NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 F 4.8948 8.1676 115.8855 57.2647 40.1205 177.1577 11 H 4.0687 6.0494 117.6486 56.5285 28.7388 174.1127 12 E 3.9583 8.2993 120.7831 58.9947 30.4284 179.1012 13 M 4.5599 7.1048 115.7816 55.6336 32.0589 177.4522 14 R 4.5896 7.6501 115.9579 55.7476 34.0730 175.3764 15 E 4.1056 8.0219 117.4707 54.9523 30.1369 174.7601 16 P 4.3584 0.0000 0.0000 63.2457 32.3890 174.9477 17 R 4.5015 8.0089 115.9599 55.3251 33.4120 173.9496 18 I 4.3009 8.2386 120.8684 60.8781 37.1841 175.8073 19 E 4.2133 9.3269 130.1765 58.2970 29.9616 176.7902 20 K 4.5918 7.3716 115.2879 56.1733 35.7244 173.9926 21 V 4.6354 8.3825 121.6868 61.3429 34.3326 174.6031 22 V 5.0889 8.2092 129.5970 60.9049 32.9406 174.8976 23 V 4.5912 7.9601 122.3940 60.3714 33.2043 174.8130 24 H 5.2976 9.1405 124.9170 54.6580 33.9521 172.1658 25 M 4.5522 8.5343 123.2921 53.4449 34.4627 174.7989 26 G 3.6128 8.2351 111.9419 46.1559 0.0000 171.5603 27 I 3.8595 8.3436 128.1691 59.6258 36.4263 175.1676 28 G 3.5189 6.7118 124.6252 45.9283 0.0000 173.0229 29 H 4.3925 7.3483 113.8685 56.0667 31.3463 174.5168 *35 A 4.2516 7.7568 123.5014 52.2641 19.8814 178.0188 36 N 4.4667 8.8213 120.9984 54.0405 38.2678 176.8641 37 A 4.1626 7.9507 122.8611 54.6642 18.6049 178.9443 38 E 4.0161 8.0852 117.4890 59.6054 28.9815 179.0380 39 D 4.4005 7.7372 117.8980 57.4485 40.8964 179.0121 40 I 3.8283 7.4172 112.1728 63.9369 37.5293 178.2897 41 L 4.0796 7.9412 120.4821 57.5087 41.4024 179.4780 42 G 3.6133 8.0066 105.2795 47.7964 0.0000 175.6284 43 E 4.0337 7.6596 118.8534 59.1876 29.6776 178.7960 44 I 3.9852 7.8697 118.0265 63.6750 38.1297 177.6206 45 T 4.2748 8.0410 110.2068 65.6533 69.3071 175.0032 46 G 3.9522 7.1878 111.4290 44.7273 0.0000 173.6219 47 Q 4.6133 7.1659 116.1759 53.7271 31.0628 175.0603 48 M 4.1287 8.3046 117.9554 54.9698 32.3726 174.6940 49 P 4.9192 0.0000 0.0000 61.8577 34.2522 174.8288 50 V 4.5410 8.2289 111.4434 59.4818 35.7806 176.0712 51 R 4.5367 8.7348 123.3718 56.8622 31.2859 176.0544 52 T 4.5181 8.5777 116.4536 62.2820 72.0327 174.1760 53 K 4.8386 8.6732 127.0906 55.7738 34.9844 175.1937 54 A 4.5865 7.4279 118.0081 52.1552 22.5457 176.2334 55 K 4.5940 8.1041 117.3577 55.5540 36.3249 173.1534 56 R 4.0695 8.7146 127.3781 55.9799 30.0970 176.6107 57 T 4.3161 8.4015 119.1006 63.3015 69.4718 174.1065 58 V 4.4702 8.4439 125.6482 60.6218 34.0364 176.7693 59 G 3.7873 8.7435 114.9605 47.8527 0.0000 173.3112 60 E 4.2958 7.9958 119.0737 56.5359 29.7211 175.9635 61 F 4.2445 8.1437 114.1408 61.1284 38.6468 175.0625 62 D 4.8596 8.0724 116.7738 52.7489 41.2774 177.1051 63 I 3.6777 7.4342 114.5163 63.0890 38.8620 177.0480 64 R 3.8570 7.6079 121.8367 55.4500 27.7931 175.0372 65 E 3.6548 8.2221 127.2211 59.5031 30.0645 176.4018 66 G 4.1465 7.7337 118.2292 46.2366 0.0000 171.3741 67 D 4.7300 8.3043 123.9934 50.8969 42.5469 173.2949 68 P 4.4262 0.0000 0.0000 64.0340 31.3200 176.0462 69 I 4.4122 9.1532 122.7002 62.2235 41.1282 174.8961 70 G 4.3405 7.8701 106.4455 46.8944 0.0000 171.6199 71 A 5.2842 8.4747 119.9671 51.3718 22.9925 175.7126 72 K 5.4627 8.6542 117.2449 56.3932 36.9800 175.2872 73 V 4.5506 8.0228 120.0634 61.6327 34.7878 173.5616 74 T 4.6906 8.5592 118.9966 60.5603 69.8432 173.9353 75 L 4.6612 8.6248 127.6695 53.2445 43.7291 176.1594 76 R 4.8273 7.9526 120.7703 54.4586 34.3700 175.6392 77 D 4.4126 9.0061 121.3627 55.7249 39.3725 176.1068 78 E 3.9646 9.0391 125.8544 61.0318 28.9543 178.1844 79 M 4.0865 8.2716 117.7713 58.4422 