NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 T 4.2380 8.1744 110.9425 61.2225 70.3468 173.0370 8 D 4.3030 8.4980 125.2258 51.4297 41.2886 174.4662 9 P 4.4135 0.0000 0.0000 65.4281 32.4384 177.0768 10 R 4.1568 8.5650 116.8484 57.1381 30.4652 176.7430 11 A 4.2389 7.5142 120.4151 51.0140 19.0132 177.1663 12 K 3.9359 8.5425 120.8847 56.3241 32.6122 176.5982 13 W 4.2381 8.9160 135.0000 57.3341 31.2011 175.0954 14 V 4.1036 7.6359 125.2306 60.0451 32.3540 173.2835 15 P 4.0067 0.0000 0.0000 62.2510 32.1933 175.3549 16 Q 4.6632 8.5709 116.8896 54.7228 31.9023 174.1427 17 D 5.5077 8.5232 115.7637 54.1802 41.5043 175.3635 18 N 5.0009 9.3822 113.1094 52.0705 38.8243 174.1132 19 D 4.3487 8.0536 119.8178 53.4685 42.6578 175.2765 20 I 2.9987 7.9677 120.7194 62.3837 37.9489 176.5942 21 Q 4.2569 8.3857 119.1899 55.9969 29.3075 175.2501 22 A 4.7633 7.4570 121.5323 50.5836 20.5703 177.8222 23 C 4.7071 8.9085 118.3092 59.0702 41.6171 174.2872 24 D 5.0122 8.1205 118.8616 52.9341 39.5624 175.2820 25 Y 4.7662 8.1535 122.3174 57.4450 39.2689 176.6706 26 W 4.5981 8.5357 125.1334 59.9376 27.9928 177.6550 27 R 3.3866 5.8400 115.3224 57.7872 29.8366 176.3166 28 H 5.1896 8.2845 115.8982 55.9276 28.9705 174.4975 29 C 3.0683 8.3126 116.9467 57.1107 42.4055 174.2040 30 S 4.8024 7.7459 114.5620 56.8545 62.4251 173.7550 31 I 3.3743 7.3311 117.6128 60.0245 39.3653 174.0943 32 D 4.7659 8.7243 126.1793 53.1911 44.4269 172.2703 33 G 4.2407 7.9603 115.3424 44.4448 0.0000 175.8355 34 N 5.4151 9.6369 122.6364 50.8826 42.3372 173.3848 35 I 4.2619 8.2320 122.9589 60.9558 37.6196 176.5925 36 C 4.1816 8.6462 124.1989 59.9821 34.6182 175.8650 37 D 4.1685 8.0932 118.3689 56.8758 40.8929 177.6835 38 C 4.7598 8.1324 114.8257 57.3674 40.3506 173.7581 39 S 4.6186 8.3125 114.0130 58.2203 63.3819 175.0032 40 G 4.0382 8.7327 108.6643 45.9767 0.0000 174.3646 41 G 4.2140 7.5096 110.7282 44.8383 0.0000 171.3611 42 S 5.0656 8.1756 115.4113 56.4756 66.2421 173.2945 43 L 4.0393 8.6941 120.8043 58.0765 41.6533 178.4909 44 T 4.6932 7.8049 104.0153 60.9562 69.7938 172.9091 45 N 5.0719 7.9151 119.1035 51.7051 41.8017 173.2955 46 C 4.7921 8.3755 117.8322 55.6451 37.0428 172.2199 47 P 4.7405 0.0000 0.0000 60.9137 31.7046 174.4538 48 P 4.1971 0.0000 0.0000 64.1865 31.6659 177.0579 49 G 4.0197 8.8849 110.5117 45.3568 0.0000 173.5715 50 T 4.3372 6.7230 109.2885 60.6469 70.8733 174.2303 51 K 4.5789 8.7700 121.5182 54.4095 34.8391 175.4702 52 L 4.4902 8.4307 126.9520 54.4211 43.0854 175.9648 53 A 4.5978 8.6691 128.8747 52.3535 19.2252 176.8045 54 T 4.4012 8.6776 108.9710 62.8519 71.0657 175.3480 55 A 4.7698 8.0400 123.4842 51.3874 20.7874 177.6073 56 S 3.9236 7.1905 116.6957 58.5515 66.2653 177.8555 *58 V 4.4778 8.6863 113.6035 61.6673 32.7382 173.4295 59 A 4.7595 8.1926 120.2161 51.3023 22.5243 175.3999 60 S 5.0617 8.7722 115.8646 57.5939 63.3251 173.8804 61 C 5.2981 9.4653 125.7801 55.3311 41.4054 172.6380 62 Y 4.6434 8.9785 124.7394 57.3334 40.1105 173.3546 63 N 3.5919 8.3613 126.8193 50.8111 39.3255 173.8939 64 P 4.0468 0.0000 0.0000 65.3320 31.9321 178.1480 65 T 3.8760 7.8815 116.3919 66.1747 68.2925 175.1092 66 D 4.6180 7.5833 116.3732 52.1673 39.8903 176.3221 67 G 3.8042 7.6193 106.7540 46.3779 0.0000 173.5409 68 Q 4.5758 8.0988 118.4829 54.0772 31.8783 174.5544 69 S 5.3014 8.1770 116.7184 57.2222 65.4312 172.8878 70 Y 5.1538 9.2173 121.9797 55.9843 41.6855 174.5007 71 L 4.8529 9.2730 125.1632 54.6645 43.7268 175.2894 72 I 4.6198 8.8994 127.7079 59.5702 39.4860 174.6868 73 A 4.2798 8.1528 129.3961 50.4745 19.4213 176.8009 74 Y 4.7142 8.0254 120.5708 57.9788 36.0879 175.2787 75 R 4.4258 8.0394 121.5510 