NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3903 8.2649 123.5968 52.0221 19.9524 175.7606 2 N 4.7804 8.5984 117.1859 50.8625 40.7455 172.6503 3 A 4.7699 8.3601 124.4918 49.3495 23.3174 174.5719 4 F 3.9645 8.8239 120.8034 59.5722 39.2417 171.3658 5 L 3.4076 7.9531 135.0000 54.1750 41.3985 174.6828 *8 L 4.2834 8.3992 121.9645 54.4818 43.6448 177.6568 9 R 4.2351 7.6495 116.2000 54.5149 30.9418 174.5173 10 P 4.3652 0.0000 0.0000 62.1863 31.9963 176.7114 11 G 3.6226 8.2072 109.0349 45.8440 0.0000 173.4366 12 S 4.3026 8.0785 115.8302 56.2127 65.1452 174.3237 13 L 3.7247 8.3343 126.3218 56.3103 41.2026 177.5793 *15 R 4.1361 7.8962 114.5402 56.0760 31.1858 176.5580 *17 C 4.9414 8.0596 113.9671 56.8380 42.0603 173.8373 18 K 4.4189 7.6948 118.1212 56.5805 32.1287 176.7904 *21 Q 4.3481 8.0085 117.0199 55.9305 29.8969 173.8084 22 C 5.0915 9.4430 118.3344 53.2978 43.6808 174.1090 23 S 4.8305 8.5906 117.6374 57.6527 64.0409 175.0779 24 F 2.7661 8.0755 122.3699 57.9702 36.4471 174.4823 *27 A 4.2157 7.9868 127.1701 51.7038 20.7551 180.3812 28 R 4.3446 7.5310 115.9542 55.7279 29.3397 178.6964 *30 I 3.8145 7.9474 117.3869 60.8905 38.7381 177.3926 31 F 4.1664 7.8143 116.3111 57.6512 38.4610 174.5693 32 K 3.9796 7.6324 120.6255 56.6728 31.6487 175.1490 33 D 4.3937 7.7721 116.9216 54.8711 42.1540 177.6749 34 A 4.1632 8.4879 124.1839 53.6656 18.4383 179.4085 *36 R 4.2054 8.0374 117.9561 57.4406 32.1023 178.0922 37 T 3.7879 7.7258 113.9337 66.6424 68.3004 176.8779 38 K 4.2910 8.3381 120.3816 59.4572 31.8962 179.1683 39 L 4.0061 7.9008 119.1614 57.9569 42.2535 178.4005 40 F 4.2546 8.1257 120.6989 60.8786 39.4114 177.2610 41 W 4.1788 8.8875 128.7032 60.1391 30.2599 177.7579 42 I 3.6938 7.6947 112.7084 64.2295 37.1009 178.0292 43 S 4.1994 7.7336 116.1372 60.8089 62.8328 175.6087 44 Y 3.7262 7.1670 121.6717 60.1444 38.3769 176.9932 45 S 4.0409 7.0607 110.7187 57.6933 63.4301 174.4343 46 D 4.1554 7.3415 121.7852 55.4805 41.1411 175.7357 47 G 3.8008 7.8667 108.6641 45.4539 0.0000 172.4764 48 D 4.7493 8.3013 122.6138 53.6803 40.4511 176.6741 49 Q 4.1971 8.8726 126.6362 57.9924 29.0002 176.9811 50 C 4.3402 9.0190 115.5262 57.2121 40.6884 175.3565 51 A 3.8071 7.7846 123.3721 55.1970 17.9947 179.2082 52 S 4.0995 7.8772 110.0609 59.4199 63.5845 173.9244 53 S 3.6387 7.6611 115.7865 58.9773 60.0479 171.1668 54 P 4.1298 0.0000 0.0000 65.2066 31.8222 177.5366 55 C 4.4092 7.7873 116.2479 56.3347 34.2625 173.3421 56 Q 4.1368 8.7584 124.9248 55.3267 29.4757 175.6086 57 N 3.9322 9.2822 113.6809 54.4997 35.7635 175.2536 58 G 3.7725 8.0768 100.1100 46.3108 0.0000 174.0153 59 G 4.0177 7.6095 106.8586 45.5238 0.0000 173.6708 60 S 4.9081 9.2308 115.8577 56.6379 65.7795 172.9558 61 C 5.1273 8.8515 124.9968 55.5723 43.1699 172.3673 62 K 4.6392 9.1599 127.6083 54.4007 34.1821 174.7196 63 D 4.9222 8.8181 127.6533 54.6813 42.0377 174.9888 64 Q 4.5249 8.7136 122.3880 53.8602 33.1669 174.6004 65 L 4.1355 8.3986 118.6483 56.1038 41.1551 177.3862 66 Q 3.4755 9.9533 126.6364 56.3161 26.8070 173.6288 67 S 4.6085 7.4105 110.5468 58.5663 64.7576 174.1850 68 Y 5.3361 7.6092 117.8831 55.8988 41.5011 174.3019 69 I 4.6089 8.8478 118.9859 60.0299 41.4454 173.8996 70 C 5.3720 8.9866 124.4575 55.6438 38.8370 172.9452 71 F 4.7239 9.5101 123.2086 56.2535 40.4292 174.7987 72 C 5.2032 8.7526 120.7400 55.0248 39.7649 173.6523 73 L 4.4572 8.6513 120.0011 54.2261 42.2317 176.8954 74 P 4.0860 0.0000 0.0000 66.0314 31.5828 177.3477 75 A 4.1551 7.9630 118.1632 52.2229 18.0544 176.3263 76 F 5.3625 8.2352 116.0470 56.8923 43.0970 173.4642 77 E 4.5687 8.7821 119.2137 55.6369 32.4549 174.7641 78 G 4.2825 8.9493 105.0555 44.7015 0.0000 174.4698 79 R 3.8594 8.6153 120.3110 59.0065 30.0179 177.6310 80 N 5.0752 8.3378 114.1829 53.1505 39.1863 173.9332 81 C 4.6092 8.1761 113.0450 57.9937 38.4376 174.4175 82 E 3.9395 8.2652 117.1191 57.8497 30.1714 176.3648 83 T 4.1773 7.9803 