31.8888 178.7457 80 A 4.0570 7.8026 120.2398 55.1493 18.7837 179.4182 81 E 3.9994 8.1611 116.9757 59.7418 29.4617 179.4372 82 E 3.9932 8.7125 117.0845 58.6409 29.3253 178.6103 83 F 4.4461 7.6544 121.0583 60.6499 39.7914 177.6158 84 L 4.0992 8.1457 118.5263 57.7086 41.1252 179.4304 85 Q 3.9961 8.2230 118.1075 58.1784 28.6121 177.5247 86 T 4.4437 7.1784 107.0344 61.1264 69.2926 174.6313 87 A 4.3590 7.4934 125.3023 54.2084 21.3692 179.2974 88 L 3.8092 8.2264 115.8822 57.4124 41.8137 177.9891 89 P 4.1813 0.0000 0.0000 65.2986 31.3035 177.2536 90 L 4.1319 7.5183 116.0371 55.5027 41.8141 176.3340 91 A 4.7591 7.5558 121.1915 50.2849 21.6069 176.3322 92 E 4.5296 8.1086 119.1122 53.3362 29.3173 174.9942 93 L 3.8475 7.9596 119.5465 55.2423 42.4061 176.8597 94 A 4.7266 8.3806 125.0276 50.4338 20.9647 176.5444 95 T 4.1372 8.4675 114.9691 66.8646 68.9131 178.0547 96 S 4.3968 8.1065 115.3782 61.2545 63.3334 175.8369 97 Q 4.1745 7.9580 114.7690 56.5734 28.0138 174.9955 98 F 5.0140 8.0494 117.7008 55.5477 41.1474 175.4244 99 D 4.7093 9.7325 125.5092 53.7620 41.8104 176.9156 100 D 4.4661 8.6065 122.7056 57.5541 40.9529 177.6720 101 T 4.2514 8.0899 113.6453 63.5732 68.4063 174.8979 102 G 3.9227 8.1456 109.3353 46.5387 0.0000 173.2199 103 N 5.2048 7.9905 116.0060 51.3048 41.9061 173.2580 104 F 5.0358 7.6621 110.7425 56.7049 41.3262 173.1929 105 S 4.9428 8.6727 115.8860 56.3912 65.1109 172.8342 106 F 4.9829 9.2775 121.1503 54.7414 41.0267 175.2207 107 G 3.7466 8.8414 107.2556 45.3035 0.0000 172.9379 *128 L 4.0100 7.9224 125.2957 55.0854 42.7491 177.0692 129 D 4.5935 8.6512 126.5697 53.6011 42.9367 176.1507 130 V 4.3966 8.0133 121.5608 61.5706 34.3322 174.0302 131 T 4.5848 8.3280 125.1574 61.5940 71.5167 174.0516 132 V 4.4663 7.5742 124.8317 61.0272 34.3706 173.7074 133 N 4.6340 9.1808 128.3014 52.5361 39.9206 173.5163 134 L 5.2721 8.2317 126.3353 53.3041 44.4453 175.9903 135 V 4.1700 7.8114 119.8889 61.0494 35.2899 172.4749 136 R 4.5171 8.3243 119.6659 54.8348 31.2730 176.7234 137 P 4.2260 0.0000 0.0000 64.9645 31.9984 176.7666 138 G 4.2608 8.0395 108.2730 45.0931 0.0000 174.7256 139 Y 4.3841 8.2525 122.6205 59.9981 39.6120 177.0810 140 R 3.7556 8.2928 119.4611 59.6431 29.8099 177.9882 141 V 3.4945 7.4308 116.1941 65.5969 31.1724 176.9734 142 A 4.6959 7.7670 118.9816 51.3681 19.4161 177.4088 143 K 4.1815 7.6038 115.4737 56.0490 33.5226 176.9149 144 R 4.2614 7.5435 115.0383 55.5216 30.5824 176.3971 145 D 4.4436 8.4045 117.6319 56.8908 41.2891 177.6077 146 K 3.9404 7.9423 117.2701 57.6739 32.5095 176.9270 147 A 3.8056 8.7166 127.0367 52.7206 16.2896 176.8768 148 S 4.5765 7.8383 112.9239 60.1423 64.1056 173.6535 149 R 4.6675 8.6071 120.0549 55.0187 33.9079 173.6834 150 S 4.5705 8.5172 118.7094 57.3772 63.4690 173.9068 151 I 3.8325 8.3573 127.8944 60.6647 37.6570 174.4193 152 P 4.4562 0.0000 0.0000 62.5591 32.1259 177.2477 153 T 3.9259 8.7043 111.8409 65.3706 68.0902 176.6941 154 K 4.0211 7.9979 119.7091 59.1296 32.2691 177.8979 155 H 4.4683 7.9562 115.6919 56.1509 30.3446 175.4568 156 R 4.1260 7.1518 119.9319 55.9242 30.5363 176.3641 157 L 4.0759 8.3564 124.2922 55.2422 43.0453 176.2530 158 N 5.0422 8.2564 120.6807 50.8621 42.1938 174.4986 159 P 4.3193 0.0000 0.0000 65.7026 31.5145 178.8917 160 A 3.8453 7.8703 118.9035 55.4606 18.3867 179.3635 161 D 4.3659 8.1259 116.3152 56.9995 40.7777 178.9753 162 A 4.0430 7.9560 121.6533 55.0841 18.5392 179.4432 163 V 3.1846 7.6844 116.8140 66.1176 31.3552 177.7516 164 A 3.9975 7.8931 120.0600 