55.7445 32.3868 175.3835 76 D 5.3257 8.6119 121.9134 53.4448 43.9825 174.6078 77 C 5.2325 8.8067 118.6667 55.7639 39.0480 172.6437 78 C 5.8194 8.9455 120.7991 54.3743 44.2621 174.8600 79 G 4.0640 9.2295 105.4686 46.0476 0.0000 172.8982 80 Y 4.7329 7.4208 114.5262 55.6316 41.9791 174.6089 81 N 4.6050 8.4881 120.4333 52.8256 39.8254 175.1495 82 V 3.9646 8.6078 121.5799 61.2129 31.7427 176.4814 83 S 4.1282 8.2991 118.5223 59.9495 62.8037 175.8786 84 G 3.9732 7.7674 106.2162 45.0942 0.0000 173.0314 85 R 4.5417 7.6307 118.0414 55.5313 33.3443 175.2368 86 C 4.3129 8.6852 117.0510 57.5685 37.6054 171.1342 87 P 5.1153 0.0000 0.0000 63.2223 32.6360 178.2673 88 C 4.9905 9.2284 118.5839 55.8881 45.4360 173.3671 89 L 4.8750 8.3741 123.7926 54.2805 43.6840 174.4830 90 N 5.0900 9.0537 124.0826 50.9345 42.9615 174.7056 91 T 4.7299 7.5288 109.3426 60.9377 68.9668 174.0066 92 E 3.8679 8.2771 122.7937 58.6274 29.5052 177.8443 93 G 3.7511 8.8139 111.8160 45.4377 0.0000 172.2272 94 E 4.3046 7.8339 121.4560 56.1076 29.8901 176.2667 95 L 4.7666 8.1531 126.1443 52.0534 44.7671 174.3324 96 P 4.4955 0.0000 0.0000 62.3426 32.0646 178.0770 97 V 3.6272 8.5281 120.5597 64.8442 31.1324 176.6853 98 Y 4.5058 7.7852 116.1190 57.6732 38.8728 175.6347 99 R 4.7114 7.7991 119.2583 53.8629 30.8535 174.1412 100 P 4.4827 0.0000 0.0000 65.8101 31.7612 179.0584 101 E 3.7106 8.1853 115.6785 58.3481 29.4734 177.4876 102 F 5.1064 8.3077 116.1278 56.8759 39.9079 173.8253 103 A 5.0936 8.1965 124.9615 51.2010 19.5887 177.5847 104 N 5.0898 9.2367 119.8855 52.8232 37.5569 175.4853 105 D 4.7529 7.8465 118.2389 55.0757 41.6628 177.0864 106 I 3.4588 7.2292 120.0306 60.7843 37.4641 175.9442 107 I 3.8022 7.6189 125.6210 60.5263 36.4725 176.9236 108 W 4.7570 8.5301 130.5779 55.8431 27.5907 176.7966 109 C 4.8467 7.2626 114.7060 56.2360 37.1873 174.4883 110 F 4.5558 7.5262 119.8627 59.4154 38.8897 176.2676 111 G 4.4385 9.4132 112.3953 46.3946 0.0000 173.7071 112 A 4.5784 7.7160 122.5415 51.0732 19.1965 176.8285 113 E 3.9611 8.6122 121.6136 57.6578 30.2504 176.7813 114 D 4.5728 9.1206 121.7527 54.8068 38.3355 173.3705 115 D 4.4048 7.8799 114.6692 54.8730 39.0255 173.9370 116 A 4.1010 7.7396 121.3283 53.0167 18.5574 178.3339 117 M 4.6728 8.4913 120.4281 54.6996 34.2734 175.7854 118 T 4.3087 7.6329 110.2373 61.4127 70.7858 172.9127 119 Y 4.4982 8.5706 125.1753 57.5802 40.1348 173.7620 120 H 4.7616 8.0106 125.1616 57.0934 32.1658 171.2825 121 C 4.9498 6.7553 109.7241 55.0102 39.4551 171.7811 122 T 5.3353 9.1128 115.8583 61.7845 71.2491 173.9189 123 I 4.5783 8.4806 118.5869 59.0888 40.5692 175.0244 124 S 4.9646 8.2959 117.4327 56.5800 61.8326 172.4190 125 P 4.5239 0.0000 0.0000 62.2895 33.6357 177.0020 126 I 4.6005 8.1310 122.5715 61.1209 37.7467 176.0638 127 V 4.2847 9.6650 119.1006 60.3335 33.1922 175.6928 128 G 4.1826 7.5542 108.4067 45.8955 0.0000 171.5204 129 K 4.5232 8.3306 119.1777 55.6871 32.7597 177.9509 130 A 4.8409 8.5514 127.6544 52.0585 19.9434 177.1950 131 S 4.3858 8.6426 110.9970 59.4266 63.2081 174.0235 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 7 T 8.17 4.24 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 8 D 8.50 4.30 0.00 2.83 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 9 P 0.00 4.41 0.00 2.25 2.21 0.00 3.83 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.01 0.00 10 R 8.56 4.16 0.00 1.97 2.04 0.00 3.17 0.00 0.00 3.24 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.59 0.00 11 A 7.51 4.24 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 12 K 8.54 3.94 0.00 1.76 1.79 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.51 1.51 7.81 13 W 8.92 4.24 