NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 T 4.4496 8.1593 117.3748 63.7410 69.9409 172.6490 3 T 4.6662 8.2476 114.9865 58.6938 71.9569 173.4332 4 A 3.9971 8.7190 124.4774 55.2585 19.3584 181.3143 5 R 3.9704 7.9868 115.2497 59.4005 30.2695 177.6082 6 D 4.4680 7.7903 117.1614 56.1101 41.4786 176.5548 7 I 4.2560 7.1780 110.8557 59.5297 37.2995 177.0602 *9 N 4.3539 7.6895 116.9493 53.6393 39.0557 174.5962 10 A 4.5352 8.2671 125.8764 52.8645 19.3914 177.5587 11 G 3.8738 8.5575 108.3006 45.6740 0.0000 174.4158 12 V 3.6904 7.4227 118.4883 62.6506 32.1738 175.5325 13 T 4.1806 8.0627 122.6832 62.9446 69.3109 174.7576 14 C 4.4877 8.4356 126.5356 55.8089 43.8319 173.0979 15 V 3.7540 8.5384 127.1125 62.2867 32.6098 175.5208 16 G 4.0542 8.6393 115.0631 45.9983 0.0000 174.3923 17 E 4.0537 9.0371 121.9521 58.9192 29.6392 178.1054 18 H 4.8382 7.8619 114.1626 55.6034 29.4899 175.1105 19 E 4.2051 8.0621 121.0764 56.1684 30.0619 176.8920 20 T 4.7011 8.2033 112.7849 61.3071 71.2263 175.8104 21 L 4.0337 8.3128 121.0864 58.1032 41.5434 180.1031 22 T 3.8300 7.9695 115.7539 66.4290 68.4082 176.5675 23 A 4.0560 8.2648 123.8523 54.5334 18.1917 179.4567 24 A 4.2043 8.0385 118.0376 55.3956 18.5181 179.3564 25 A 4.1062 8.0311 118.4209 55.4383 18.3806 179.5437 26 Q 4.0694 7.8431 116.4378 59.0432 28.7118 179.2684 27 Y 4.2660 7.5050 116.7397 58.1125 38.0455 178.2549 *29 R 4.1522 8.1250 123.7280 57.1421 31.9932 177.5679 30 E 3.9339 8.2797 112.4242 59.1377 29.5274 179.3429 31 H 4.7378 8.2369 115.7061 55.1769 29.4399 175.2103 32 D 4.4636 7.6738 117.5499 54.5118 37.3916 177.8633 33 I 4.7427 7.6263 111.5109 59.6512 40.9993 175.4347 34 G 4.2271 8.5314 106.2135 45.9913 0.0000 172.4435 35 A 5.3424 7.7852 120.4560 50.4377 22.2692 176.0665 36 L 4.9228 8.9468 121.3739 52.1175 45.4539 174.7416 37 P 4.6050 0.0000 0.0000 62.6208 33.1636 174.8124 38 I 4.9354 8.9039 124.2092 59.7768 39.8852 174.0337 39 C 5.2552 9.1326 123.6510 55.0227 43.6619 174.4731 40 G 3.8680 8.2524 113.3084 44.8481 0.0000 175.1366 *41 D 4.3997 8.6209 117.3788 55.4809 39.7266 173.6707 42 D 4.6029 7.9708 114.7697 53.7245 39.7283 177.0124 43 D 4.4741 8.3591 121.3185 55.3950 39.7323 175.0150 44 R 4.1784 8.2413 119.1026 54.9925 30.2176 180.9760 45 L 4.4421 8.2801 123.3842 55.3353 42.5662 176.3887 46 H 4.9287 10.0102 122.5848 54.7403 31.9158 176.5130 47 G 4.0988 7.3031 107.4209 45.5726 0.0000 174.4423 *49 L 4.3699 8.0251 128.3970 54.6860 42.6219 175.4704 50 T 5.0240 8.7039 116.7446 59.8976 72.2576 175.3887 51 D 4.3583 8.7926 122.3594 56.8090 39.3398 178.8246 52 R 3.9122 7.9977 119.6819 59.0254 30.0130 177.9314 53 D 4.4045 8.1261 118.8799 57.4707 40.7631 178.8064 54 I 3.7035 7.5742 120.0552 64.3082 37.0562 178.7697 55 V 3.5602 7.5799 118.9689 66.0641 31.2422 178.2274 56 I 3.7891 8.0791 118.2486 64.1326 37.3180 178.0406 57 K 4.3821 8.2348 116.9242 57.7252 32.5117 177.5851 58 G 3.7812 8.0929 105.2899 45.5000 0.0000 175.3800 59 L 3.9721 7.6359 119.3306 57.2381 42.3192 179.4487 60 A 4.0513 8.3627 119.5918 54.1734 18.4672 177.7842 61 A 4.4458 7.9057 117.3048 51.7009 19.1194 177.4243 62 G 3.8926 7.9658 104.1908 46.9348 0.0000 174.2799 63 L 4.4216 7.6216 118.6813 53.1876 43.1883 175.8338 64 D 4.6995 8.3379 120.9837 52.1858 41.8914 175.6163 65 P 4.5271 0.0000 0.0000 65.6308 31.3791 177.5233 66 N 4.6916 8.6864 115.2839 54.2921 38.8828 175.6299 67 T 4.3957 7.5672 106.1934 62.3320 71.3660 174.7314 68 A 4.2512 8.5109 125.3484 