55.2976 18.0065 179.1068 165 F 4.0487 7.7927 117.0894 61.6326 39.5024 177.2670 166 I 3.7290 7.8511 117.7329 64.4636 37.2793 177.6516 167 E 4.2938 8.7632 122.0442 58.5153 29.0517 178.0623 168 S 4.6583 7.9662 111.4234 57.7507 64.0561 175.2145 169 T 4.3675 7.6322 115.7364 62.8766 70.4897 173.0509 170 Y 3.5213 7.5258 122.8146 58.5400 35.0229 168.8739 171 D 4.3399 7.0653 116.9754 53.5364 41.6118 174.5365 172 V 4.3836 8.1744 118.3805 60.8853 34.5595 175.4030 173 E 4.3405 8.3596 123.8391 56.1587 30.9176 176.5390 174 V 4.2488 8.3416 117.0800 62.6839 32.5909 173.6856 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 F 8.17 4.89 0.00 3.35 3.36 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 11 H 6.05 4.07 0.00 3.13 2.81 0.00 5.46 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 E 8.30 3.96 0.00 1.65 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 2.22 2.20 0.00 13 M 7.10 4.56 0.00 2.15 2.09 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.64 0.00 14 R 7.65 4.59 0.00 1.96 1.88 0.00 3.30 0.00 0.00 3.32 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.69 0.00 15 E 8.02 4.11 0.00 2.20 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 2.47 2.27 0.00 16 P 0.00 4.36 0.00 0.57 1.51 0.00 3.65 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 1.87 1.92 0.00 17 R 8.01 4.50 0.00 1.87 1.93 0.00 2.77 0.00 0.00 3.16 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.56 0.00 18 I 8.24 4.30 1.96 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.80 0.97 0.00 0.00 19 E 9.33 4.21 0.00 1.97 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 2.25 2.22 0.00 20 K 7.37 4.59 0.00 1.77 1.82 0.00 1.47 0.00 0.00 1.75 0.00 0.00 2.93 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.28 1.29 7.81 21 V 8.38 4.64 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 0.99 0.00 0.00 0.98 0.00 0.00 22 V 8.21 5.09 1.96 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 0.79 0.00 0.00 0.85 0.00 0.00 23 V 7.96 4.59 1.94 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 0.06 0.00 0.00 0.70 0.00 0.00 24 H 9.14 5.30 0.00 3.08 2.99 0.00 5.52 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 M 8.53 4.55 0.00 1.90 1.87 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.39 0.00 26 G 8.24 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 27 I 8.34 3.86 1.99 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 1.24 0.71 0.80 0.00 0.00 28 G 6.71 3.52 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 H 7.35 4.39 0.00 3.16 3.34 0.00 5.76 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 *35 A 7.76 4.25 1.28 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 0.00 0.00 36 N 8.82 4.47 0.00 2.93 3.10 0.00 0.00 5.84 7.46 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 37 A 7.95 4.16 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 38 E 8.09 4.02 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 2.32 2.49 0.00 39 D 7.74 4.40 0.00 2.76 2.72 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 40 I 7.42 3.83 1.89 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 1.72 0.72 0.92 0.00 0.00 41 L 7.94 4.08 0.00 1.83 1.72 0.88 0.88 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 42 G 8.01 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 43 E 7.66 4.03 0.00 2.17 2.04 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 2.35 2.49 0.00 44 I 7.87 3.99 1.96 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.85 1.09 0.00 0.00 45 T 8.04 4.27 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 