NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4362 8.3044 120.3270 54.7614 32.6804 174.8369 2 E 3.8493 8.7249 125.6599 55.0940 30.3580 170.5434 3 V 4.3512 9.0347 126.3495 60.9325 34.2586 174.3322 4 K 4.7089 8.4897 125.8342 54.6306 34.5453 175.4110 5 E 4.7591 8.4611 121.0778 54.8578 33.4220 175.0341 6 V 4.8142 8.1021 114.3685 59.8658 36.3554 174.5662 7 E 4.7295 8.7799 120.8923 54.7807 33.3969 174.7234 8 L 5.3824 8.6248 123.4240 53.1471 44.9170 175.4849 9 E 4.8598 9.0635 121.9631 54.2189 33.5592 174.3909 10 L 3.8289 8.8404 128.3577 55.5181 42.6114 176.3598 11 S 4.5430 8.4271 119.9072 59.2419 65.0459 173.5719 12 S 4.3980 7.2493 113.0497 56.2637 65.5513 171.9711 13 E 3.8840 8.8140 120.5404 57.9690 29.3527 176.0950 14 A 3.8409 8.6184 128.6371 53.3975 16.7471 175.6352 15 T 5.2021 7.4106 113.4081 63.3711 73.1966 173.5242 16 F 5.2741 9.2010 122.0056 55.7434 43.5656 173.9918 17 L 4.6718 9.2856 124.1407 54.5230 42.9609 175.9199 18 S 5.0593 9.4773 121.0197 56.5989 65.3549 173.1884 19 K 4.5985 9.1878 128.3816 55.9211 32.9691 175.7319 20 T 5.0564 8.6370 117.9257 59.7715 71.9528 174.8826 21 S 4.2145 8.9082 116.5195 61.0751 62.8876 175.5039 22 I 4.1852 7.5249 108.9896 59.7628 38.6956 175.8006 23 G 3.8977 6.2602 106.6168 45.8492 0.0000 170.0702 24 E 5.9409 8.6116 118.3159 53.7949 32.0380 175.8068 25 I 4.8404 8.2027 115.7899 59.2562 42.0212 173.8228 26 T 4.9815 8.4097 113.1542 60.5419 70.7114 173.2435 27 A 5.1019 10.2651 128.0519 49.2989 22.4702 176.5480 28 G 3.8058 8.5699 109.5335 44.6192 0.0000 172.5603 29 E 3.9241 8.2034 120.8944 58.8477 29.5395 179.1136 30 K 4.6619 8.1891 115.0946 55.8317 33.2142 176.1561 31 G 4.0848 7.7635 108.4560 45.0203 0.0000 173.1478 32 L 4.2370 8.8874 123.7701 54.7766 42.9294 176.5642 33 N 4.5824 8.8659 123.1601 53.1843 39.8946 173.4146 34 P 4.2670 0.0000 0.0000 66.4108 31.0354 178.6967 35 M 4.2052 8.0933 116.3589 58.1032 31.9336 178.5032 36 E 4.1633 8.5998 119.1607 59.1798 29.5647 179.1472 37 L 4.0692 8.1475 119.3033 57.4380 41.5222 179.2639 38 L 3.9935 7.8415 120.2429 58.1837 42.0544 179.0490 39 L 3.9701 7.7625 118.2038 57.7450 41.4255 179.6936 40 V 3.6353 7.8942 118.2921 65.9441 31.5043 178.2876 41 S 4.1205 8.3318 115.3148 61.5940 62.7057 176.8044 42 I 3.8131 8.0857 122.6820 64.3585 36.9153 178.6943 43 G 3.6399 8.4728 107.2262 47.8563 0.0000 175.8628 44 S 4.1386 8.3579 117.1819 61.0848 62.9496 175.5510 45 C 4.1943 8.1082 122.0587 59.6242 43.1282 175.6263 46 S 4.5010 7.7804 116.0104 60.8342 62.0221 176.0875 47 G 3.7792 8.7159 108.8524 47.9980 0.0000 175.7103 48 V 3.5945 8.2472 120.8330 65.7393 31.4471 177.8276 49 D 4.2765 7.8129 118.7048 57.4819 40.6712 178.8052 50 V 3.4725 8.0243 118.8988 66.1309 31.4416 177.2564 51 Y 3.9192 8.1326 119.0271 61.2032 38.6194 177.8972 52 H 4.1921 8.1758 116.8585 58.8502 28.7807 178.0196 53 I 3.6018 8.0152 121.8629 64.4093 36.9761 178.4496 54 L 3.8814 8.0349 120.1463 57.5930 41.4828 179.6379 55 K 3.7416 7.7777 119.6111 59.2601 31.9024 178.8705 56 K 3.9718 7.9688 119.0151 58.8280 32.0749 177.5435 57 K 4.4116 7.8539 117.2066 56.0228 32.9299 176.7912 58 R 3.8422 7.4597 115.0110 57.3010 28.2356 176.3711 59 Q 4.2621 7.8828 115.9043 55.4912 30.2161 176.1906 60 E 4.2689 8.3961 122.3482 55.1023 30.3035 174.9537 61 V 4.1570 7.9804 125.1402 61.9409 31.7508 175.3351 62 K 4.2607 9.1694 130.2563 58.5912 33.2306 175.7143 63 D 4.5932 7.5089 116.2507 53.6895 44.7409 174.7128 64 I 5.1123 8.3376 122.3069 59.7450 40.8073 174.6937 65 K 4.5040 9.3537 127.2539 54.4761 34.8425 175.4129 66 I 4.7584 7.7818 124.3022 59.4418 40.2997 174.5747 67 F 4.7751 9.0679 126.3073 55.5620 41.3099 174.6475 68 L 5.2657 8.5664 123.0328 52.6994 44.7146 175.7839 69 K 4.5062 9.2645 124.7738 54.4245 35.3628 174.8485 70 G 3.7666 8.5972 113.7115 44.0585 0.0000 172.1382 71 K 4.7380 9.0010 124.2246 54.6336 34.0496 175.8776 72 R 4.8527 8.6814 124.5592 55.2502 31.1631 176.8718 73 R 4.2451 8.8311 123.4511 56.7608 30.3192 176.5569 74 E 4.1614 8.8702 123.0050 57.6490 30.1131 177.1202 75 K 4.5298 