NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 N 4.4697 8.4244 118.0978 52.1141 38.7278 173.6169 3 I 3.5398 8.3740 117.8689 63.8004 38.2364 176.2608 4 F 4.1958 9.1716 120.0523 60.7680 40.0136 177.6692 5 E 4.2927 8.5590 118.0536 56.8195 28.5555 178.8679 *7 L 4.2007 7.9725 121.4374 54.7768 43.9738 179.2945 8 R 3.6309 8.2260 118.4617 59.2838 29.6630 178.6713 9 I 3.7149 7.5386 118.4986 64.7026 37.2803 178.0041 10 D 4.5733 8.1765 117.7003 56.6820 40.8339 177.0400 11 E 4.3298 8.3675 117.5421 55.4027 30.9891 177.2820 12 G 3.7922 8.1605 108.2028 44.3703 0.0000 171.5225 13 L 4.9269 8.0524 119.4287 53.4008 44.6082 175.9583 14 R 4.6347 8.7457 124.5456 54.6162 33.7579 175.8365 15 L 4.5552 8.7779 122.0137 54.8480 43.0244 175.7699 16 K 5.0856 7.8419 119.9241 53.9656 35.0525 175.5481 17 I 4.1553 8.1910 126.6123 62.6622 37.7118 174.8011 18 Y 5.1011 9.0845 124.0713 55.2973 42.2005 173.9266 19 K 4.9074 8.7090 119.0872 55.0176 33.8545 177.3379 20 D 4.8748 8.7511 125.1624 52.6906 41.1455 176.8155 21 T 3.8735 8.5423 108.0935 64.5871 68.6657 174.5889 22 E 4.0844 8.3348 119.2210 56.0122 29.9525 176.5163 23 G 3.6562 8.1311 107.3208 45.4620 0.0000 172.5849 24 Y 4.8123 8.0576 117.4626 55.8670 40.3015 175.0020 25 Y 4.7530 8.3204 121.0483 59.0945 39.0366 175.5150 26 T 5.0305 9.0908 119.7588 62.3432 73.7968 172.4305 27 I 4.9094 8.5316 122.2979 59.7221 42.3550 176.7176 28 G 3.9260 9.3577 114.9311 47.3428 0.0000 176.8375 29 I 5.0141 7.8472 118.8641 59.4355 35.3196 175.0076 30 G 4.0888 8.4266 109.7709 46.7024 0.0000 171.8378 31 H 4.4332 8.4232 121.3119 54.1561 28.9497 173.8484 32 L 4.2608 8.0728 129.1488 55.2373 42.5813 176.5276 33 L 4.2715 8.6109 126.6879 56.6432 42.3387 176.7781 34 T 4.1977 7.2066 107.9733 61.6153 69.6486 172.7287 35 K 3.6163 8.2888 123.8890 56.1671 32.6666 177.3219 36 S 4.2737 7.7782 115.2087 57.5760 62.6644 172.2314 37 P 4.4939 0.0000 0.0000 63.7579 31.7191 176.4800 38 S 4.4757 8.2371 115.8262 57.4722 63.0144 173.8463 39 L 3.0942 8.5596 131.4589 58.1647 41.8382 178.4688 40 N 4.2630 8.0684 115.6292 56.1626 38.5208 176.9917 41 A 3.9581 8.0583 121.9273 55.0747 18.4151 179.5152 42 A 3.9240 7.9061 119.2153 55.2998 18.3479 180.0012 43 K 3.8328 8.2865 117.4151 59.5124 32.0760 179.4998 44 S 4.0552 8.1503 113.3772 61.5032 62.3283 176.0886 45 E 3.9692 8.2684 121.2479 59.1554 29.1770 179.0929 46 L 3.9463 8.1370 120.4797 58.3763 42.2163 178.6676 47 D 4.7560 8.2772 120.4091 56.7293 40.5257 178.8531 48 K 3.9353 8.0058 118.7348 59.4932 32.2850 178.4478 49 A 4.1287 7.9995 120.0442 54.9861 18.3682 179.0918 50 I 4.0740 7.8481 117.1785 61.5772 37.5466 177.2208 51 G 3.9230 10.1014 107.2264 45.1169 0.0000 172.6738 52 R 4.4430 7.3699 114.1061 54.4710 32.0289 173.7476 53 N 4.8684 8.5446 117.5867 53.4911 37.7425 174.1167 54 T 4.1694 9.4002 117.7599 61.4473 69.9872 174.8763 55 N 3.7233 9.2613 118.8867 54.4328 37.5084 174.4774 56 G 3.9565 8.4252 102.7286 44.9525 0.0000 173.2692 57 V 5.0449 7.3697 117.6299 60.8666 34.2317 174.5413 58 I 4.9548 8.7371 120.5298 59.2367 41.1141 174.6379 59 T 4.3726 8.7524 112.8998 60.4493 70.5897 176.0077 60 K 3.8808 8.7405 122.4114 59.8581 32.0938 178.3433 61 D 4.3715 8.0870 118.4932 57.5223 40.8105 178.5118 62 E 3.9680 8.1997 118.6666 59.2927 29.4756 179.2222 63 A 4.0567 8.2360 120.8658 55.4566 18.4186 179.6488 64 E 4.1972 8.5823 117.2290 59.1467 29.4640 179.5987 65 K 3.9702 8.3264 119.9846 59.5823 32.2963 178.7850 66 L 4.0378 7.9984 