7512 32.7322 175.5883 117 R 4.9173 8.9354 120.6819 54.6661 35.1830 174.1731 118 I 4.8015 8.0220 119.9222 59.5878 41.2565 176.7740 119 V 3.5728 8.6432 125.6904 66.0862 31.6404 178.1449 120 S 4.1776 8.1098 112.8073 60.4840 62.3763 174.2451 121 Q 4.5865 7.7663 116.5427 55.1832 29.0427 174.9864 122 K 4.6643 7.5185 118.2547 54.3831 35.3825 176.1678 123 S 4.3330 8.6143 118.7339 58.9391 62.8330 174.2577 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 4.48 0.00 2.02 2.09 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.57 0.00 2 N 8.49 5.08 0.00 2.79 2.86 0.00 0.00 7.36 6.68 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 3 S 8.21 4.38 0.00 3.97 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 4 E 8.15 4.18 0.00 2.18 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 0.00 2.36 2.29 0.00 5 I 7.45 4.03 1.94 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 1.50 1.33 0.93 0.00 0.00 6 E 7.80 4.01 0.00 2.06 1.88 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 2.33 2.55 0.00 7 L 7.74 3.56 0.00 1.27 0.83 1.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 8 P 0.00 3.36 0.00 1.84 2.22 0.00 3.34 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.94 0.00 9 V 6.80 3.05 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 0.38 0.00 0.00 0.81 0.00 0.00 10 Q 7.66 3.78 0.00 2.09 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.76 0.00 0.00 0.00 0.00 0.00 2.24 2.49 0.00 11 K 7.27 4.10 0.00 1.33 1.91 0.00 1.82 0.00 0.00 1.77 0.00 0.00 2.88 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.14 1.39 7.81 12 Q 8.03 4.25 0.00 1.87 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.69 5.41 0.00 0.00 0.00 0.00 0.00 2.45 2.41 0.00 13 L 7.78 4.08 0.00 1.89 1.85 0.95 0.90 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 14 E 8.15 3.91 0.00 2.29 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 0.00 2.34 2.51 0.00 15 A 8.28 4.14 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 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 8.16 3.88 0.00 3.29 3.22 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 17 N 7.44 4.16 0.00 2.66 2.45 0.00 0.00 7.06 7.04 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 18 A 8.02 4.12 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 19 R 7.89 3.77 0.00 2.00 2.14 0.00 2.91 0.00 0.00 2.53 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.49 0.00 20 D 8.12 4.94 0.00 2.91 2.70 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 21 I 8.10 3.82 1.76 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.37 0.79 0.00 0.00 22 D 8.18 4.30 0.00 2.80 2.70 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 23 A 8.08 4.26 1.54 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 0.00 0.00 0.00 0.00 0.00 0.00 24 F 8.41 4.33 0.00 3.36 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 25 M 8.11 4.18 0.00 2.15 1.91 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.47 0.00 26 A 7.83 3.89 1.12 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 0.00 0.00 27 W 7.99 4.44 0.00 3.63 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 28 W 8.02 4.87 0.00 3.31 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 29 A 8.62 4.38 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 30 D 8.76 4.40 0.00 2.77 2.69 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 31 D 7.87 5.00 0.00 2.83 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 32 C 7.61 5.07 0.00 3.51 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 33 Q 8.82 4.74 0.00 2.23 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.76 0.00 0.00 0.00 0.00 0.00 2.54 2.50 0.00 34 Y 8.83 5.27 0.00 3.08 2.79 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 35 Y 8.98 5.23 0.00 3.21 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 36 A 8.48 4.05 1.18 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 37 F 7.38 4.26 0.00 2.88 2.82 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 38 P 0.00 3.98 0.00 1.96 1.57 0.00 3.54 0.00 0.00 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.64 0.00 39 A 7.31 4.62 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 T 8.85 4.41 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 1.23 0.00 0.00 41 L 8.31 3.74 0.00 0.95 1.42 0.46 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 42 L 8.68 4.18 0.00 1.95 1.85 1.31 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 43 A 7.82 4.72 1.27 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 44 G 8.94 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 45 N 7.58 4.32 0.00 3.19 2.96 0.00 0.00 6.00 7.49 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 46 A 8.05 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 47 A 7.76 3.87 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 48 E 8.14 4.02 0.00 1.96 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 2.36 2.58 0.00 49 I 7.03 3.22 1.45 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 1.37 1.53 -0.50 0.00 0.00 50 R 7.53 3.68 0.00 1.89 1.97 0.00 2.68 0.00 0.00 2.98 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.51 0.00 51 V 7.16 3.43 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 0.89 0.00 0.00 0.92 0.00 0.00 52 R 7.62 4.37 0.00 1.99 1.83 0.00 3.28 0.00 0.00 3.36 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.53 0.00 53 H 7.83 4.18 0.00 3.23 3.11 0.00 5.87 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 54 I 7.54 3.42 1.91 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.41 0.85 0.00 0.00 55 E 8.03 4.11 0.00 2.23 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 0.00 2.32 2.53 0.00 56 R 7.52 4.46 0.00 1.88 2.35 0.00 3.26 0.00 0.00 3.49 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.61 0.00 57 F 8.33 4.23 0.00 2.97 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 58 K 7.68 4.30 0.00 1.87 1.89 0.00 1.73 0.00 0.00 1.73 0.00 0.00 3.20 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.80 1.63 7.81 59 E 7.65 4.08 0.00 2.18 1.98 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 2.35 2.31 0.00 60 P 0.00 4.28 0.00 2.14 2.16 0.00 3.74 