7.5563 116.4355 54.7967 34.8732 175.6720 76 H 4.4485 8.3772 117.8359 55.1091 29.2921 173.7242 77 P 4.5354 0.0000 0.0000 62.4248 32.6247 177.3270 78 K 4.2992 8.2428 122.2076 55.5843 30.7188 175.8215 79 I 3.8876 7.0744 115.7610 60.4715 40.1501 176.1688 80 Y 4.9165 8.0909 120.4179 57.8650 37.7127 176.1417 81 E 4.2775 9.8301 125.3690 58.7577 30.9197 176.4887 82 E 5.2029 8.0521 118.9974 54.7986 33.8022 174.0134 83 I 4.8206 8.7660 125.5591 59.7758 41.2448 173.8700 84 E 5.0257 9.5143 127.7730 54.8339 31.7486 175.2341 85 I 4.8620 8.7989 125.0478 59.2740 40.7422 174.2292 86 K 5.1522 9.1431 128.9767 54.8505 34.8729 174.0312 87 Y 5.1222 9.1967 125.5019 56.4766 40.3308 174.7965 88 V 4.9719 9.4484 124.4116 61.2408 34.3363 173.8058 89 A 5.0934 8.8794 130.6606 50.4815 21.1492 175.4765 90 V 4.4991 9.7044 123.0426 60.8634 34.0160 174.2558 91 G 3.5477 7.6910 114.6546 44.7037 0.0000 173.8158 92 K 2.4800 7.5860 115.7642 53.8686 30.5124 174.5862 93 V 4.5246 6.5917 118.8388 60.4126 34.4791 175.2513 94 E 4.6417 8.6725 126.4916 55.5537 31.5942 177.1178 95 E 4.1123 9.0622 123.6782 59.5555 29.6584 179.4507 96 K 3.9855 8.1425 118.0902 59.7802 32.7067 178.9992 97 A 3.8925 7.7982 121.5290 54.8670 18.3566 179.1970 98 L 3.7414 7.8639 118.9609 58.0137 42.0343 178.7457 99 E 2.5400 8.0498 119.4406 58.8784 29.4563 178.8030 100 Q 3.8100 7.7765 117.7458 58.8423 28.7571 178.7358 101 A 3.8375 7.7863 121.6625 55.0485 18.3291 179.8905 102 V 2.9909 7.4532 116.9163 65.8970 31.5241 178.4859 103 K 3.9135 7.8730 118.4802 59.3675 31.7835 179.4256 104 L 4.0013 8.0690 119.5313 57.6761 41.3859 179.4949 105 S 4.2082 8.0876 113.3662 61.7745 62.2778 176.4386 106 T 3.9882 8.1886 111.3779 63.8732 68.6314 175.1492 107 E 4.5537 8.1173 119.1252 56.0885 30.7446 176.1103 108 K 4.2759 7.5927 116.4841 57.9898 35.4638 176.5555 109 Y 4.3220 8.0347 114.9067 60.3349 38.4383 175.1547 110 C 4.5429 8.5599 121.7778 56.0444 43.5902 174.0596 111 S 4.1078 8.8481 124.4934 61.5978 62.7121 176.4170 112 V 3.7472 7.7643 120.3769 66.0774 31.3720 177.6467 113 L 3.9957 7.9977 119.2821 58.1476 41.7369 178.5794 114 A 4.0684 7.7303 119.4653 55.3493 18.3446 179.2179 115 M 4.1879 7.8623 116.1091 57.5781 32.3293 178.2423 116 V 4.2488 7.6819 110.6623 61.4510 33.0638 177.7084 117 K 3.8846 7.9481 119.1994 59.3584 31.8188 177.0697 118 P 4.4691 0.0000 0.0000 64.3953 31.2999 177.0464 119 S 4.6731 7.7898 112.3065 58.3847 63.3924 172.8597 120 T 4.6633 7.7043 114.0669 61.0324 71.2946 172.0721 121 N 4.7948 8.8511 122.8582 52.0201 40.2768 173.1260 122 L 4.9743 8.5269 129.0099 53.7090 43.6773 175.5292 123 K 4.5798 9.0234 126.1521 54.9579 34.3850 174.9835 124 I 5.2158 8.4610 126.1953 59.7494 39.4351 175.3670 125 S 4.6379 9.1577 119.7438 57.1840 66.8465 172.5040 126 W 5.8413 7.7316 116.2223 56.2225 30.7822 173.0443 127 E 5.0710 9.4768 117.6270 55.5336 32.6282 174.2610 128 V 5.0242 8.5626 120.0375 60.0174 34.6184 175.3980 129 K 4.5512 8.8954 122.7372 54.0948 34.1390 174.9693 130 W 4.6839 8.8986 135.0000 57.5672 30.7366 174.9583 131 E 4.8586 8.6977 126.1707 54.5796 33.8739 175.9542 132 E 4.1840 8.6937 120.3298 56.6045 30.1203 176.1069 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 4.44 0.00 2.01 2.12 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.60 0.00 2 E 8.72 3.85 0.00 2.01 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 2.29 2.36 0.00 3 V 9.03 4.35 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 0.89 0.00 0.00 0.98 0.00 0.00 4 K 8.49 4.71 0.00 1.75 1.67 0.00 1.76 0.00 0.00 1.71 0.00 0.00 3.21 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.33 1.36 7.81 5 E 8.46 4.76 0.00 1.88 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 2.20 2.31 0.00 6 V 8.10 4.81 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 0.72 0.00 0.00 0.91 0.00 0.00 7 E 8.78 4.73 0.00 1.83 1.79 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 2.21 2.27 0.00 8 L 8.62 5.38 0.00 1.39 1.59 0.88 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 9 E 9.06 4.86 0.00 2.07 