0.00 3.29 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 14 V 7.64 4.10 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 0.83 0.00 0.00 0.94 0.00 0.00 15 P 0.00 4.01 0.00 2.24 1.82 0.00 3.67 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.18 0.00 16 Q 8.57 4.66 0.00 2.29 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 7.00 0.00 0.00 0.00 0.00 0.00 2.38 2.44 0.00 17 D 8.52 5.51 0.00 2.60 2.65 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 18 N 9.38 5.00 0.00 2.79 2.88 0.00 0.00 6.51 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 19 D 8.05 4.35 0.00 2.67 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 20 I 7.97 3.00 1.31 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.54 0.14 0.00 0.00 21 Q 8.39 4.26 0.00 2.16 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.72 0.00 0.00 0.00 0.00 0.00 2.32 2.24 0.00 22 A 7.46 4.76 1.38 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 0.00 0.00 23 C 8.91 4.71 0.00 3.13 3.35 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 24 D 8.12 5.01 0.00 2.61 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 25 Y 8.15 4.77 0.00 3.37 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 26 W 8.54 4.60 0.00 3.69 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 27 R 5.84 3.39 0.00 1.36 1.52 0.00 2.96 0.00 0.00 2.82 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 28 H 8.28 5.19 0.00 3.55 3.36 0.00 5.63 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 C 8.31 3.07 0.00 2.52 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 S 7.75 4.80 0.00 3.81 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 31 I 7.33 3.37 1.81 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 1.06 1.39 0.90 0.00 0.00 32 D 8.72 4.77 0.00 2.79 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 0.00 0.00 0.00 33 G 7.96 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 0.00 0.00 0.00 0.00 34 N 9.64 5.42 0.00 2.70 2.82 0.00 0.00 7.39 7.29 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 35 I 8.23 4.26 1.86 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 1.13 0.79 0.93 0.00 0.00 36 C 8.65 4.18 0.00 2.93 3.11 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 37 D 8.09 4.17 0.00 2.71 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 38 C 8.13 4.76 0.00 3.11 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 39 S 8.31 4.62 0.00 3.99 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 40 G 8.73 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 0.00 0.00 0.00 41 G 7.51 4.21 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 0.00 42 S 8.18 5.07 0.00 3.90 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 43 L 8.69 4.04 0.00 1.66 1.67 0.91 0.59 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 44 T 7.80 4.69 4.21 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 1.17 0.00 0.00 45 N 7.92 5.07 0.00 2.76 2.67 0.00 0.00 7.00 7.32 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 46 C 8.38 4.79 0.00 2.90 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 47 P 0.00 4.74 0.00 1.94 2.06 0.00 3.74 0.00 0.00 3.65 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 48 P 0.00 4.20 0.00 2.00 1.96 0.00 3.62 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.05 0.00 49 G 8.88 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 50 T 6.72 4.34 4.09 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 0.29 0.00 0.00 51 K 8.77 4.58 0.00 1.62 1.73 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.80 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.37 1.66 7.81 52 L 8.43 4.49 0.00 1.75 1.53 0.92 0.99 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 