119.2976 57.7745 41.4262 179.3466 67 F 4.6638 8.5547 120.5049 61.5230 39.4313 176.5531 68 N 4.4715 8.6230 116.8527 56.9911 38.7135 176.7623 69 Q 4.0530 8.2455 119.2811 59.1028 28.7562 178.5845 70 D 4.3681 8.6471 120.3151 57.2894 40.9178 178.9763 71 V 3.5660 8.0926 119.0156 65.9380 31.4011 177.2906 72 D 4.3127 8.1339 117.4975 57.5703 40.9554 178.2407 73 A 3.9392 8.4704 121.1956 54.9457 18.3441 179.4040 74 A 3.8721 8.1953 119.3650 55.2977 18.5256 179.9304 75 V 3.3034 7.7028 116.5688 66.3130 31.6043 178.3826 76 R 3.9702 8.1858 117.9527 59.1349 29.6289 179.2085 77 G 3.6088 8.0898 104.9031 47.7959 0.0000 175.4465 78 I 3.7821 7.5119 122.1347 64.2514 36.9529 178.6999 79 L 4.0158 7.4372 117.8893 57.3806 41.4390 179.1886 80 R 4.2081 7.7540 118.1680 57.4758 30.1900 175.6232 81 N 4.5322 7.7433 117.7364 52.2261 38.6274 175.3389 82 A 4.0109 8.6228 128.6087 54.5465 18.4832 178.2011 83 K 4.2449 8.1251 115.8686 58.2000 33.0416 178.5171 84 L 4.2638 7.9237 118.7104 56.7988 41.8620 178.6670 85 K 3.8911 8.2709 120.1109 59.3557 32.1232 176.8999 86 P 4.3516 0.0000 0.0000 65.4900 31.0104 178.8080 87 V 3.5937 7.7103 115.6590 66.1237 31.9067 176.8310 88 Y 4.2409 8.1066 119.2496 61.1056 38.4463 178.0387 89 D 4.4923 8.6251 118.7483 57.1095 40.9528 178.4823 90 S 4.3177 7.7274 113.0901 59.4134 63.5167 174.4951 91 L 4.4915 6.8576 122.5696 53.6033 42.6641 176.6277 92 D 4.5814 8.2641 120.9519 52.8373 41.7860 177.2465 93 A 3.8698 8.3155 121.2342 55.1079 18.1503 180.1440 94 V 3.0619 7.5126 116.2249 66.1812 31.6689 178.4715 95 R 3.4710 8.0572 117.7616 58.8977 29.7248 179.1669 96 R 3.7170 8.0155 118.0571 59.1088 29.9014 178.7708 97 A 3.9825 7.7706 119.7480 55.1923 18.1742 179.5286 98 A 3.6454 7.0757 117.7063 54.9307 18.2754 179.3770 99 A 4.3588 7.8308 118.4321 55.5874 18.8162 179.5915 100 I 3.8888 8.0579 118.4058 64.3837 37.1115 178.1849 101 N 4.1878 8.1458 114.7101 54.9966 38.6390 176.1574 *103 V 3.9359 7.6020 119.0798 62.6660 33.3310 176.2307 104 F 4.1210 8.6738 120.9339 61.4195 39.1058 175.8508 105 Q 4.2223 8.1885 118.5439 57.6511 29.1781 175.7620 *107 G 3.7561 7.7231 105.7627 45.7970 0.0000 173.8721 108 E 3.9430 8.7657 120.5732 58.7002 29.4937 178.0794 109 T 4.4301 7.8214 113.8874 63.4066 69.4744 176.4648 110 G 3.7473 8.2056 111.0216 47.7343 0.0000 174.9752 111 V 4.2033 7.6610 117.6486 63.1178 32.0598 177.0510 112 A 3.9934 7.5516 121.0903 56.1938 18.1487 179.0591 113 G 3.6160 8.0325 101.6943 47.1398 0.0000 174.3252 114 F 4.6308 8.3855 119.3175 57.6252 39.0937 177.3012 115 T 3.9153 7.9762 118.4440 67.3276 67.9753 175.7797 116 N 4.3795 8.0392 116.0193 56.2490 38.6984 177.2566 117 S 4.3035 8.0387 115.2303 61.6371 63.2850 176.0945 118 L 4.1387 8.1782 121.8417 57.7447 41.4023 180.0858 119 R 4.0847 7.7390 114.7360 57.3776 29.8362 177.8324 *121 L 4.2838 7.8415 118.9038 54.4257 43.5713 179.0201 122 Q 3.9874 8.1578 118.4977 59.0311 28.8274 177.0152 123 Q 3.9919 7.9845 115.3576 55.9325 28.9657 176.3373 124 K 2.0000 6.9042 116.2791 56.9495 30.2615 177.5051 125 R 4.0706 6.3099 115.7552 54.4566 27.5507 176.3914 126 W 4.6059 7.5212 122.8851 59.8925 29.6989 177.4873 127 D 4.4501 8.2135 118.3463 57.4017 40.3236 178.5430 128 E 3.9662 8.1855 118.3903 59.3028 29.5065 178.9866 129 A 3.9878 8.4994 121.0039 55.1122 18.2069 179.4499 130 A 4.0368 8.2978 119.2884 55.4006 18.2755 179.9670 131 V 3.5154 7.6323 115.3172 66.2465 32.0334 177.4474 132 N 4.4709 8.3848 116.7862 56.6908 38.5776 176.8019 