52.0898 18.6749 176.3981 69 T 5.0210 8.6848 110.9526 59.5755 71.5257 175.6437 70 A 4.1204 8.9802 125.3507 55.4990 18.2007 180.5141 71 G 3.5855 8.3120 104.4887 47.9090 0.0000 175.7203 72 E 4.0564 7.9436 118.7705 58.7207 29.7207 178.5134 73 L 4.3204 7.5206 117.5075 55.9895 42.4854 177.9020 74 A 4.3938 8.3400 122.2363 53.3631 18.6880 179.7660 75 R 3.8257 7.5534 118.5086 60.0131 29.3998 183.5135 *76 D 4.9375 7.9992 114.5326 53.0204 40.1286 178.8513 77 S 4.9076 8.1627 113.8566 58.0399 63.1053 173.4068 78 I 4.3817 7.2196 119.7558 59.2881 39.7380 173.8983 79 Y 4.4401 7.1480 123.0050 56.5528 39.7534 172.2034 80 Y 4.8359 7.2440 118.3457 57.1617 40.4600 172.7315 81 V 4.6862 8.3502 111.6241 59.4975 36.3029 175.3755 82 D 5.0816 8.7416 122.0016 53.7514 42.3711 177.0588 83 A 3.9829 8.9196 127.8998 55.5289 18.5081 179.6154 84 N 4.8527 8.2220 110.9028 51.9284 38.0066 179.3932 85 A 4.1979 7.8770 122.8836 53.1193 18.9355 178.3846 86 S 4.9498 8.2422 115.8800 57.0846 64.7030 174.5660 87 I 3.8659 8.2490 121.0593 64.6075 37.1804 177.9549 88 Q 4.1014 8.3460 121.4207 59.7802 28.8439 179.7372 89 E 4.3603 8.0831 111.5003 56.3312 28.9933 180.5272 *91 L 4.3661 7.9543 121.8267 55.8297 43.9209 178.3103 92 N 4.4225 8.3226 116.1035 56.4869 38.7372 177.9630 93 V 3.8040 7.9002 117.1361 64.3140 30.8749 177.9748 *95 E 4.2439 8.3206 115.2392 55.4246 31.6503 180.9749 96 E 3.9212 8.1807 119.2936 58.6894 29.6855 177.1916 97 H 4.3137 8.2184 115.8394 55.5230 29.8344 175.1058 98 Q 3.4810 7.3860 116.5441 56.1012 25.2884 178.4331 99 V 4.5660 7.2995 113.3958 60.7716 36.2691 176.9084 100 R 4.6562 8.4373 119.0612 56.6971 31.9629 176.1218 101 R 5.1416 8.0098 116.1117 55.2079 33.3277 175.0418 102 V 4.7880 8.9143 123.9117 60.2413 34.9050 173.0634 103 P 4.8312 0.0000 0.0000 62.8948 33.0089 174.9601 104 V 4.9270 8.9482 122.1213 61.3869 33.9312 174.4382 105 I 5.0414 8.6764 128.1665 59.8669 40.8116 174.8143 106 S 4.5592 9.1180 121.8372 58.2691 66.0449 174.7590 107 E 3.4422 9.4958 123.7680 57.5034 26.8078 170.9524 108 H 4.1766 8.3399 112.4686 57.0894 26.4991 175.0830 109 R 4.5890 7.4903 117.9180 53.7860 33.1477 174.7847 110 L 4.3753 8.4129 123.3518 55.4083 42.5115 176.8046 111 V 4.2423 8.7956 119.0500 60.8128 34.2037 175.5459 112 G 4.1895 7.0081 105.9356 46.4013 0.0000 171.4546 113 I 5.3076 8.3783 120.0560 59.3473 40.6593 175.8115 114 V 4.6419 8.8776 126.2229 60.0620 34.2914 174.7890 115 T 5.0835 9.0696 113.3750 59.5284 71.7317 174.6790 116 E 3.9351 9.0005 122.7632 59.4660 29.5349 179.1256 117 A 3.9780 7.9482 120.4392 55.0551 18.4609 179.0991 118 D 4.3330 8.0479 117.4951 57.5362 40.6846 179.1038 119 I 3.6897 7.4866 118.5290 64.3742 37.3446 177.9433 120 A 4.1288 8.1797 121.7466 55.1948 17.9778 179.6561 121 R 3.8349 8.2107 116.2625 59.6020 30.2140 177.5906 122 H 4.7994 7.8502 113.0534 55.7673 28.9912 175.6350 123 L 4.3483 7.5070 128.8069 55.3517 42.1076 175.9209 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 2 T 8.16 4.45 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 3 T 8.25 4.67 4.41 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 1.21 0.00 0.00 4 A 8.72 4.00 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 5 R 7.99 3.97 0.00 1.88 1.97 0.00 3.26 0.00 0.00 3.21 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.60 0.00 6 D 7.79 4.47 0.00 2.86 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 7 I 7.18 4.26 1.92 0.00 0.00 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 