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.29 0.00 10 L 8.84 3.83 0.00 1.46 1.46 0.30 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 11 S 8.43 4.54 0.00 3.95 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 12 S 7.25 4.40 0.00 3.92 3.94 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.81 3.88 0.00 1.91 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 2.26 2.30 0.00 14 A 8.62 3.84 1.35 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 0.00 0.00 0.00 15 T 7.41 5.20 4.13 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 1.22 0.00 0.00 16 F 9.20 5.27 0.00 2.96 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 17 L 9.29 4.67 0.00 1.58 1.63 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 18 S 9.48 5.06 0.00 3.73 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 19 K 9.19 4.60 0.00 1.81 1.79 0.00 1.58 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.39 7.81 20 T 8.64 5.06 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 21 S 8.91 4.21 0.00 3.88 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 22 I 7.52 4.19 1.86 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.47 0.90 0.00 0.00 23 G 6.26 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 24 E 8.61 5.94 0.00 1.84 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 2.22 2.11 0.00 25 I 8.20 4.84 1.88 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 1.42 1.24 0.92 0.00 0.00 26 T 8.41 4.98 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 1.22 0.00 0.00 27 A 10.27 5.10 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 28 G 8.57 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 0.00 0.00 0.00 29 E 8.20 3.92 0.00 1.97 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 2.34 2.32 0.00 30 K 8.19 4.66 0.00 1.76 1.76 0.00 1.67 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.33 7.81 31 G 7.76 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 0.00 0.00 0.00 32 L 8.89 4.24 0.00 1.66 1.64 0.94 0.65 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 33 N 8.87 4.58 0.00 2.80 2.73 0.00 0.00 7.19 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 34 P 0.00 4.27 0.00 2.19 2.10 0.00 3.67 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.23 0.00 35 M 8.09 4.21 0.00 2.01 2.21 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.47 0.00 36 E 8.60 4.16 0.00 2.22 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 2.39 2.63 0.00 37 L 8.15 4.07 0.00 1.93 1.74 0.94 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 38 L 7.84 3.99 0.00 1.86 2.01 0.98 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 39 L 7.76 3.97 0.00 1.96 1.65 0.79 0.47 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 40 V 7.89 3.64 2.24 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 1.11 0.00 0.00 0.99 0.00 0.00 41 S 8.33 4.12 0.00 4.10 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 42 I 8.09 3.81 2.01 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 1.49 1.12 0.94 0.00 0.00 43 G 8.47 3.64 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 0.00 0.00 0.00 44 S 8.36 4.14 0.00 4.04 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 45 C 8.11 4.19 0.00 3.18 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 46 S 7.78 4.50 0.00 4.08 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 47 G 8.72 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 48 V 8.25 3.59 2.28 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 1.09 0.00 0.00 1.00 0.00 0.00 49 D 7.81 4.28 0.00 2.88 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 50 V 8.02 3.47 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 1.02 0.00 0.00 0.69 0.00 0.00 51 Y 8.13 3.92 0.00 3.14 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 52 H 8.18 4.19 0.00 3.21 3.26 0.00 5.67 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 I 8.02 3.60 1.82 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 1.39 0.67 0.83 0.00 0.00 54 L 8.03 3.88 0.00 1.65 1.57 0.85 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 