118.4683 63.2207 69.1726 173.5389 84 H 4.8096 8.7915 124.2294 54.2989 28.4437 176.1256 85 K 3.8623 8.0540 125.3403 59.3011 31.9579 178.2062 86 D 4.6378 7.8917 115.7719 54.9980 40.9552 176.1385 87 D 5.0154 8.1175 119.6324 54.4653 41.3733 176.5406 88 Q 4.5878 7.9862 115.0776 55.7425 30.0634 177.0956 89 L 4.3410 7.8135 120.2220 54.5455 40.5553 175.5687 90 I 4.6450 6.9980 114.6433 58.6802 41.2451 178.0588 91 C 4.2952 9.4089 119.6024 60.3681 40.0988 176.8374 92 V 3.4139 7.7214 110.9014 63.0602 31.5267 175.8195 93 N 4.5573 8.0587 119.5609 52.6537 37.7448 174.2915 94 E 3.9226 8.9652 128.3915 57.7144 27.3690 174.8494 95 N 4.6631 8.4729 110.7360 53.1641 37.7064 174.1890 96 G 3.6446 8.9638 101.0710 45.7962 0.0000 175.8946 97 G 3.9582 8.4034 107.0004 45.2576 0.0000 174.2238 98 C 4.4830 7.7726 117.6100 56.6312 40.8072 173.6990 99 E 3.9764 9.1315 125.3667 58.3819 30.0979 176.7834 100 Q 4.2494 7.9097 112.5572 55.6990 31.0420 175.9855 101 Y 5.0049 5.9601 119.3380 57.5198 41.1084 174.6792 102 C 5.4504 8.7941 121.6614 54.9526 47.5508 173.1266 103 S 4.7614 8.9405 121.3662 56.7328 65.6766 173.7510 104 D 4.8149 8.6837 124.4286 54.8263 42.3455 176.5557 105 H 4.7523 8.4488 117.6333 54.8599 31.8273 173.0385 106 T 4.0398 8.4300 114.2601 63.0995 68.9551 173.7128 107 G 4.2261 9.4171 113.9224 45.0847 0.0000 173.6771 108 T 4.6560 7.3289 110.7457 61.2500 69.0353 173.6909 109 K 4.8840 8.5551 120.2015 54.2750 35.3725 176.7477 110 R 4.4590 8.6995 118.2100 56.5816 30.3436 175.6889 111 S 4.9389 9.0740 114.9602 56.9552 66.1952 172.2875 112 C 5.4020 8.7283 118.2296 55.9182 41.5048 172.7299 113 R 4.8263 8.9134 119.5033 55.2099 34.9035 173.0446 114 C 5.1262 8.4856 115.6851 55.3639 38.7332 174.0953 115 H 4.4959 9.2891 120.7596 55.2224 30.2279 174.4408 116 E 4.0681 8.3944 124.2406 58.2394 29.8486 177.3213 117 G 3.9894 9.8896 112.5884 45.3733 0.0000 171.9335 118 Y 5.2955 7.6671 114.9695 56.4228 42.3985 174.7584 119 S 4.8230 9.2844 116.6578 56.5183 67.5382 173.2195 120 L 4.5931 8.5110 125.3371 54.8857 42.6743 176.7211 121 L 4.4083 9.0415 126.8170 54.0399 42.7680 178.0656 122 A 4.0294 8.6578 122.7198 55.2148 18.3134 178.6073 123 D 4.3672 8.0639 113.8399 54.2255 39.6234 177.4150 124 G 3.9895 8.1930 107.8796 46.0225 0.0000 174.4442 125 V 4.3827 8.5987 112.3872 61.3622 35.1567 176.0785 126 S 5.0133 8.3589 115.4012 57.6527 65.0140 173.9544 127 C 5.5790 9.9459 120.0443 55.5069 40.5214 173.5825 128 T 4.9103 8.8130 117.1963 59.3544 70.4616 171.3255 129 P 4.2618 0.0000 0.0000 62.6472 31.9263 176.1153 130 T 4.5769 8.3381 113.2561 61.3781 69.5241 173.8922 131 V 4.4814 7.2371 113.4809 59.8460 35.8469 174.9580 132 E 3.8255 8.6360 121.7786 58.7137 29.8803 176.5657 133 Y 4.7739 7.3202 114.9147 55.0824 38.1568 173.0927 134 P 4.3768 0.0000 0.0000 62.0955 32.4544 177.1582 135 C 4.2798 8.5150 114.3690 59.3643 30.2489 174.6947 136 G 3.9625 8.8233 108.3254 45.7705 0.0000 173.4508 137 K 4.5703 7.5020 118.1983 54.4638 34.5158 176.3813 138 I 4.2905 7.9608 123.5003 59.0105 37.2693 174.6328 139 P 4.2569 0.0000 0.0000 65.7035 31.2563 178.7527 140 I 3.9963 7.8041 107.7423 62.2150 37.4831 176.0033 141 L 4.6060 7.9896 120.0167 54.8138 43.4346 176.2811 142 E 4.2064 7.9733 122.9634 56.4563 29.4578 176.0427 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 A 8.26 4.39 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 2 N 8.60 4.78 0.00 2.81 2.74 0.00 0.00 6.67 6.46 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 3 A 8.36 4.77 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 4 F 8.82 3.96 0.00 2.93 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 5 L 7.95 3.41 0.00 1.35 1.38 0.57 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 *8 L 8.40 4.28 0.00 1.70 1.71 0.81 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 9 R 7.65 4.24 0.00 1.75 1.81 0.00 3.19 0.00 0.00 3.19 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 10 P 0.00 4.37 0.00 1.98 