1.46 0.69 0.88 0.00 0.00 *9 N 7.69 4.35 0.00 2.90 2.88 0.00 0.00 6.88 7.80 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 10 A 8.27 4.54 1.22 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 11 G 8.56 3.87 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 0.00 0.00 0.00 12 V 7.42 3.69 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 0.75 0.00 0.00 0.89 0.00 0.00 13 T 8.06 4.18 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 1.09 0.00 0.00 14 C 8.44 4.49 0.00 2.91 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 15 V 8.54 3.75 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 0.62 0.00 0.00 16 G 8.64 4.05 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 0.00 17 E 9.04 4.05 0.00 2.08 2.12 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 2.19 1.77 0.00 18 H 7.86 4.84 0.00 3.19 3.36 0.00 5.70 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 E 8.06 4.21 0.00 2.22 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 2.40 2.48 0.00 20 T 8.20 4.70 4.46 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 0.00 0.00 0.00 1.27 0.00 0.00 21 L 8.31 4.03 0.00 1.89 1.77 0.93 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 22 T 7.97 3.83 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 1.17 0.00 0.00 23 A 8.26 4.06 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 24 A 8.04 4.20 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 25 A 8.03 4.11 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 26 Q 7.84 4.07 0.00 1.93 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 7.07 0.00 0.00 0.00 0.00 0.00 2.28 2.51 0.00 27 Y 7.50 4.27 0.00 3.25 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 *29 R 8.13 4.15 0.00 1.86 2.12 0.00 3.18 0.00 0.00 3.35 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 30 E 8.28 3.93 0.00 2.02 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 2.18 0.00 31 H 8.24 4.74 0.00 3.21 3.36 0.00 5.77 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 D 7.67 4.46 0.00 2.85 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 33 I 7.63 4.74 1.90 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 1.43 1.20 0.98 0.00 0.00 34 G 8.53 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 35 A 7.79 5.34 1.23 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 36 L 8.95 4.92 0.00 1.46 1.52 1.09 1.05 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 37 P 0.00 4.61 0.00 2.05 2.13 0.00 3.60 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 2.00 1.94 0.00 38 I 8.90 4.94 1.84 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 1.32 1.06 0.87 0.00 0.00 39 C 9.13 5.26 0.00 2.71 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 40 G 8.25 3.87 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 0.00 0.00 0.00 *41 D 8.62 4.40 0.00 2.71 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 42 D 7.97 4.60 0.00 2.74 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 43 D 8.36 4.47 0.00 2.79 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 44 R 8.24 4.18 0.00 1.72 1.80 0.00 3.27 0.00 0.00 3.09 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.43 0.00 45 L 8.28 4.44 0.00 1.45 1.45 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 46 H 10.01 4.93 0.00 3.16 3.26 0.00 5.89 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 G 7.30 4.10 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 0.00 0.00 0.00 *49 L 8.03 4.37 0.00 1.77 