0.99 0.00 0.00 46 G 7.19 3.95 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 0.00 0.00 0.00 47 Q 7.17 4.61 0.00 2.25 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.81 0.00 0.00 0.00 0.00 0.00 2.21 2.25 0.00 48 M 8.30 4.13 0.00 2.01 2.03 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.52 0.00 49 P 0.00 4.92 0.00 2.04 2.04 0.00 3.70 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 1.91 1.96 0.00 50 V 8.23 4.54 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 0.72 0.00 0.00 0.99 0.00 0.00 51 R 8.73 4.54 0.00 1.68 1.86 0.00 3.30 0.00 0.00 3.21 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.60 0.00 52 T 8.58 4.52 4.33 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 1.19 0.00 0.00 53 K 8.67 4.84 0.00 1.61 1.76 0.00 1.82 0.00 0.00 0.61 0.00 0.00 2.78 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.26 7.81 54 A 7.43 4.59 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 55 K 8.10 4.59 0.00 1.58 1.66 0.00 1.83 0.00 0.00 1.69 0.00 0.00 2.71 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.31 1.41 7.81 56 R 8.71 4.07 0.00 1.97 2.00 0.00 3.20 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.63 0.00 57 T 8.40 4.32 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 1.26 0.00 0.00 58 V 8.44 4.47 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 1.03 0.00 0.00 0.98 0.00 0.00 59 G 8.74 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 60 E 8.00 4.30 0.00 2.14 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 0.00 2.29 2.33 0.00 61 F 8.14 4.24 0.00 3.05 3.14 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 0.00 62 D 8.07 4.86 0.00 2.79 2.51 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 63 I 7.43 3.68 1.87 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 1.16 0.45 0.97 0.00 0.00 64 R 7.61 3.86 0.00 1.69 2.02 0.00 3.18 0.00 0.00 3.08 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.57 0.00 65 E 8.22 3.65 0.00 2.02 1.79 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 2.47 2.31 0.00 66 G 7.73 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 0.00 0.00 0.00 67 D 8.30 4.73 0.00 2.63 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 68 P 0.00 4.43 0.00 1.94 2.05 0.00 3.59 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.12 0.00 69 I 9.15 4.41 1.96 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 1.13 0.91 0.92 0.00 0.00 70 G 7.87 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 0.00 0.00 0.00 0.00 71 A 8.47 5.28 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 72 K 8.65 5.46 0.00 1.77 1.87 0.00 1.49 0.00 0.00 1.62 0.00 0.00 2.76 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.29 1.18 7.81 73 V 8.02 4.55 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 0.90 0.00 0.00 0.86 0.00 0.00 74 T 8.56 4.69 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 1.16 0.00 0.00 75 L 8.62 4.66 0.00 1.57 1.64 0.48 0.47 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 76 R 7.95 4.83 0.00 1.63 1.77 0.00 3.32 0.00 0.00 3.23 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.62 0.00 77 D 9.01 4.41 0.00 2.89 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 0.00 0.00 0.00 0.00 78 E 9.04 3.96 0.00 2.03 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 0.00 2.43 2.43 0.00 79 M 8.27 4.09 0.00 2.02 2.26 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.59 0.00 80 A 7.80 4.06 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 81 E 8.16 4.00 0.00 2.11 