1.93 0.00 3.64 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.04 0.00 11 G 8.21 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.08 4.30 0.00 3.71 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 13 L 8.33 3.72 0.00 1.39 1.44 0.66 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 *15 R 7.90 4.14 0.00 1.82 1.92 0.00 3.31 0.00 0.00 3.21 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.66 0.00 *17 C 8.06 4.94 0.00 3.17 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 18 K 7.69 4.42 0.00 1.81 1.88 0.00 1.82 0.00 0.00 1.81 0.00 0.00 3.15 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.50 1.54 7.81 *21 Q 8.01 4.35 0.00 2.18 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.71 0.00 0.00 0.00 0.00 0.00 2.29 2.41 0.00 22 C 9.44 5.09 0.00 3.14 3.17 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 23 S 8.59 4.83 0.00 4.12 4.07 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 24 F 8.08 2.77 0.00 1.82 2.57 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 0.00 0.00 0.00 0.00 *27 A 7.99 4.22 1.56 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 0.00 0.00 28 R 7.53 4.34 0.00 1.26 1.63 0.00 3.24 0.00 0.00 3.21 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.54 0.00 *30 I 7.95 3.81 1.45 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.44 0.11 0.00 0.00 31 F 7.81 4.17 0.00 2.97 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 32 K 7.63 3.98 0.00 1.88 1.81 0.00 1.69 0.00 0.00 1.60 0.00 0.00 2.93 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.32 1.30 7.81 33 D 7.77 4.39 0.00 2.77 2.60 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 34 A 8.49 4.16 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 *36 R 8.04 4.21 0.00 1.94 1.98 0.00 3.20 0.00 0.00 3.43 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.90 0.00 37 T 7.73 3.79 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 0.80 0.00 0.00 38 K 8.34 4.29 0.00 1.90 1.96 0.00 1.73 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.62 1.74 7.81 39 L 7.90 4.01 0.00 1.62 1.83 0.93 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 40 F 8.13 4.25 0.00 2.48 2.80 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 41 W 8.89 4.18 0.00 3.87 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 42 I 7.69 3.69 1.87 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 1.72 0.67 1.02 0.00 0.00 43 S 7.73 4.20 0.00 3.75 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 44 Y 7.17 3.73 0.00 1.79 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 0.00 0.00 0.00 0.00 45 S 7.06 4.04 0.00 3.47 2.63 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 0.00 0.00 0.00 0.00 46 D 7.34 4.16 0.00 2.75 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 7.87 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 48 D 8.30 4.75 0.00 2.71 2.54 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 49 Q 8.87 4.20 0.00 2.44 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.68 0.00 0.00 0.00 0.00 0.00 2.55 2.43 0.00 50 C 9.02 4.34 0.00 3.29 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 51 A 7.78 3.81 1.26 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 0.00 0.00 52 S 7.88 4.10 0.00 3.74 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 53 S 7.66 3.64 0.00 3.96 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.13 0.00 1.73 1.78 0.00 3.48 0.00 0.00 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.72 0.00 55 C 7.79 4.41 0.00 2.96 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 56 Q 8.76 4.14 0.00 2.28 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.34 6.22 0.00 0.00 0.00 0.00 0.00 2.32 2.46 0.00 57 N 9.28 3.93 0.00 1.64 1.42 0.00 0.00 6.90 7.65 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 58 G 8.08 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 59 G 7.61 4.02 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 0.00 60 S 9.23 4.91 0.00 