1.62 0.94 0.65 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 50 T 8.70 5.02 4.34 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 1.28 0.00 0.00 51 D 8.79 4.36 0.00 2.97 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 52 R 8.00 3.91 0.00 1.91 1.99 0.00 3.20 0.00 0.00 3.35 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.73 0.00 53 D 8.13 4.40 0.00 2.99 2.73 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 54 I 7.57 3.70 2.05 0.00 0.00 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 1.43 0.78 0.92 0.00 0.00 55 V 7.58 3.56 2.21 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 1.08 0.00 0.00 1.00 0.00 0.00 56 I 8.08 3.79 1.94 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 1.70 0.93 0.92 0.00 0.00 57 K 8.23 4.38 0.00 1.88 1.87 0.00 1.70 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.46 7.81 58 G 8.09 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 59 L 7.64 3.97 0.00 1.87 1.74 0.92 1.09 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 60 A 8.36 4.05 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 61 A 7.91 4.45 1.30 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 62 G 7.97 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 0.00 0.00 0.00 63 L 7.62 4.42 0.00 1.77 1.61 1.01 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 64 D 8.34 4.70 0.00 2.67 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 65 P 0.00 4.53 0.00 2.25 2.30 0.00 3.74 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.99 0.00 66 N 8.69 4.69 0.00 2.85 2.90 0.00 0.00 6.77 7.35 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 67 T 7.57 4.40 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 1.27 0.00 0.00 68 A 8.51 4.25 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 69 T 8.68 5.02 4.53 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 1.34 0.00 0.00 70 A 8.98 4.12 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 71 G 8.31 3.59 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 0.00 0.00 0.00 72 E 7.94 4.06 0.00 2.11 2.12 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 2.56 2.36 0.00 73 L 7.52 4.32 0.00 1.66 1.78 0.98 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 74 A 8.34 4.39 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 75 R 7.55 3.83 0.00 1.79 1.90 0.00 3.26 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.48 0.00 *76 D 8.00 4.94 0.00 2.68 2.55 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 77 S 8.16 4.91 0.00 3.95 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 78 I 7.22 4.38 1.86 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.83 0.96 0.00 0.00 79 Y 7.15 4.44 0.00 2.74 2.34 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 80 Y 7.24 4.84 0.00 3.05 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 81 V 8.35 4.69 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 0.74 0.00 0.00 1.05 0.00 0.00 82 D 8.74 5.08 0.00 2.89 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 83 A 8.92 3.98 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 84 N 8.22 4.85 0.00 2.77 2.70 0.00 0.00 6.99 7.57 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 85 A 7.88 4.20 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 86 S 8.24 4.95 0.00 3.99 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 87 I 8.25 3.87 1.88 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 1.42 0.54 0.92 0.00 0.00 88 Q 8.35 4.10 0.00 2.15 