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 2.43 2.56 0.00 82 E 8.71 3.99 0.00 2.04 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 2.36 2.43 0.00 83 F 7.65 4.45 0.00 3.29 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 84 L 8.15 4.10 0.00 2.00 1.84 1.12 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 85 Q 8.22 4.00 0.00 1.94 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 7.35 0.00 0.00 0.00 0.00 0.00 2.29 2.58 0.00 86 T 7.18 4.44 4.13 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 1.14 0.00 0.00 87 A 7.49 4.36 0.80 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 88 L 8.23 3.81 0.00 1.76 1.69 1.04 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 89 P 0.00 4.18 0.00 1.98 2.07 0.00 3.61 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.06 0.00 90 L 7.52 4.13 0.00 1.71 1.72 0.94 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 91 A 7.56 4.76 0.52 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 0.00 0.00 0.00 0.00 0.00 0.00 92 E 8.11 4.53 0.00 1.92 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 2.17 2.26 0.00 93 L 7.96 3.85 0.00 1.62 1.72 0.81 0.77 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 94 A 8.38 4.73 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 95 T 8.47 4.14 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 1.18 0.00 0.00 96 S 8.11 4.40 0.00 4.06 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 97 Q 7.96 4.17 0.00 2.26 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.81 0.00 0.00 0.00 0.00 0.00 2.47 2.43 0.00 98 F 8.05 5.01 0.00 3.17 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 99 D 9.73 4.71 0.00 2.62 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 0.00 100 D 8.61 4.47 0.00 2.72 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 0.00 101 T 8.09 4.25 4.54 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 1.22 0.00 0.00 102 G 8.15 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 0.00 103 N 7.99 5.20 0.00 2.78 2.80 0.00 0.00 6.54 8.13 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 0.00 104 F 7.66 5.04 0.00 2.73 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 0.00 105 S 8.67 4.94 0.00 3.71 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 0.00 106 F 9.28 4.98 0.00 3.13 3.29 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 0.00 107 G 8.84 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 *128 L 7.92 4.01 0.00 1.70 1.70 0.95 1.21 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 0.00 129 D 8.65 4.59 0.00 2.64 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 V 8.01 4.40 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 0.00 0.00 0.93 0.00 0.00 0.95 0.00 0.00 131 T 8.33 4.58 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 1.06 0.00 0.00 132 V 7.57 4.47 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 1.04 0.00 0.00 0.62 0.00 0.00 133 N 9.18 4.63 0.00 2.74 2.62 0.00 0.00 6.62 6.35 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 0.00 134 L 8.23 5.27 0.00 1.78 1.46 1.24 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 135 V 7.81 4.17 1.46 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 0.26 0.00 0.00 0.44 0.00 0.00 136 R 8.32 4.52 0.00 1.68 1.77 0.00 3.17 0.00 0.00 3.10 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.52 0.00 137 P 0.00 4.23 0.00 2.07 2.14 0.00 3.60 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 2.12 0.00 138 G 8.04 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 0.00 0.00 0.00 0.00 139 Y 8.25 4.38 