133 L 4.4045 8.3224 119.7723 57.8397 41.8293 178.9787 134 A 3.9139 7.6316 119.0814 53.2661 19.6394 178.3432 135 K 4.3146 7.4470 119.0629 54.3379 31.0121 176.7284 136 S 4.7124 7.4857 114.9364 55.8171 67.4928 175.1676 137 R 3.9663 8.7587 123.3258 59.4552 29.7664 178.2388 138 W 4.5894 8.6676 127.6708 61.1302 30.4858 177.0513 139 Y 3.4577 8.3422 118.9348 60.7545 38.0285 177.9020 140 N 4.3463 8.0839 115.8024 56.1695 38.6751 177.0130 141 Q 4.2845 8.2958 119.2124 57.1197 30.6603 176.4680 142 T 4.5535 7.7174 109.4262 58.5946 68.6475 172.5056 143 P 3.6111 0.0000 0.0000 65.8640 31.9282 178.4105 144 N 4.1499 7.7962 115.8058 55.9415 38.5050 177.2351 145 R 3.8495 7.7665 119.2696 59.3103 30.3394 178.0795 146 A 3.4252 7.7139 120.6454 54.9079 18.0718 179.6317 147 K 3.9545 8.2148 117.2818 59.6991 32.1310 179.7333 148 R 3.7675 7.7470 117.6793 59.2402 30.0025 179.3308 149 V 3.7547 8.1229 118.0196 66.1618 31.5749 178.1043 150 I 4.1016 8.6284 119.9174 64.9125 36.9894 178.5210 151 T 3.9637 8.3044 116.7642 66.9426 68.2313 176.8081 152 T 3.8571 7.9376 117.6329 66.6689 68.2146 176.7984 153 F 4.1559 7.9191 118.6374 60.3590 38.9633 177.4930 154 R 4.1644 8.3755 118.5049 58.9922 30.0265 177.7388 155 T 4.3067 7.8105 107.4955 60.5290 69.9552 175.2110 156 G 3.5021 7.6479 108.6518 46.1769 0.0000 172.8620 157 T 4.4181 7.2492 107.9725 59.2786 71.6859 173.3268 158 W 4.9646 8.3433 118.6757 56.8512 29.2144 178.2299 159 D 4.3823 8.1408 121.8172 57.6149 40.2946 178.7038 160 A 4.0663 8.1140 119.6133 54.0359 18.5489 177.2198 161 Y 4.5537 8.0749 112.2378 57.3465 38.7086 175.8443 162 K 4.1877 7.8037 127.1840 56.7037 32.2245 176.4271 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 N 8.42 4.47 0.00 2.84 2.85 0.00 0.00 5.99 6.93 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 3 I 8.37 3.54 1.83 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.27 0.63 0.00 0.00 4 F 9.17 4.20 0.00 3.27 3.16 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 5 E 8.56 4.29 0.00 1.92 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 2.30 2.41 0.00 *7 L 7.97 4.20 0.00 1.90 1.57 0.29 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 8 R 8.23 3.63 0.00 2.00 2.15 0.00 2.99 0.00 0.00 3.02 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 9 I 7.54 3.71 2.04 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.78 1.06 0.00 0.00 10 D 8.18 4.57 0.00 2.73 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 11 E 8.37 4.33 0.00 1.95 2.14 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 2.35 2.39 0.00 12 G 8.16 3.79 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 0.00 0.00 0.00 13 L 8.05 4.93 0.00 1.44 1.44 0.91 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 14 R 8.75 4.63 0.00 1.40 1.62 0.00 2.64 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.20 0.00 15 L 8.78 4.56 0.00 1.62 1.92 0.93 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 16 K 7.84 5.09 0.00 1.77 1.72 0.00 1.83 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.36 1.54 7.81 17 I 8.19 4.16 1.89 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.81 0.94 0.00 0.00 18 Y 9.08 5.10 0.00 3.00 3.03 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 19 K 8.71 4.91 0.00 1.66 1.67 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.25 0.00 0.00 2.99 0.00 0.00 0.00 0.00 0.89 1.34 7.81 20 D 8.75 4.87 0.00 2.96 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 21 T 8.54 3.87 