NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 A 4.1447 8.2649 123.5830 51.8600 21.0651 176.2661 *2 I 4.0438 7.4918 114.5803 60.5527 38.7199 175.9766 3 V 3.9345 8.7480 126.2261 64.9416 32.2970 176.1200 4 G 4.6551 7.4260 103.8769 46.1102 0.0000 172.2435 5 L 5.2841 8.1491 122.7799 53.0851 45.8414 175.3123 6 G 4.4010 9.0892 111.8625 44.9824 0.0000 171.2012 7 T 5.2615 8.2552 115.9235 60.6667 71.2531 172.2186 8 D 4.7223 8.7921 123.4445 53.1835 45.2430 173.7044 9 I 5.1355 8.4956 124.4535 59.1497 40.8402 174.1630 10 A 4.9489 9.4787 130.2914 50.0211 22.1942 174.7784 11 E 4.4726 8.8813 122.9622 55.4908 30.4474 177.3756 12 I 3.7734 8.5473 128.6184 64.4438 37.0838 178.0258 13 E 4.0486 8.0497 119.6810 59.4284 29.4250 178.9998 14 R 3.8348 7.6425 116.9205 58.9467 30.0476 179.2276 15 V 3.4387 7.5960 117.7056 65.9410 31.6748 177.7179 16 E 3.9932 8.2890 118.3943 59.4658 29.3754 179.5725 17 K 3.9219 8.2329 118.3413 59.3101 32.0001 179.2283 18 A 3.7034 7.7226 121.0566 55.0505 18.1131 179.7436 19 L 4.0488 8.0398 117.2775 57.8698 41.5017 179.5831 20 A 4.0407 7.9825 119.7798 54.5524 18.2752 179.5014 21 R 4.1738 7.4679 115.4466 58.3310 30.9425 177.7230 22 S 4.7143 8.3699 112.0832 57.1134 66.1324 176.6057 23 G 4.0134 7.9776 110.1763 46.0650 0.0000 175.9250 24 E 4.0215 9.1128 125.4898 58.9514 29.0945 177.0977 25 N 4.3825 7.8514 115.7321 56.2237 38.9941 176.8671 26 F 4.3759 8.1942 121.1822 61.2339 39.6323 176.8910 27 A 3.4468 8.1047 120.4972 55.2441 17.8871 179.8675 28 R 3.8194 8.1179 115.2773 58.9555 30.1316 179.1618 29 R 4.0335 7.4744 116.9905 58.3969 30.0197 178.0403 30 I 3.6815 7.0857 117.8068 61.1733 38.5335 175.8061 31 L 4.8253 7.2341 118.8191 52.9684 43.3097 177.2522 32 T 3.9232 8.6849 113.4254 61.5790 70.5255 175.1813 33 D 4.3674 8.5938 122.1508 57.9660 40.8566 179.1690 34 S 4.2565 7.9380 112.9018 61.3918 62.5936 175.8438 35 E 4.2493 8.1807 120.4497 58.8382 29.1311 179.1924 36 L 3.9568 7.6202 119.5237 57.5075 41.2137 178.8118 37 E 3.9123 7.8194 117.9377 59.5538 29.3655 178.8480 38 Q 3.9752 8.0018 117.5932 58.9020 29.6156 177.2616 39 F 2.8840 7.9940 121.8136 61.2682 39.1641 176.9073 40 H 4.0206 8.3736 114.5707 58.5074 28.5005 177.1776 41 A 4.0863 7.3570 120.9932 53.1279 18.8171 177.9469 42 S 4.0966 6.7942 111.4472 58.6057 62.8636 173.9570 43 K 4.4254 8.4539 123.9706 56.4339 33.0961 176.9287 44 Q 4.6046 7.9446 117.6409 53.9648 29.4819 175.9902 45 Q 4.0209 7.9440 120.2654 58.7023 29.2105 178.7251 46 G 3.7818 8.1622 106.3894 48.1100 0.0000 175.8231 47 R 3.9917 8.0291 120.3759 58.5981 30.1681 178.5462 48 F 4.0443 8.5272 120.6410 61.5128 39.4286 177.0671 49 L 4.1859 8.9024 119.9890 58.0556 41.9265 178.5632 50 A 4.1204 8.4210 121.0151 55.2813 18.2976 179.8224 51 K 4.0011 8.0664 116.6076 59.6539 32.0291 179.9124 52 R 3.8845 7.8412 117.9962 58.9291 29.9200 178.7201 53 F 3.9749 8.7549 120.7217 61.3411 39.3366 176.9937 54 A 4.6865 8.5723 121.3205 54.5974 18.1666 179.3061 55 A 3.8558 8.0725 119.1943 55.4670 18.4260 180.1370 56 K 3.4674 8.1692 117.0475 59.1924 32.0724 179.5379 57 E 3.5940 8.0668 118.7446 59.2333 29.3655 179.1281 58 A 3.8634 8.0028 120.6547 55.1504 18.5280 179.4908 59 A 3.8105 7.7675 119.4056 55.2772 18.2919 180.0690 60 S 4.1610 7.5994 112.7576 61.3733 62.9892 176.9494 61 K 3.9383 7.9851 122.0639 59.1431 31.8462 179.1510 62 A 4.2539 8.0381 122.3805 54.4500 18.0152 179.4465 63 L 4.1427 7.7142 116.3055 56.0417 41.8222 178.3300 64 G 4.0065 8.1802 106.7361 45.2531 0.0000 173.7810 65 T 4.2925 7.5533 108.4810 60.0819 71.0142 175.6711 66 G 3.9934 7.8194 110.5478 45.8598 0.0000 173.7360 67 I 3.8552 7.7959 117.1338 58.9709 35.6753 174.3880 68 A 4.2119 8.3662 127.3882 52.2217 22.7137 176.2622 69 Q 3.5364 9.9386 114.7468 