NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 L 4.2718 8.1693 122.4907 54.5626 43.3539 177.4305 11 E 4.2241 8.7123 112.8516 54.5384 31.7968 175.8721 12 R 4.0416 9.2230 121.2722 56.6215 31.6276 177.6373 13 S 4.8746 8.4436 117.3502 56.6016 66.3243 173.2843 14 L 4.8231 8.0685 121.3811 53.4779 44.3147 176.9014 15 N 4.8737 8.1606 119.3072 52.9654 39.9938 172.8268 16 R 4.9899 8.2627 121.8150 53.8127 34.3323 174.6125 17 V 4.4156 8.7915 122.0322 61.4025 34.9330 173.6450 18 H 5.1792 8.8550 124.3106 54.0544 30.7900 173.6773 19 L 4.8126 8.3942 122.3649 52.8832 46.2431 175.3357 20 L 5.0278 8.2304 123.2749 53.7515 45.2331 175.9031 21 G 3.9440 8.1313 112.2511 46.0184 0.0000 170.7995 22 R 5.0029 7.6547 117.8751 54.0978 32.4610 176.4364 23 V 4.1555 8.8258 124.8896 63.7146 32.1484 176.6188 24 G 4.6271 9.4845 114.6336 47.3045 0.0000 173.0920 25 Q 4.7278 7.7908 116.1302 55.0655 30.9957 173.4424 26 D 4.4414 8.5429 119.2522 53.3308 41.3668 174.8740 27 P 4.8948 0.0000 0.0000 63.6463 32.2449 175.5559 28 V 4.6620 8.8050 120.3643 61.1773 34.2785 174.6945 29 L 4.4539 8.7391 127.9923 54.6050 42.8467 176.9343 30 R 4.3783 9.5701 122.7047 54.6674 32.8864 174.1427 31 Q 4.7756 8.5517 125.2388 54.6179 29.4358 174.6700 32 V 3.9849 8.2742 116.7595 62.9858 32.2473 177.2527 33 E 3.9877 7.4473 119.5928 56.4371 30.3124 175.2019 34 G 3.2982 6.9557 112.2484 45.5657 0.0000 172.6415 35 K 4.5565 7.5716 123.6479 56.5367 33.1857 176.9956 36 N 4.8213 8.6912 117.4662 50.2599 38.2173 173.2862 37 P 4.7558 0.0000 0.0000 62.5114 32.4468 176.0072 38 V 4.2201 8.4803 122.1327 61.3421 34.9918 174.3349 39 T 4.8990 8.1653 124.5681 62.8303 70.2496 173.7853 40 I 5.0933 9.2506 127.1153 59.4736 40.8989 174.6707 41 F 5.4187 8.5172 120.8339 55.7574 42.1836 173.0489 42 S 5.4565 9.0029 112.7194 56.5740 66.4232 172.6159 43 L 5.1625 8.7428 122.3061 53.3813 44.6201 174.9533 44 A 4.1815 8.6567 128.2579 50.6995 21.0911 175.9653 45 T 4.6801 8.1725 117.1157 61.8061 72.7558 172.6641 46 N 5.2380 8.8140 123.5731 51.8584 40.3439 173.9904 47 E 4.7302 9.3496 124.6099 54.8612 31.9044 175.0031 48 M 5.3898 8.7253 123.9880 53.6665 35.3214 173.9884 49 W 5.1807 8.7241 122.9185 54.6757 31.7651 174.3066 50 R 4.8796 8.7999 122.8733 55.6935 31.0952 175.9999 51 S 3.6074 8.0263 120.8117 59.4020 60.4521 171.1171 *61 D 4.1986 7.3919 120.4382 54.0874 42.3792 174.9072 62 V 3.8911 7.4790 118.9893 61.3003 32.3340 172.0822 63 S 4.4221 7.9049 122.7620 56.5323 64.8308 173.6854 64 Q 4.7217 8.4878 124.1630 54.9993 30.1677 175.4167 65 K 4.7326 9.3750 123.5920 55.2915 36.2730 174.6964 66 T 5.0342 8.6551 122.7560 62.0829 71.4696 173.2446 67 T 4.5459 9.0333 123.2698 61.6701 70.8404 173.4150 68 W 4.9238 8.8415 126.3869 55.5103 30.8470 175.2058 69 H 4.9420 8.9816 122.1354 54.0145 31.3777 173.8451 70 R 4.3644 8.5273 122.9118 55.3249 31.3805 174.6857 71 I 4.5040 8.6959 128.8681 59.9551 39.0663 175.0798 72 S 4.9721 8.5615 123.4478 56.4751 65.6135 173.6889 73 V 4.4707 8.2352 123.2409 60.2092 32.9771 176.2474 74 F 4.3476 8.9536 124.9124 59.0891 39.9428 176.8989 75 R 3.8827 8.2792 119.8816 55.7338 30.0923 173.7533 76 P 4.3486 0.0000 0.0000 64.8046 30.8358 174.7165 77 G 4.2209 8.0813 115.9210 45.9993 0.0000 175.3208 78 L 4.0330 8.0626 121.2153 56.9309 42.2601 179.4664 79 R 3.9374 7.9666 118.6746 59.6775 30.0624 178.2668 80 D 4.4449 8.0123 118.0006 57.2938 40.9422 178.7559 81 V 3.8696 8.2671 118.7263 66.2229 31.6605 177.7440 82 A 4.2736 8.6122 120.9464 55.5747 17.9442 179.0808 83 Y 4.0548 8.1266 117.1085 61.0491 39.0485 177.6384 84 Q 3.8132 8.0533 117.4303 57.8946 28.9211 176.5316 85 Y 4.5159 7.8484 116.0650 58.6284 39.1918 176.4762 86 V 4.1877 7.6692 112.8458 60.2533 32.2321 175.0338 87 K 4.5773 8.0292 122.9682 53.7690 35.6432 174.8819 88 K 4.2931 8.1634 122.2377 56.9235 32.4011 175.5357 89 G 4.1649 8.7059 116.8268 46.1842 0.0000 174.8736 90 S 4.1864 7.8207 115.4499 59.1528 64.0393 174.2764 91 R 4.6911 8.6573 124.6921 56.1320 31.5614 174.7187 92 I 4.8318 8.7515 124.6342 59.9593 42.2720 172.3556 93 Y 5.3831 8.8926 128.6987 55.7698 41.6400 174.3184 94 L 