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 7.20 0.00 0.00 0.00 0.00 0.00 2.45 2.42 0.00 89 E 8.08 4.36 0.00 1.93 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 2.24 2.15 0.00 *91 L 7.95 4.37 0.00 1.81 1.79 0.92 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 92 N 8.32 4.42 0.00 2.92 2.84 0.00 0.00 6.61 7.43 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 93 V 7.90 3.80 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 0.89 0.00 0.00 0.92 0.00 0.00 *95 E 8.32 4.24 0.00 1.96 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 2.21 1.88 0.00 96 E 8.18 3.92 0.00 1.92 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 2.23 2.14 0.00 97 H 8.22 4.31 0.00 2.89 2.77 0.00 5.86 0.00 0.00 0.00 0.00 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 Q 7.39 3.48 0.00 2.24 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.71 0.00 0.00 0.00 0.00 0.00 2.21 2.18 0.00 99 V 7.30 4.57 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 0.69 0.00 0.00 0.50 0.00 0.00 100 R 8.44 4.66 0.00 1.47 1.88 0.00 3.19 0.00 0.00 3.34 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.19 0.00 101 R 8.01 5.14 0.00 1.71 1.88 0.00 3.15 0.00 0.00 3.19 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.61 0.00 102 V 8.91 4.79 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 1.22 0.00 0.00 0.99 0.00 0.00 103 P 0.00 4.83 0.00 2.16 2.14 0.00 3.92 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 2.27 1.87 0.00 104 V 8.95 4.93 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 1.04 0.00 0.00 0.96 0.00 0.00 105 I 8.68 5.04 1.70 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.07 0.77 0.00 0.00 106 S 9.12 4.56 0.00 3.82 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 0.00 107 E 9.50 3.44 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 2.13 1.88 0.00 108 H 8.34 4.18 0.00 3.28 3.37 0.00 5.61 0.00 0.00 0.00 0.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 R 7.49 4.59 0.00 1.90 1.73 0.00 3.25 0.00 0.00 3.07 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.64 0.00 110 L 8.41 4.38 0.00 1.51 1.52 0.96 0.90 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 0.00 111 V 8.80 4.24 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 0.60 0.00 0.00 0.97 0.00 0.00 112 G 7.01 4.19 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 0.00 113 I 8.38 5.31 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 1.27 0.97 0.94 0.00 0.00 114 V 8.88 4.64 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 1.00 0.00 0.00 0.96 0.00 0.00 115 T 9.07 5.08 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 1.27 0.00 0.00 116 E 9.00 3.94 0.00 2.07 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 2.31 2.33 0.00 117 A 7.95 3.98 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 0.00 118 D 8.05 4.33 0.00 2.95 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 0.00 119 I 7.49 3.69 2.05 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 1.47 0.65 0.92 0.00 0.00 120 A 8.18 4.13 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 0.00 0.00 0.00 0.00 0.00 0.00 121 R 8.21 3.83 0.00 1.77 1.95 0.00 3.03 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.59 0.00 122 H 7.85 4.80 0.00 3.26 3.28 0.00 5.70 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 L 7.51 4.35 0.00 1.97 1.53 0.92 0.83 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 * Residues marked with a * may have inaccurate shift predictions.