57.1009 26.1553 175.6651 70 G 3.9179 8.4736 106.3187 45.1560 0.0000 174.6027 71 V 3.9614 7.7503 121.3205 62.5087 32.1861 175.0159 72 T 4.8789 8.1562 115.7298 59.2183 72.1526 174.6093 73 F 4.3060 8.6635 120.2893 61.2625 38.9371 177.1772 74 H 4.6790 7.8206 114.9702 57.3958 28.5987 175.8038 75 D 4.3553 8.3326 120.0332 55.0785 40.9963 175.5191 76 F 5.2867 7.8563 117.8029 55.7795 41.8913 174.7584 77 T 4.8190 8.9937 119.7481 61.8623 71.6061 172.8911 78 I 4.7690 8.9823 127.8356 60.2932 38.8272 175.2451 79 S 4.9498 9.0836 122.2309 57.1825 67.3113 172.2563 80 H 5.4783 8.5311 115.7688 54.5970 32.7988 173.8409 81 D 4.7136 8.8686 121.7725 51.8512 40.9318 177.0054 82 K 3.8308 8.6248 119.4587 59.2599 31.9242 177.0454 83 L 4.3277 8.2017 116.3020 54.5380 41.9815 177.2820 84 G 4.0164 8.2349 107.3699 44.3994 0.0000 173.9086 85 K 4.2288 8.1154 122.4616 55.7904 33.2186 174.1439 86 P 4.8197 0.0000 0.0000 62.6293 32.6655 175.4146 87 L 4.8414 9.1169 121.8324 52.8373 45.4741 174.9908 88 L 5.1422 8.5639 124.3892 53.3586 44.2238 175.2850 89 I 4.6210 8.8325 126.9885 59.5373 40.2167 174.6713 90 L 5.0743 8.5296 126.2462 53.7246 43.9352 175.7627 91 S 4.3021 8.4863 115.4627 57.8094 66.9354 174.2341 92 G 3.7198 8.7502 107.8448 46.7584 0.0000 175.4238 93 Q 3.9373 8.5377 118.4109 58.7524 28.9863 178.4010 94 A 3.8314 7.8640 121.6854 54.9835 18.2714 179.4519 95 A 3.8502 7.7267 119.3519 55.0068 18.4389 179.3307 96 E 3.8152 7.9641 117.4669 59.5612 29.7570 179.0218 97 L 3.9594 8.0792 118.7526 57.8786 41.6188 179.4863 98 A 4.0144 8.2105 120.7421 55.0396 18.1764 179.6647 99 S 3.9945 8.2818 111.8340 61.7517 62.3027 176.4180 100 Q 3.9887 7.9125 119.3704 58.7529 28.5493 178.0793 101 L 4.2463 7.8089 117.0491 54.3068 42.1036 176.7398 102 Q 3.6056 8.3310 117.9162 56.6331 26.6450 173.5549 103 V 3.9530 7.9808 118.1056 63.3434 32.0274 175.1517 104 E 4.7349 9.2362 125.3328 56.2906 32.7497 175.5460 105 N 5.2355 8.0294 115.9066 51.3686 43.1446 173.3631 106 I 4.8828 8.2960 122.7253 59.7871 40.3872 174.5556 107 H 5.0229 9.2958 123.4102 53.8932 32.3480 172.4521 108 L 5.2003 8.5027 123.4755 53.5127 45.2556 175.1305 109 S 4.8510 9.1579 119.8104 56.6015 66.0543 172.5431 110 I 5.0721 8.2939 124.9268 59.7967 40.4980 174.7236 111 S 4.6993 8.4446 118.1795 56.9558 65.5220 172.4546 112 D 5.0771 8.3612 123.7890 51.8051 42.3962 174.5279 113 E 4.8129 8.6083 118.1215 54.9618 32.3844 174.8080 114 R 4.0001 8.9390 116.4159 59.9487 30.1799 177.2137 115 H 4.5514 8.5673 112.4401 55.6741 30.7646 173.6093 116 Y 5.2949 7.9289 115.7345 56.0416 41.9411 174.7177 117 A 5.5348 9.2208 123.7250 49.2815 22.9568 175.0257 *119 A 4.5629 8.2094 118.9868 52.4716 20.4634 176.0148 120 T 5.1363 8.5940 115.4277 61.7613 73.0489 173.3568 121 V 4.9325 8.8942 124.5932 61.1713 35.2137 174.1350 122 I 5.0377 8.9447 127.7190 59.5096 40.6781 174.2126 123 L 5.2571 8.8485 126.7565 52.9083 44.1938 175.3502 124 E 5.0995 9.1873 121.1330 54.5306 33.0539 175.3440 125 R 5.1590 8.9910 118.3546 54.1783 32.3783 176.3523 126 R 5.0618 7.4980 113.9819 57.7853 29.8900 175.8899 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 0 A 8.26 4.14 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 *2 I 7.49 4.04 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 1.30 0.59 0.94 0.00 0.00 3 V 8.75 3.93 2.20 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 0.72 0.00 0.00 1.01 0.00 0.00 4 G 7.43 4.66 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 0.00 0.00 0.00 5 L 8.15 5.28 0.00 1.71 1.44 0.97 1.02 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 6 G 9.09 4.40 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 0.00 7 T 8.26 5.26 4.22 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 1.19 0.00 0.00 8 