0.00 3.10 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.29 3.76 0.00 1.92 1.94 0.00 3.25 0.00 0.00 3.26 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.69 0.00 141 V 7.43 3.49 2.05 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 0.92 0.00 0.00 0.98 0.00 0.00 142 A 7.77 4.70 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 0.00 143 K 7.60 4.18 0.00 1.58 1.74 0.00 1.63 0.00 0.00 1.57 0.00 0.00 2.83 0.00 0.00 3.11 0.00 0.00 0.00 0.00 0.70 1.23 7.81 144 R 7.54 4.26 0.00 1.89 1.90 0.00 3.03 0.00 0.00 3.19 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.68 0.00 145 D 8.40 4.44 0.00 2.67 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 0.00 146 K 7.94 3.94 0.00 1.73 1.74 0.00 1.88 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.42 7.81 147 A 8.72 3.81 1.28 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 0.00 0.00 148 S 7.84 4.58 0.00 3.90 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 0.00 149 R 8.61 4.67 0.00 1.90 1.72 0.00 3.12 0.00 0.00 3.08 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.61 0.00 150 S 8.52 4.57 0.00 3.92 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 0.00 151 I 8.36 3.83 1.99 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 1.48 1.19 1.03 0.00 0.00 152 P 0.00 4.46 0.00 2.21 2.00 0.00 3.65 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.09 0.00 153 T 8.70 3.93 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 1.23 0.00 0.00 154 K 8.00 4.02 0.00 1.77 1.95 0.00 1.65 0.00 0.00 1.66 0.00 0.00 3.10 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.47 1.58 7.81 155 H 7.96 4.47 0.00 3.16 3.36 0.00 5.95 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 0.00 156 R 7.15 4.13 0.00 2.10 1.88 0.00 3.43 0.00 0.00 3.21 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.75 0.00 157 L 8.36 4.08 0.00 1.51 1.74 0.86 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 158 N 8.26 5.04 0.00 2.83 2.69 0.00 0.00 6.99 8.03 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 0.00 159 P 0.00 4.32 0.00 2.14 2.15 0.00 3.61 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.36 0.00 160 A 7.87 3.85 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 0.00 161 D 8.13 4.37 0.00 2.82 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 0.00 162 A 7.96 4.04 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 V 7.68 3.18 1.94 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 0.73 0.00 0.00 0.01 0.00 0.00 164 A 7.89 4.00 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 0.00 165 F 7.79 4.05 0.00 3.00 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 0.00 166 I 7.85 3.73 1.99 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 1.71 1.15 0.89 0.00 0.00 167 E 8.76 4.29 0.00 2.02 2.04 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 2.24 2.24 0.00 168 S 7.97 4.66 0.00 3.85 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 0.00 169 T 7.63 4.37 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 1.34 0.00 0.00 170 Y 7.53 3.52 0.00 3.07 3.02 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 0.00 171 D 7.07 4.34 0.00 2.81 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 0.00 172 V 8.17 4.38 2.05 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 0.85 0.00 0.00 0.90 0.00 0.00 173 E 8.36 4.34 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 2.34 2.23 0.00 174 V 8.34 4.25 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 0.94 0.00 0.00 0.89 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.