5.4593 8.0645 124.8935 53.9254 44.9058 174.4794 95 E 5.3410 7.7660 117.4715 54.0165 33.7994 175.4438 96 G 4.3069 8.0097 108.5140 46.1831 0.0000 171.0199 97 K 5.0982 8.5067 118.2446 54.4888 35.4966 175.7768 98 I 4.2976 8.1939 124.9071 60.9979 38.2438 174.7919 99 D 4.6185 8.6772 126.0425 52.5826 44.0048 175.1569 100 Y 4.6646 8.4982 123.4733 56.9505 39.2796 176.1512 101 G 3.6298 8.8598 109.9478 48.3078 0.0000 173.8020 102 E 3.7920 8.0879 121.8043 56.1515 26.3040 172.4461 103 Y 4.8801 8.1736 118.3663 55.3005 41.2255 175.9816 104 M 4.3464 8.5598 123.6881 53.7196 30.6684 175.4176 105 D 4.5733 8.5366 121.5031 56.2354 43.1359 176.8737 106 K 4.1587 8.7456 118.3156 56.4753 32.9179 176.8953 107 N 4.4725 9.4923 113.1912 55.0454 39.3505 175.8646 108 N 4.8909 7.8732 122.9269 53.8951 40.2079 173.7346 109 V 3.5742 7.3476 118.7630 63.2059 30.7910 175.1211 110 R 4.8319 8.1128 123.1321 55.9735 31.2450 175.5903 111 R 4.5511 8.5776 119.0425 55.5123 33.6951 172.8600 112 Q 4.5751 8.0753 114.6120 55.5556 32.5671 175.6472 113 A 4.5473 8.1483 118.1529 52.0181 20.3596 174.0732 114 T 4.3336 8.1251 115.4997 61.5518 68.6626 173.8605 115 T 4.8560 8.7386 118.6979 59.8713 72.4508 172.9006 116 I 4.4784 8.1976 124.9477 60.5199 38.7347 174.7954 117 I 4.7476 8.3895 121.7444 58.9579 39.0013 175.0731 118 A 4.3949 8.5313 130.5909 51.9076 18.5427 176.5522 119 D 4.9512 8.9175 120.8663 52.8941 40.9728 175.6337 120 N 4.8746 7.7773 118.0437 52.9551 42.5489 172.8143 121 I 4.8265 8.4740 126.4711 59.6375 40.3436 174.6185 122 I 4.5003 9.0814 128.6614 59.5378 39.4991 174.7866 123 F 4.6369 8.9689 126.0745 56.6851 39.8434 176.2674 124 L 4.4878 8.1990 124.1760 53.4348 40.7378 177.3420 125 S 4.1953 8.0478 118.2740 58.5649 63.9738 174.2291 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 10 L 8.17 4.27 0.00 1.60 1.51 0.92 0.63 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 11 E 8.71 4.22 0.00 2.19 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 2.25 2.39 0.00 12 R 9.22 4.04 0.00 1.82 1.92 0.00 3.15 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 13 S 8.44 4.87 0.00 3.81 3.73 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 14 L 8.07 4.82 0.00 1.59 1.53 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 15 N 8.16 4.87 0.00 2.69 2.67 0.00 0.00 6.81 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 16 R 8.26 4.99 0.00 1.66 1.78 0.00 3.36 0.00 0.00 3.16 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.54 0.00 17 V 8.79 4.42 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 0.90 0.00 0.00 0.87 0.00 0.00 18 H 8.86 5.18 0.00 2.97 3.18 0.00 5.72 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 19 L 8.39 4.81 0.00 1.36 1.32 0.72 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 20 L 8.23 5.03 0.00 1.77 1.55 0.96 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 21 G 8.13 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 0.00 0.00 0.00 22 R 7.65 5.00 0.00 1.74 1.86 0.00 3.16 0.00 0.00 3.46 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.58 0.00 23 V 8.83 4.16 2.22 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 1.02 0.00 0.00 0.84 0.00 0.00 24 G 9.48 4.63 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 0.00 0.00 0.00 25 Q 7.79 4.73 0.00 2.17 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.87 0.00 0.00 0.00 0.00 0.00 2.35 2.48 0.00 26 D 8.54 4.44 0.00 2.67 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 27 P 0.00 4.89 0.00 2.36 2.26 0.00 3.65 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 2.12 0.00 28 V 8.80 4.66 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 1.01 0.00 0.00 1.01 0.00 0.00 29 L 8.74 4.45 0.00 1.12 1.32 0.52 0.67 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 30 R 9.57 4.38 0.00 1.65 1.81 0.00 3.22 0.00 0.00 3.08 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.66 0.00 31 Q 8.55 4.78 0.00 1.95 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.90 0.00 0.00 0.00 0.00 0.00 2.21 2.41 0.00 32 V 8.27 3.98 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 0.74 0.00 0.00 0.94 0.00 0.00 