D 8.79 4.72 0.00 2.77 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 9 I 8.50 5.14 1.87 0.00 0.00 0.59 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 1.32 0.91 0.00 0.00 10 A 9.48 4.95 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 11 E 8.88 4.47 0.00 2.18 1.87 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 2.27 2.10 0.00 12 I 8.55 3.77 1.86 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 1.42 0.40 0.90 0.00 0.00 13 E 8.05 4.05 0.00 1.98 1.89 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 2.34 2.37 0.00 14 R 7.64 3.83 0.00 1.99 1.86 0.00 3.27 0.00 0.00 3.09 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.71 0.00 15 V 7.60 3.44 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 1.30 0.00 0.00 0.82 0.00 0.00 16 E 8.29 3.99 0.00 2.19 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 2.35 2.49 0.00 17 K 8.23 3.92 0.00 1.69 1.78 0.00 1.62 0.00 0.00 1.60 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.61 7.81 18 A 7.72 3.70 0.40 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 19 L 8.04 4.05 0.00 1.93 1.85 1.19 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 20 A 7.98 4.04 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 21 R 7.47 4.17 0.00 1.85 1.94 0.00 3.03 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.81 0.00 22 S 8.37 4.71 0.00 3.84 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 23 G 7.98 4.01 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 0.00 0.00 0.00 24 E 9.11 4.02 0.00 2.18 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 2.43 2.51 0.00 25 N 7.85 4.38 0.00 2.96 2.93 0.00 0.00 6.99 8.75 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 26 F 8.19 4.38 0.00 3.07 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 27 A 8.10 3.45 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 R 8.12 3.82 0.00 1.79 2.01 0.00 3.19 0.00 0.00 3.23 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.85 0.00 29 R 7.47 4.03 0.00 1.82 1.92 0.00 3.22 0.00 0.00 3.28 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.89 0.00 30 I 7.09 3.68 1.45 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.24 0.66 0.00 0.00 31 L 7.23 4.83 0.00 1.51 1.52 0.49 1.26 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 32 T 8.68 3.92 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 1.27 0.00 0.00 33 D 8.59 4.37 0.00 2.64 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 34 S 7.94 4.26 0.00 3.89 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 35 E 8.18 4.25 0.00 2.26 2.13 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 2.41 2.40 0.00 36 L 7.62 3.96 0.00 1.90 1.61 0.93 1.10 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 37 E 7.82 3.91 0.00 2.10 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 2.33 2.35 0.00 38 Q 8.00 3.98 0.00 2.21 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.82 0.00 0.00 0.00 0.00 0.00 2.54 2.52 0.00 39 F 7.99 2.88 0.00 2.72 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 40 H 8.37 4.02 0.00 3.21 3.25 0.00 5.72 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 A 7.36 4.09 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 42 S 6.79 4.10 0.00 3.61 3.51 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.45 4.43 0.00 1.74 1.76 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.94 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.30 1.38 7.81 44 Q 7.94 4.60 0.00 2.11 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.81 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 45 Q 7.94 4.02 0.00 1.92 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.89 0.00 0.00 0.00 0.00 0.00 1.66 2.17 0.00 46 G 8.16 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 