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 22 E 8.33 4.08 0.00 1.81 1.53 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 2.28 2.31 0.00 23 G 8.13 3.66 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 24 Y 8.06 4.81 0.00 3.15 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 25 Y 8.32 4.75 0.00 2.94 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 26 T 9.09 5.03 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 1.13 0.00 0.00 27 I 8.53 4.91 1.93 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.48 0.99 0.00 0.00 28 G 9.36 3.93 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 0.00 0.00 0.00 29 I 7.85 5.01 1.27 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.58 0.01 0.00 0.00 30 G 8.43 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 0.00 0.00 0.00 0.00 31 H 8.42 4.43 0.00 3.36 3.51 0.00 5.79 0.00 0.00 0.00 0.00 6.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 L 8.07 4.26 0.00 1.55 1.42 1.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 33 L 8.61 4.27 0.00 1.84 1.71 0.98 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 34 T 7.21 4.20 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 1.30 0.00 0.00 35 K 8.29 3.62 0.00 1.46 1.14 0.00 1.54 0.00 0.00 1.14 0.00 0.00 2.49 0.00 0.00 2.57 0.00 0.00 0.00 0.00 0.30 0.95 7.81 36 S 7.78 4.27 0.00 3.86 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 37 P 0.00 4.49 0.00 2.29 2.20 0.00 3.87 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.00 0.00 38 S 8.24 4.48 0.00 3.97 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 39 L 8.56 3.09 0.00 1.57 1.52 0.38 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 40 N 8.07 4.26 0.00 2.74 2.82 0.00 0.00 7.02 7.13 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 41 A 8.06 3.96 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 42 A 7.91 3.92 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 K 8.29 3.83 0.00 1.87 1.83 0.00 1.61 0.00 0.00 1.53 0.00 0.00 2.81 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.53 7.81 44 S 8.15 4.06 0.00 3.96 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 45 E 8.27 3.97 0.00 2.19 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 2.50 2.59 0.00 46 L 8.14 3.95 0.00 1.82 1.85 0.94 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 47 D 8.28 4.76 0.00 2.86 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 48 K 8.01 3.94 0.00 1.82 2.03 0.00 1.80 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.46 7.81 49 A 8.00 4.13 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 50 I 7.85 4.07 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 1.66 0.89 0.92 0.00 0.00 51 G 10.10 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 52 R 7.37 4.44 0.00 1.95 2.00 0.00 2.97 0.00 0.00 3.27 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 53 N 8.54 4.87 0.00 2.70 2.81 0.00 0.00 6.94 7.70 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 54 T 9.40 4.17 4.45 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 1.32 0.00 0.00 55 N 9.26 3.72 0.00 2.78 2.86 0.00 0.00 7.10 7.98 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 56 G 8.43 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 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0.00 0.00 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 A 8.20 3.87 1.43 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 0.00 0.00 0.00 0.00 0.00 0.00 75 V 7.70 3.30 