55 K 7.78 3.74 0.00 1.42 1.74 0.00 1.47 0.00 0.00 1.52 0.00 0.00 2.87 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.33 1.29 7.81 56 K 7.97 3.97 0.00 1.78 1.92 0.00 1.78 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.44 7.81 57 K 7.85 4.41 0.00 1.71 1.76 0.00 1.87 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.39 1.56 7.81 58 R 7.46 3.84 0.00 1.98 1.98 0.00 3.37 0.00 0.00 3.20 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.71 0.00 59 Q 7.88 4.26 0.00 1.91 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.23 6.92 0.00 0.00 0.00 0.00 0.00 2.42 2.42 0.00 60 E 8.40 4.27 0.00 1.74 1.79 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 2.19 2.15 0.00 61 V 7.98 4.16 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 0.81 0.00 0.00 0.77 0.00 0.00 62 K 9.17 4.26 0.00 1.69 1.83 0.00 1.93 0.00 0.00 1.62 0.00 0.00 2.85 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.39 1.35 7.81 63 D 7.51 4.59 0.00 2.79 2.43 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 64 I 8.34 5.11 1.93 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.85 1.00 0.00 0.00 65 K 9.35 4.50 0.00 1.72 1.31 0.00 1.78 0.00 0.00 1.85 0.00 0.00 2.89 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.30 1.40 7.81 66 I 7.78 4.76 1.68 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.56 0.52 0.00 0.00 67 F 9.07 4.78 0.00 2.90 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 68 L 8.57 5.27 0.00 1.38 1.43 0.80 0.85 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 69 K 9.26 4.51 0.00 1.73 1.56 0.00 1.71 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 1.27 1.34 7.81 70 G 8.60 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 K 9.00 4.74 0.00 1.73 1.78 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.86 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.38 1.39 7.81 72 R 8.68 4.85 0.00 1.71 1.93 0.00 3.18 0.00 0.00 3.15 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.79 0.00 73 R 8.83 4.25 0.00 1.77 1.80 0.00 3.46 0.00 0.00 3.21 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 74 E 8.87 4.16 0.00 1.98 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 2.29 2.29 0.00 75 K 7.56 4.53 0.00 1.83 1.77 0.00 1.58 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.31 1.42 7.81 76 H 8.38 4.45 0.00 3.14 3.27 0.00 5.89 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 77 P 0.00 4.54 0.00 2.15 2.04 0.00 3.76 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.97 0.00 78 K 8.24 4.30 0.00 1.69 1.82 0.00 1.68 0.00 0.00 1.60 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.53 1.25 7.81 79 I 7.07 3.89 1.84 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 1.32 0.92 0.87 0.00 0.00 80 Y 8.09 4.92 0.00 2.93 3.05 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 81 E 9.83 4.28 0.00 2.01 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 2.35 2.37 0.00 82 E 8.05 5.20 0.00 2.01 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 2.26 2.34 0.00 83 I 8.77 4.82 1.83 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 0.88 0.53 0.77 0.00 0.00 84 E 9.51 5.03 0.00 1.84 1.84 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 2.24 2.32 0.00 85 I 8.80 4.86 1.87 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 1.03 0.94 0.33 0.00 0.00 86 K 9.14 5.15 0.00 1.81 1.77 0.00 1.58 0.00 0.00 1.58 0.00 0.00 2.79 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.48 1.47 7.81 87 Y 9.20 5.12 0.00 3.20 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 V 9.45 4.97 2.31 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 1.10 0.00 0.00 1.17 0.00 0.00 89 A 8.88 5.09 1.29 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 0.00 0.00 0.00 0.00 0.00 0.00 90 V 9.70 4.50 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 0.97 0.00 0.00 0.98 0.00 0.00 91 G 7.69 3.55 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 K 7.59 2.48 0.00 1.44 1.16 0.00 1.83 0.00 0.00 1.59 0.00 0.00 3.01 0.00 0.00 2.88 0.00 0.00 0.00 0.00 0.87 1.06 7.81 93 