47 R 8.03 3.99 0.00 1.94 2.03 0.00 3.15 0.00 0.00 3.28 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.72 0.00 48 F 8.53 4.04 0.00 3.34 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 L 8.90 4.19 0.00 2.16 1.93 0.68 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 50 A 8.42 4.12 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 51 K 8.07 4.00 0.00 1.92 1.81 0.00 1.64 0.00 0.00 1.65 0.00 0.00 3.05 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.47 1.60 7.81 52 R 7.84 3.88 0.00 1.98 1.98 0.00 3.25 0.00 0.00 2.96 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.78 0.00 53 F 8.75 3.97 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 54 A 8.57 4.69 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 55 A 8.07 3.86 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 56 K 8.17 3.47 0.00 1.91 1.80 0.00 1.87 0.00 0.00 2.17 0.00 0.00 3.13 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.50 1.72 7.81 57 E 8.07 3.59 0.00 2.00 1.81 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 1.88 1.71 0.00 58 A 8.00 3.86 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 59 A 7.77 3.81 0.94 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 0.00 0.00 60 S 7.60 4.16 0.00 4.09 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 61 K 7.99 3.94 0.00 1.93 1.84 0.00 1.75 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.40 1.52 7.81 62 A 8.04 4.25 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 63 L 7.71 4.14 0.00 1.91 1.78 1.05 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 64 G 8.18 4.01 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 0.00 0.00 0.00 65 T 7.55 4.29 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 1.21 0.00 0.00 66 G 7.82 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 67 I 7.80 3.86 1.65 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 -0.16 0.64 0.00 0.00 68 A 8.37 4.21 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 69 Q 9.94 3.54 0.00 2.17 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.53 0.00 0.00 0.00 0.00 0.00 2.25 2.26 0.00 70 G 8.47 3.92 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 0.00 0.00 0.00 71 V 7.75 3.96 2.33 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 1.04 0.00 0.00 0.90 0.00 0.00 72 T 8.16 4.88 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 1.24 0.00 0.00 73 F 8.66 4.31 0.00 3.22 3.34 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 74 H 7.82 4.68 0.00 3.16 3.34 0.00 5.65 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 D 8.33 4.36 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 0.00 0.00 0.00 76 F 7.86 5.29 0.00 2.96 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 77 T 8.99 4.82 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 1.24 0.00 0.00 78 I 8.98 4.77 1.85 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 1.19 0.37 0.79 0.00 0.00 79 S 9.08 4.95 0.00 3.66 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 80 H 8.53 5.48 0.00 2.96 3.16 0.00 5.89 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 D 8.87 4.71 0.00 2.91 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 82 K 8.62 3.83 0.00 1.75 1.91 0.00 1.77 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.44 1.49 7.81 83 L 8.20 4.33 0.00 1.79 1.70 0.93 0.87 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 84 G 8.23 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 85 K 8.12 4.23 0.00 1.87 2.04 0.00 1.73 0.00 0.00 1.88 0.00 0.00 2.96 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.52 1.46 7.81 86 P 0.00 4.82 0.00 2.06 2.01 0.00 3.77 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.00 0.00 87 L 9.12 4.84 0.00 1.51 1.54 0.92 0.64 