33 E 7.45 3.99 0.00 1.93 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 2.29 2.31 0.00 34 G 6.96 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.57 4.56 0.00 1.85 1.70 0.00 1.65 0.00 0.00 1.83 0.00 0.00 3.18 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.41 1.58 7.81 36 N 8.69 4.82 0.00 2.90 2.89 0.00 0.00 5.89 7.75 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 37 P 0.00 4.76 0.00 1.95 1.98 0.00 3.66 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 38 V 8.48 4.22 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 0.00 0.00 0.93 0.00 0.00 39 T 8.17 4.90 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 1.61 0.00 0.00 40 I 9.25 5.09 1.87 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.81 0.89 0.00 0.00 41 F 8.52 5.42 0.00 3.09 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 42 S 9.00 5.46 0.00 4.33 4.17 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 43 L 8.74 5.16 0.00 1.80 1.54 0.89 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 44 A 8.66 4.18 0.05 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 0.00 0.00 45 T 8.17 4.68 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 1.29 0.00 0.00 46 N 8.81 5.24 0.00 2.54 2.75 0.00 0.00 6.99 7.66 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 47 E 9.35 4.73 0.00 1.97 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 2.27 2.31 0.00 48 M 8.73 5.39 0.00 1.99 2.08 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 2.41 2.47 0.00 49 W 8.72 5.18 0.00 3.52 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 50 R 8.80 4.88 0.00 1.80 1.91 0.00 3.41 0.00 0.00 3.93 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.55 0.00 51 S 8.03 3.61 0.00 4.09 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 *61 D 7.39 4.20 0.00 2.64 2.61 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 62 V 7.48 3.89 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 0.62 0.00 0.00 0.84 0.00 0.00 63 S 7.90 4.42 0.00 2.72 3.28 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 64 Q 8.49 4.72 0.00 1.89 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.68 0.00 0.00 0.00 0.00 0.00 2.28 2.26 0.00 65 K 9.37 4.73 0.00 1.90 1.79 0.00 1.70 0.00 0.00 1.73 0.00 0.00 2.85 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.51 7.81 66 T 8.66 5.03 4.35 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 0.86 0.00 0.00 67 T 9.03 4.55 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 1.05 0.00 0.00 68 W 8.84 4.92 0.00 3.21 3.27 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 69 H 8.98 4.94 0.00 3.11 3.13 0.00 5.80 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 70 R 8.53 4.36 0.00 1.95 1.80 0.00 3.23 0.00 0.00 3.39 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 71 I 8.70 4.50 0.58 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 0.99 0.66 0.47 0.00 0.00 72 S 8.56 4.97 0.00 3.50 3.21 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 73 V 8.24 4.47 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 1.02 0.00 0.00 1.04 0.00 0.00 74 F 8.95 4.35 0.00 3.06 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 75 R 8.28 3.88 0.00 1.94 1.97 0.00 3.19 0.00 0.00 3.44 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.70 0.00 76 P 0.00 4.35 0.00 2.21 2.14 0.00 3.80 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.01 0.00 77 G 8.08 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 0.00 0.00 0.00 0.00 78 L 8.06 4.03 0.00 1.85 1.76 1.03 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 79 R 7.97 3.94 0.00 2.19 2.04 0.00 3.12 0.00 0.00 3.31 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 80 D 8.01 4.44 0.00 3.00 2.77 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 81 V 8.27 3.87 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 1.31 0.00 0.00 1.11 0.00 0.00 82 A 8.61 4.27 1.68 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 0.00 0.00 0.00 0.00 0.00 0.00 83 Y 8.13 4.05 0.00 3.13 3.19 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 84 Q 8.05 3.81 0.00 1.86 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.58 