V 6.59 4.52 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 0.83 0.00 0.00 0.75 0.00 0.00 94 E 8.67 4.64 0.00 2.14 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 2.61 2.62 0.00 95 E 9.06 4.11 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 2.68 2.71 0.00 96 K 8.14 3.99 0.00 2.04 2.09 0.00 1.57 0.00 0.00 1.84 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.53 1.52 7.81 97 A 7.80 3.89 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 98 L 7.86 3.74 0.00 1.77 1.77 0.83 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 99 E 8.05 2.54 0.00 1.86 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 2.11 1.82 0.00 100 Q 7.78 3.81 0.00 2.22 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.32 2.53 0.00 101 A 7.79 3.84 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 0.00 102 V 7.45 2.99 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 0.82 0.00 0.00 0.21 0.00 0.00 103 K 7.87 3.91 0.00 1.73 1.88 0.00 1.65 0.00 0.00 1.64 0.00 0.00 3.09 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.38 1.33 7.81 104 L 8.07 4.00 0.00 1.79 1.98 0.97 0.97 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 0.00 105 S 8.09 4.21 0.00 3.94 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 0.00 106 T 8.19 3.99 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 1.35 0.00 0.00 107 E 8.12 4.55 0.00 2.05 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 2.26 2.34 0.00 108 K 7.59 4.28 0.00 1.41 1.55 0.00 1.46 0.00 0.00 0.94 0.00 0.00 2.83 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.30 1.05 7.81 109 Y 8.03 4.32 0.00 3.04 3.10 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 0.00 110 C 8.56 4.54 0.00 3.18 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 0.00 111 S 8.85 4.11 0.00 3.91 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 0.00 112 V 7.76 3.75 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 1.06 0.00 0.00 1.00 0.00 0.00 113 L 8.00 4.00 0.00 1.85 1.70 0.97 1.20 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 0.00 114 A 7.73 4.07 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 0.00 115 M 7.86 4.19 0.00 1.99 2.30 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.59 0.00 116 V 7.68 4.25 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 0.90 0.00 0.00 1.05 0.00 0.00 117 K 7.95 3.88 0.00 1.83 1.91 0.00 1.70 0.00 0.00 1.73 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.51 1.74 7.81 118 P 0.00 4.47 0.00 2.03 2.12 0.00 3.61 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 2.04 2.19 0.00 119 S 7.79 4.67 0.00 3.98 3.88 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 0.00 120 T 7.70 4.66 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 1.32 0.00 0.00 121 N 8.85 4.79 0.00 2.93 2.85 0.00 0.00 7.20 6.79 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 0.00 122 L 8.53 4.97 0.00 1.71 1.59 1.03 0.69 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 0.00 123 K 9.02 4.58 0.00 1.72 1.71 0.00 1.68 0.00 0.00 1.65 0.00 0.00 3.09 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.36 1.39 7.81 124 I 8.46 5.22 2.12 0.00 0.00 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 1.62 0.70 1.43 0.00 0.00 125 S 9.16 4.64 0.00 3.70 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 0.00 126 W 7.73 5.84 0.00 3.46 3.41 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 0.00 127 E 9.48 5.07 0.00 2.09 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 0.00 2.32 2.35 0.00 128 V 8.56 5.02 2.23 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 0.95 0.00 0.00 1.15 0.00 0.00 129 K 8.90 4.55 0.00 1.71 1.84 0.00 1.75 0.00 0.00 1.76 0.00 0.00 2.86 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.42 1.55 7.81 130 W 8.90 4.68 0.00 3.52 3.05 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 0.00 131 E 8.70 4.86 0.00 1.81 1.71 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 0.00 2.25 2.43 0.00 132 E 8.69 4.18 0.00 1.96 1.84 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 2.31 2.43 0.00