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 88 L 8.56 5.14 0.00 1.61 1.54 1.09 1.01 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 89 I 8.83 4.62 1.88 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 1.23 0.57 0.90 0.00 0.00 90 L 8.53 5.07 0.00 1.46 1.45 0.93 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 91 S 8.49 4.30 0.00 3.76 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 92 G 8.75 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 0.00 0.00 0.00 93 Q 8.54 3.94 0.00 2.12 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.86 0.00 0.00 0.00 0.00 0.00 2.55 2.43 0.00 94 A 7.86 3.83 0.89 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 0.00 0.00 95 A 7.73 3.85 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 96 E 7.96 3.82 0.00 2.09 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 2.28 2.38 0.00 97 L 8.08 3.96 0.00 1.91 1.70 0.90 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 98 A 8.21 4.01 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 99 S 8.28 3.99 0.00 3.95 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 0.00 100 Q 7.91 3.99 0.00 2.21 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.71 0.00 0.00 0.00 0.00 0.00 2.38 2.62 0.00 101 L 7.81 4.25 0.00 1.76 1.70 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 102 Q 8.33 3.61 0.00 2.27 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.93 6.99 0.00 0.00 0.00 0.00 0.00 2.26 2.43 0.00 103 V 7.98 3.95 2.16 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 0.79 0.00 0.00 0.97 0.00 0.00 104 E 9.24 4.73 0.00 1.91 1.92 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 2.20 2.43 0.00 105 N 8.03 5.24 0.00 2.65 2.54 0.00 0.00 6.94 7.28 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 0.00 106 I 8.30 4.88 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 1.34 0.59 0.92 0.00 0.00 107 H 9.30 5.02 0.00 3.01 3.14 0.00 5.56 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 L 8.50 5.20 0.00 1.55 1.46 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 109 S 9.16 4.85 0.00 3.89 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 0.00 110 I 8.29 5.07 1.87 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.77 0.90 0.00 0.00 111 S 8.44 4.70 0.00 3.80 3.65 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 0.00 0.00 0.00 0.00 112 D 8.36 5.08 0.00 2.93 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.61 4.81 0.00 2.05 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 2.29 2.40 0.00 114 R 8.94 4.00 0.00 1.73 1.81 0.00 3.16 0.00 0.00 3.18 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.66 0.00 115 H 8.57 4.55 0.00 2.97 2.54 0.00 5.75 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 Y 7.93 5.29 0.00 2.95 2.86 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 0.00 117 A 9.22 5.53 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 *119 A 8.21 4.56 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 0.00 120 T 8.59 5.14 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 1.22 0.00 0.00 121 V 8.89 4.93 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 1.01 0.00 0.00 0.87 0.00 0.00 122 I 8.94 5.04 1.91 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 1.23 0.70 0.93 0.00 0.00 123 L 8.85 5.26 0.00 1.58 1.56 0.96 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 124 E 9.19 5.10 0.00 2.00 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 2.37 2.25 0.00 125 R 8.99 5.16 0.00 1.94 1.98 0.00 2.67 0.00 0.00 2.25 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.45 0.00 126 R 7.50 5.06 0.00 1.97 2.03 0.00 2.67 0.00 0.00 3.92 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 * Residues marked with a * may have inaccurate shift predictions.