3.70 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 61 C 8.85 5.13 0.00 2.95 2.95 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 0.00 0.00 0.00 62 K 9.16 4.64 0.00 2.05 1.85 0.00 1.78 0.00 0.00 1.62 0.00 0.00 2.77 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.32 1.61 7.81 63 D 8.82 4.92 0.00 2.84 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 64 Q 8.71 4.52 0.00 2.17 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.74 0.00 0.00 0.00 0.00 0.00 2.50 2.47 0.00 65 L 8.40 4.14 0.00 1.62 1.63 0.91 0.96 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 66 Q 9.95 3.48 0.00 2.08 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.89 0.00 0.00 0.00 0.00 0.00 2.53 2.41 0.00 67 S 7.41 4.61 0.00 3.83 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 68 Y 7.61 5.34 0.00 2.96 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 69 I 8.85 4.61 2.00 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 1.15 0.79 0.71 0.00 0.00 70 C 8.99 5.37 0.00 3.05 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 71 F 9.51 4.72 0.00 2.96 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 72 C 8.75 5.20 0.00 3.02 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 73 L 8.65 4.46 0.00 2.10 1.78 1.06 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 74 P 0.00 4.09 0.00 2.05 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 2.07 2.17 0.00 75 A 7.96 4.16 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 F 8.24 5.36 0.00 3.08 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 77 E 8.78 4.57 0.00 2.07 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 0.00 2.21 2.25 0.00 78 G 8.95 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 0.00 0.00 0.00 0.00 79 R 8.62 3.86 0.00 1.76 2.02 0.00 3.21 0.00 0.00 3.13 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.59 0.00 80 N 8.34 5.08 0.00 2.90 3.01 0.00 0.00 7.16 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 81 C 8.18 4.61 0.00 3.15 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 82 E 8.27 3.94 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 2.29 2.29 0.00 83 T 7.98 4.18 4.44 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 1.25 0.00 0.00 84 H 8.79 4.81 0.00 3.26 3.28 0.00 5.63 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 K 8.05 3.86 0.00 1.68 1.81 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.69 1.42 7.81 86 D 7.89 4.64 0.00 2.61 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 87 D 8.12 5.02 0.00 2.78 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 88 Q 7.99 4.59 0.00 1.99 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.64 0.00 0.00 0.00 0.00 0.00 2.51 2.24 0.00 89 L 7.81 4.34 0.00 1.58 1.61 0.98 1.00 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 90 I 7.00 4.64 1.87 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 1.64 0.58 0.91 0.00 0.00 91 C 9.41 4.30 0.00 3.17 3.17 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 92 V 7.72 3.41 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 0.65 0.00 0.00 0.93 0.00 0.00 93 N 8.06 4.56 0.00 2.82 2.96 0.00 0.00 7.06 7.64 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 94 E 8.97 3.92 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 2.30 2.21 0.00 95 N 8.47 4.66 0.00 2.93 2.81 0.00 0.00 7.56 7.92 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 96 G 8.96 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 97 G 8.40 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 98 C 7.77 4.48 0.00 3.12 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 99 E 9.13 3.98 0.00 1.84 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 0.00 2.20 2.21 0.00 100 Q 7.91 4.25 0.00 1.77 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.81 6.61 0.00 0.00 0.00 0.00 0.00 1.91 2.06 0.00 101 Y 5.96 5.00 0.00 2.91 2.71 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 0.00 0.00 0.00 102 C 8.79 