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 61 D 7.91 4.47 0.00 2.81 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 62 L 7.20 4.10 0.00 1.50 1.49 0.64 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 63 Y 8.38 4.33 0.00 2.96 2.69 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 64 G 8.23 4.15 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 0.00 65 E 8.74 4.38 0.00 2.36 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 2.30 2.36 0.00 66 L 8.40 4.26 0.00 1.67 1.54 0.99 1.00 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 67 L 8.69 4.62 0.00 1.41 1.60 0.65 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 68 T 7.53 4.90 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 69 R 8.40 5.68 0.00 1.76 1.86 0.00 2.55 0.00 0.00 3.87 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.48 0.00 70 V 8.52 4.61 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 0.73 0.00 0.00 0.95 0.00 0.00 71 I 8.25 4.79 1.86 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 1.23 1.07 0.90 0.00 0.00 72 V 8.89 4.18 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 0.87 0.00 0.00 0.94 0.00 0.00 73 G 8.62 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 74 N 9.18 4.78 0.00 3.12 3.06 0.00 0.00 5.38 7.74 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 75 V 7.76 4.97 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 1.26 0.00 0.00 1.04 0.00 0.00 76 V 8.61 4.82 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 1.12 0.00 0.00 0.95 0.00 0.00 77 I 8.83 4.49 1.90 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 1.26 0.90 0.93 0.00 0.00 78 D 9.06 4.86 0.00 2.97 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 79 H 9.19 5.37 0.00 3.25 3.39 0.00 5.72 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 E 8.95 5.17 0.00 2.14 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 2.16 2.32 0.00 81 T 8.51 4.83 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 1.32 0.00 0.00 82 V 8.81 4.37 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 1.11 0.00 0.00 1.11 0.00 0.00 83 T 9.00 4.21 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 1.21 0.00 0.00 84 R 7.86 5.09 0.00 1.48 1.84 0.00 3.10 0.00 0.00 3.24 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.53 0.00 85 N 8.83 5.04 0.00 2.71 2.79 0.00 0.00 6.73 7.43 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 86 F 8.46 5.25 0.00 3.07 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 87 P 0.00 4.52 0.00 2.19 2.20 0.00 3.73 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 1.97 1.92 0.00 88 E 8.38 4.48 0.00 2.14 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 2.37 2.33 0.00 89 G 7.06 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 0.00 0.00 0.00 0.00 90 K 8.04 3.55 0.00 1.82 1.60 0.00 1.54 0.00 0.00 1.76 0.00 0.00 3.21 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.64 1.52 7.81 91 G 8.31 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 0.00 0.00 0.00 92 E 8.10 4.73 0.00 2.06 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 2.32 2.25 0.00 93 V 8.39 4.90 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 1.03 0.00 0.00 1.06 0.00 0.00 94 D 8.81 5.06 0.00 2.73 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 95 V 8.93 4.79 2.48 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 1.27 0.00 0.00 1.12 0.00 0.00 96 A 8.85 4.66 1.18 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 97 C 8.98 4.77 0.00 2.88 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 98 I 8.33 4.81 1.93 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 1.72 1.83 1.17 0.00 0.00 99 Y 8.99 4.90 0.00 2.73 2.48 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 0.00 100 E 8.90 5.03 0.00 2.24 1.78 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 2.25 2.37 0.00 101 V 8.72 4.64 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 0.79 0.00 0.00 0.80 0.00 0.00 102 E 8.82 4.59 0.00 2.00 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 2.21 2.26 0.00 103 N 9.88 4.28 0.00 2.93 2.90 0.00 0.00 7.22 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 0.00 104 G 8.70 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 0.00 105 R 7.42 4.81 0.00 1.78 1.93 0.00 3.44 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.71 0.00 106 I 8.21 4.02 1.30 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.28 0.56 0.00 0.00 107 A 9.07 4.14 1.37 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 0.00 0.00 0.00 108 K 7.66 5.00 0.00 1.48 1.11 0.00 2.05 0.00 0.00 2.15 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.55 1.51 7.81 109 A 8.52 4.36 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 0.00 110 W 9.03 5.62 0.00 3.21 2.84 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 0.00 111 F 8.58 5.61 0.00 3.05 3.03 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 0.00 112 K 8.93 4.70 0.00 1.44 2.00 0.00 1.22 0.00 0.00 1.66 0.00 0.00 2.80 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.28 7.81 113 I 8.11 4.10 1.88 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.93 0.99 0.00 0.00 114 G 9.09 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 0.00 115 E 7.67 5.00 0.00 2.04 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 0.00 2.29 2.34 0.00 116 P 0.00 4.89 0.00 2.40 2.43 0.00 3.77 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 2.07 2.08 0.00 117 R 8.94 4.92 0.00 1.92 1.81 0.00 3.25 0.00 0.00 3.18 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.61 0.00 118 I 8.02 4.80 1.91 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.64 1.01 0.00 0.00 119 V 8.64 3.57 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 0.95 0.00 0.00 0.95 0.00 0.00 120 S 8.11 4.18 0.00 3.88 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 0.00 121 Q 7.77 4.59 0.00 2.12 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.48 0.00 0.00 0.00 0.00 0.00 2.32 2.28 0.00 122 K 7.52 4.66 0.00 1.73 1.68 0.00 1.80 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.34 1.38 7.81 123 S 8.61 4.33 0.00 3.91 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