0.00 0.00 0.00 0.00 0.00 2.10 2.13 0.00 85 Y 7.85 4.52 0.00 2.98 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.67 4.19 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 0.67 0.00 0.00 0.32 0.00 0.00 87 K 8.03 4.58 0.00 1.75 1.60 0.00 1.57 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.37 1.41 7.81 88 K 8.16 4.29 0.00 1.83 1.73 0.00 1.88 0.00 0.00 1.75 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.50 1.46 7.81 89 G 8.71 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 0.00 0.00 0.00 0.00 90 S 7.82 4.19 0.00 3.94 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 91 R 8.66 4.69 0.00 1.91 1.80 0.00 3.19 0.00 0.00 3.28 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.63 0.00 92 I 8.75 4.83 1.81 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.87 0.88 0.00 0.00 93 Y 8.89 5.38 0.00 3.03 2.68 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 0.00 0.00 0.00 0.00 94 L 8.06 5.46 0.00 1.77 1.58 0.85 0.51 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 95 E 7.77 5.34 0.00 1.81 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 1.87 1.88 0.00 96 G 8.01 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 0.00 0.00 0.00 0.00 97 K 8.51 5.10 0.00 1.64 1.62 0.00 1.66 0.00 0.00 1.81 0.00 0.00 2.81 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.39 1.41 7.81 98 I 8.19 4.30 1.59 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 1.13 0.37 0.44 0.00 0.00 99 D 8.68 4.62 0.00 2.67 2.50 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.50 4.66 0.00 3.06 2.85 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 0.00 101 G 8.86 3.63 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 0.00 0.00 0.00 102 E 8.09 3.79 0.00 2.16 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 2.25 2.37 0.00 103 Y 8.17 4.88 0.00 3.05 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 0.00 104 M 8.56 4.35 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.60 0.00 105 D 8.54 4.57 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 0.00 106 K 8.75 4.16 0.00 1.71 1.53 0.00 1.89 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.36 1.38 7.81 107 N 9.49 4.47 0.00 2.85 2.89 0.00 0.00 6.74 8.00 0.00 0.00 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 N 7.87 4.89 0.00 2.75 2.88 0.00 0.00 6.80 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 0.00 109 V 7.35 3.57 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 0.97 0.00 0.00 1.03 0.00 0.00 110 R 8.11 4.83 0.00 1.94 2.00 0.00 3.02 0.00 0.00 3.12 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.57 0.00 111 R 8.58 4.55 0.00 1.74 1.29 0.00 3.05 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 1.44 1.44 0.00 112 Q 8.08 4.58 0.00 2.13 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.94 0.00 0.00 0.00 0.00 0.00 2.14 2.35 0.00 113 A 8.15 4.55 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 0.00 114 T 8.13 4.33 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 1.37 0.00 0.00 115 T 8.74 4.86 4.17 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 1.21 0.00 0.00 116 I 8.20 4.48 1.74 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.99 0.80 0.00 0.00 117 I 8.39 4.75 2.03 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.18 0.99 0.00 0.00 118 A 8.53 4.39 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 0.00 119 D 8.92 4.95 0.00 2.66 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 0.00 120 N 7.78 4.87 0.00 2.80 2.65 0.00 0.00 6.91 7.85 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 0.00 121 I 8.47 4.83 1.76 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.80 0.24 0.00 0.00 122 I 9.08 4.50 2.00 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 1.29 0.81 0.92 0.00 0.00 123 F 8.97 4.64 0.00 2.80 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 0.00 124 L 8.20 4.49 0.00 1.61 1.65 0.94 0.79 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 0.00 125 S 8.05 4.20 0.00 3.80 3.68 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 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.