5.45 0.00 3.06 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 0.00 103 S 8.94 4.76 0.00 3.76 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 0.00 104 D 8.68 4.81 0.00 2.51 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 0.00 105 H 8.45 4.75 0.00 3.19 3.18 0.00 5.63 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 0.00 106 T 8.43 4.04 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 0.00 107 G 9.42 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 0.00 0.00 0.00 0.00 108 T 7.33 4.66 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 1.20 0.00 0.00 109 K 8.56 4.88 0.00 1.76 1.79 0.00 1.62 0.00 0.00 1.76 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.32 1.36 7.81 110 R 8.70 4.46 0.00 1.96 1.99 0.00 3.04 0.00 0.00 3.29 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.71 0.00 111 S 9.07 4.94 0.00 3.92 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 0.00 112 C 8.73 5.40 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 0.00 113 R 8.91 4.83 0.00 1.86 1.91 0.00 3.14 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 0.00 114 C 8.49 5.13 0.00 2.80 2.96 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 0.00 115 H 9.29 4.50 0.00 2.75 2.92 0.00 5.61 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 E 8.39 4.07 0.00 1.99 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 2.36 2.38 0.00 117 G 9.89 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 0.00 0.00 0.00 118 Y 7.67 5.30 0.00 2.84 2.76 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 0.00 119 S 9.28 4.82 0.00 3.69 3.71 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 0.00 0.00 0.00 120 L 8.51 4.59 0.00 1.65 1.59 1.00 1.03 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 0.00 121 L 9.04 4.41 0.00 1.78 1.60 0.93 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 122 A 8.66 4.03 1.28 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 0.00 0.00 0.00 123 D 8.06 4.37 0.00 2.78 2.81 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 0.00 124 G 8.19 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 0.00 0.00 0.00 125 V 8.60 4.38 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 0.70 0.00 0.00 0.99 0.00 0.00 126 S 8.36 5.01 0.00 3.81 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 0.00 127 C 9.95 5.58 0.00 2.63 2.96 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 0.00 128 T 8.81 4.91 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 1.22 0.00 0.00 129 P 0.00 4.26 0.00 1.78 1.55 0.00 3.63 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.90 0.00 130 T 8.34 4.58 4.20 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 1.19 0.00 0.00 131 V 7.24 4.48 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 0.67 0.00 0.00 0.81 0.00 0.00 132 E 8.64 3.83 0.00 1.72 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 1.47 1.69 0.00 133 Y 7.32 4.77 0.00 2.97 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 0.00 134 P 0.00 4.38 0.00 1.68 1.49 0.00 3.77 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 1.93 1.71 0.00 135 C 8.52 4.28 0.00 3.15 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 0.00 136 G 8.82 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 0.00 137 K 7.50 4.57 0.00 1.81 1.75 0.00 1.88 0.00 0.00 1.77 0.00 0.00 3.00 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.53 1.59 7.81 138 I 7.96 4.29 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 1.43 0.73 0.93 0.00 0.00 139 P 0.00 4.26 0.00 2.27 2.33 0.00 3.65 0.00 0.00 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.33 0.00 140 I 7.80 4.00 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 1.43 0.54 0.93 0.00 0.00 141 L 7.99 4.61 0.00 1.76 1.73 0.93 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 0.00 142 E 7.97 4.21 0.00 2.10 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.41 0.00 * Residues marked with a * may have inaccurate shift predictions.