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.96 0.00 0.00 76 R 8.19 3.97 0.00 1.95 1.93 0.00 3.31 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.78 0.00 77 G 8.09 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 0.00 0.00 0.00 78 I 7.51 3.78 1.62 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.18 0.56 0.00 0.00 79 L 7.44 4.02 0.00 1.57 1.69 0.88 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 80 R 7.75 4.21 0.00 2.01 2.04 0.00 3.23 0.00 0.00 3.13 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 81 N 7.74 4.53 0.00 2.73 2.80 0.00 0.00 6.94 9.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 K 7.45 4.31 0.00 1.94 1.79 0.00 1.72 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.53 7.81 136 S 7.49 4.71 0.00 4.29 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 R 8.76 3.97 0.00 1.97 2.11 0.00 3.26 0.00 0.00 3.35 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.77 0.00 138 W 8.67 4.59 0.00 3.68 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 0.00 139 Y 8.34 3.46 0.00 3.03 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 0.00 140 N 8.08 4.35 0.00 2.96 2.91 0.00 0.00 7.11 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 Q 8.30 4.28 0.00 2.06 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 7.22 0.00 0.00 0.00 0.00 0.00 2.66 2.56 0.00 142 T 7.72 4.55 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 1.25 0.00 0.00 143 P 0.00 3.61 0.00 1.88 1.77 0.00 3.69 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.69 0.00 144 N 7.80 4.15 0.00 2.73 2.81 0.00 0.00 6.76 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 0.00 145 R 7.77 3.85 0.00 1.89 1.92 0.00 3.34 0.00 0.00 3.71 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.99 0.00 146 A 7.71 3.43 0.17 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 0.00 0.00 147 K 8.21 3.95 0.00 1.90 1.86 0.00 1.60 0.00 0.00 1.65 0.00 0.00 3.06 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.61 1.57 7.81 148 R 7.75 3.77 0.00 1.96 1.45 0.00 2.21 0.00 0.00 2.70 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.60 0.00 149 V 8.12 3.75 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 1.32 0.00 0.00 1.31 0.00 0.00 150 I 8.63 4.10 2.09 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.94 1.05 0.00 0.00 151 T 8.30 3.96 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 1.21 0.00 0.00 152 T 7.94 3.86 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 0.63 0.00 0.00 153 F 7.92 4.16 0.00 3.28 3.06 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 0.00 154 R 8.38 4.16 0.00 1.96 2.12 0.00 3.29 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.82 0.00 155 T 7.81 4.31 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 1.22 0.00 0.00 156 G 7.65 3.50 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 0.00 0.00 0.00 157 T 7.25 4.42 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 0.00 158 W 8.34 4.96 0.00 3.46 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 0.00 159 D 8.14 4.38 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 0.00 160 A 8.11 4.07 1.16 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 0.00 161 Y 8.07 4.55 0.00 3.20 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 0.00 162 K 7.80 4.19 0.00 1.86 1.72 0.00 1.76 0.00 0.00 1.82 0.00 0.00 3.17 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.49 1.46 7.81 * Residues marked with a * may have inaccurate shift predictions.