53 A 8.67 4.60 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.68 4.40 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 1.29 0.00 0.00 55 A 8.04 4.77 1.49 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 0.00 0.00 0.00 0.00 0.00 0.00 56 S 7.19 3.92 0.00 3.96 3.31 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 *58 V 8.69 4.48 2.18 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 0.91 0.00 0.00 0.99 0.00 0.00 59 A 8.19 4.76 1.44 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 0.00 0.00 0.00 60 S 8.77 5.06 0.00 3.95 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 61 C 9.47 5.30 0.00 3.26 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 62 Y 8.98 4.64 0.00 3.15 2.99 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 63 N 8.36 3.59 0.00 1.44 2.25 0.00 0.00 6.56 7.52 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 64 P 0.00 4.05 0.00 2.13 2.15 0.00 3.12 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.89 0.00 65 T 7.88 3.88 4.14 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 1.13 0.00 0.00 66 D 7.58 4.62 0.00 2.68 2.65 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 67 G 7.62 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 68 Q 8.10 4.58 0.00 1.85 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.32 6.73 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 69 S 8.18 5.30 0.00 3.75 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 70 Y 9.22 5.15 0.00 3.27 2.99 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 71 L 9.27 4.85 0.00 1.79 1.59 1.08 1.00 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 72 I 8.90 4.62 1.42 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.08 0.14 0.00 0.00 73 A 8.15 4.28 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 74 Y 8.03 4.71 0.00 2.95 3.01 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 75 R 8.04 4.43 0.00 1.79 1.87 0.00 3.08 0.00 0.00 3.31 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.78 0.00 76 D 8.61 5.33 0.00 2.87 2.65 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 77 C 8.81 5.23 0.00 2.73 2.87 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 0.00 0.00 0.00 78 C 8.95 5.82 0.00 2.79 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 79 G 9.23 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 80 Y 7.42 4.73 0.00 2.63 2.74 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 81 N 8.49 4.61 0.00 2.64 2.73 0.00 0.00 7.02 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 82 V 8.61 3.96 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 0.99 0.00 0.00 1.11 0.00 0.00 83 S 8.30 4.13 0.00 3.98 3.67 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 0.00 0.00 0.00 0.00 84 G 7.77 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 0.00 0.00 0.00 85 R 7.63 4.54 0.00 1.80 1.82 0.00 3.33 0.00 0.00 3.47 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.71 0.00 86 C 8.69 4.31 0.00 3.10 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 87 P 0.00 5.12 0.00 2.08 2.06 0.00 3.78 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.01 0.00 88 C 9.23 4.99 0.00 2.83 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 89 L 8.37 4.87 0.00 1.52 1.48 0.84 0.86 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 N 9.05 5.09 0.00 2.37 2.06 0.00 0.00 6.18 6.97 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 91 T 7.53 4.73 4.16 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 1.17 0.00 0.00 92 E 8.28 3.87 0.00 1.90 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 1.95 2.21 0.00 93 G 8.81 3.75 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 0.00 0.00 0.00 94 E 7.83 4.30 0.00 1.96 1.83 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 2.59 2.58 0.00 95 L 8.15 4.77 0.00 1.59 1.45 0.96 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 96 P 0.00 4.50 0.00 1.41 2.01 0.00 3.28 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.06 0.00 97 V 8.53 3.63 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 0.83 0.00 0.00 0.95 0.00 0.00 98 Y 7.79 4.51 0.00 3.11 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 99 R 7.80 4.71 0.00 1.78 1.90 0.00 3.39 0.00 0.00 3.34 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.56 0.00 100 P 0.00 4.48 0.00 2.51 2.49 0.00 3.80 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.07 0.00 101 E 8.19 3.71 0.00 1.52 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 1.47 1.47 0.00 102 F 8.31 5.11 0.00 3.10 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 0.00 103 A 8.20 5.09 1.44 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 0.00 0.00 0.00 104 N 9.24 5.09 0.00 2.79 2.90 0.00 0.00 7.01 8.38 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 0.00 105 D 7.85 4.75 0.00 2.61 2.67 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 0.00 0.00 0.00 0.00 106 I 7.23 3.46 0.84 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.28 -0.30 0.00 0.00 107 I 7.62 3.80 1.62 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.64 0.93 0.00 0.00 108 W 8.53 4.76 0.00 3.65 3.31 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 0.00 109 C 7.26 4.85 0.00 2.75 3.20 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 0.00 110 F 7.53 4.56 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 0.00 111 G 9.41 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 0.00 0.00 0.00 0.00 112 A 7.72 4.58 1.38 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 0.00 0.00 113 E 8.61 3.96 0.00 2.02 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 2.39 2.35 0.00 114 D 9.12 4.57 0.00 2.89 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 0.00 115 D 7.88 4.40 0.00 2.86 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 0.00 116 A 7.74 4.10 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 0.00 117 M 8.49 4.67 0.00 1.88 2.01 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.58 0.00 118 T 7.63 4.31 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 1.22 0.00 0.00 119 Y 8.57 4.50 0.00 3.13 2.90 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 0.00 120 H 8.01 4.76 0.00 3.25 3.23 0.00 5.87 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 C 6.76 4.95 0.00 3.12 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 0.00 122 T 9.11 5.34 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 1.55 0.00 0.00 123 I 8.48 4.58 1.97 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 1.45 0.91 0.90 0.00 0.00 124 S 8.30 4.96 0.00 3.75 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 0.00 125 P 0.00 4.52 0.00 2.05 2.11 0.00 3.78 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.93 0.00 126 I 8.13 4.60 1.85 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.42 1.06 0.00 0.00 127 V 9.66 4.28 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 0.61 0.00 0.00 1.00 0.00 0.00 128 G 7.55 4.18 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 0.00 129 K 8.33 4.52 0.00 1.61 1.64 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.79 0.00 0.00 2.75 0.00 0.00 0.00 0.00 0.91 1.27 7.81 130 A 8.55 4.84 1.19 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 0.00 0.00 0.00 0.00 0.00 0.00 131 S 8.64 4.39 0.00 3.86 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 * Residues marked with a * may have inaccurate shift predictions.