NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 K 4.0518 8.3149 121.7209 55.4937 34.2447 175.9578 4 W 4.1308 7.1005 118.4395 56.3266 29.8701 173.1869 5 R 4.5618 9.0353 120.4803 55.5142 32.2434 175.2759 6 F 5.3279 9.0729 122.0381 55.5655 42.9355 173.9740 7 L 5.0031 8.8907 124.9416 53.5087 43.9849 175.0300 8 G 4.5560 9.1967 114.8096 44.5916 0.0000 171.7069 9 I 5.2282 8.7079 126.1627 59.7100 39.8225 174.4314 10 D 4.9757 9.1236 124.9126 53.1415 45.6109 172.7059 11 D 5.4905 8.4828 119.7602 52.1813 42.7143 174.4866 12 S 5.0071 8.9106 112.6493 57.8611 67.6407 174.0863 13 F 5.2101 8.3798 116.1821 55.8107 41.1650 173.6457 14 D 4.7928 8.4308 122.6421 52.7770 39.9307 176.3302 15 D 4.6405 8.8715 116.0083 55.1094 40.0944 177.2536 16 R 4.4988 8.9682 117.5330 56.6129 32.9709 175.6679 17 K 4.6655 8.1264 116.5897 54.4449 35.7565 173.8111 18 C 5.4762 8.5453 123.8929 57.7830 34.6498 172.1408 19 C 5.0415 8.9577 121.1034 56.3829 32.4723 172.7600 20 V 4.8101 8.5821 120.8812 61.1183 34.0464 174.2568 21 V 4.9134 9.0891 127.9211 61.0682 34.4989 174.2302 22 G 4.6187 9.3310 114.8475 44.5900 0.0000 171.5149 23 C 4.9719 9.1558 123.3788 57.1335 35.3614 172.5700 24 V 4.7731 8.3411 126.3515 61.2930 33.1616 174.4274 25 T 5.0642 8.6651 117.6653 59.9875 72.5979 172.7092 26 C 4.9076 8.1916 122.7452 56.8035 34.5403 174.0154 27 G 3.7546 9.9311 114.7073 46.5611 0.0000 174.0824 28 G 3.9728 8.6423 108.0939 44.9408 0.0000 173.6339 29 Y 4.2803 7.8159 122.2942 56.5658 39.3408 174.5190 30 V 3.8427 7.7069 127.5420 62.8516 32.0403 174.9288 31 E 4.5151 8.4296 126.3891 56.6149 31.9351 175.8723 32 G 4.1015 6.8050 104.6216 45.9602 0.0000 172.1687 33 F 5.5652 8.8747 117.3604 55.7009 43.2247 174.4784 34 L 5.1412 9.3382 120.5353 53.4511 45.9590 175.0285 35 Y 5.3077 8.5418 121.3936 56.7139 42.1536 173.6448 36 T 4.5474 8.4418 119.5617 60.9342 71.8227 171.6472 37 E 5.1462 8.5120 122.7888 54.3806 32.4850 175.3574 38 I 4.8584 8.0125 114.8207 58.9673 41.7384 174.4485 39 D 4.5092 9.1047 122.6276 53.4934 41.2028 176.6359 40 I 3.7315 8.2892 125.1669 62.8935 37.4423 175.3047 41 D 4.4680 8.9175 123.8240 55.1866 39.7234 174.7729 42 G 4.1077 7.5709 110.8782 45.0926 0.0000 174.8519 43 L 4.7927 8.3150 118.8590 53.6686 43.9063 177.0145 44 D 4.6555 7.9764 118.3736 53.6991 39.8363 177.8303 45 A 3.9492 8.2674 123.9330 55.6779 18.3226 179.9502 46 T 3.7881 7.8197 113.6920 66.8375 68.6127 176.3329 47 D 4.3348 8.0324 120.0983 57.4557 40.7410 178.6763 48 K 3.8618 7.9996 117.5997 59.6708 32.1551 179.0627 49 L 4.1488 8.1852 118.0952 57.8034 41.6395 179.3066 50 I 3.9154 7.6947 118.5971 64.2836 37.2706 179.7537 51 S 4.1351 8.5040 112.6237 58.6965 62.1761 175.6586 *53 V 4.0728 7.7680 119.3319 61.9103 32.7973 175.5315 54 R 4.0240 7.3135 117.6222 57.3894 30.6999 182.2399 55 R 2.9536 6.9258 115.4453 58.2607 33.3525 176.6212 56 S 4.5033 7.8847 117.0993 57.7481 63.3108 174.4792 57 K 4.2167 8.4720 121.6693 57.3230 33.2557 177.1067 58 F 4.7470 8.0185 118.1275 57.0504 39.5153 177.4407 59 R 4.0994 8.1408 118.4017 59.0060 28.9884 177.1450 60 E 4.5040 8.1407 114.6842 56.1540 29.6876 176.0995 61 Q 4.5620 8.2972 117.6081 55.6582 30.2610 175.8567 62 I 4.1125 7.6552 119.8975 60.8300 37.7679 175.5644 63 K 4.1602 9.0357 128.7155 59.2239 32.4251 176.3653 64 C 4.7674 7.8516 112.3708 57.2398 33.3205 172.0105 65 I 4.8158 8.4090 120.7941 59.8643 38.8386 174.8223 66 F 5.4269 9.3787 126.0301 55.8646 41.3548 174.8798 67 L 5.2384 8.7588 122.6782 52.3664 45.0753 175.4762 68 P 5.0767 0.0000 0.0000 61.6899 31.8735 175.7104 69 G 3.9852 7.1833 108.2482 45.9129 0.0000 172.4292 70 I 4.0004 7.4440 111.3383 61.8758 38.1611 175.7857 71 T 4.7480 7.6463 111.7047 60.7803 67.7371 173.4492 72 L 4.7233 8.3382 128.9433 54.3243 44.0399 176.8861 73 G 3.5783 10.7257 109.1167 46.2537 0.0000 176.4238 74 G 3.3949 8.1059 109.8384 44.6708 0.0000 174.5854 75 F 5.1122 5.8053 114.7962 56.9690 40.3578 176.0562 76 N 5.3487 7.9638 122.3651 52.2386 37.9351 173.7486 77 L 4.5560 8.2502 123.7505 54.0905 43.1903 176.0125 78 V 4.1296 8.2653 122.6739 61.7191 32.9636 175.9932 79 D 4.6240 8.9560 128.3978 53.2564 40.9679 176.5959 80 I 3.8302 8.1350 122.2546 63.6864 37.7241 178.0545 81 Q 4.0917 8.1091 119.7574 58.8828 28.5554 178.3366 82 R 3.8681 8.9919 120.1583 59.1939 30.0609 178.5610 83 V 3.5783 7.9365 118.1565 66.3402 31.5576 177.3874 84 Y 4.7938 8.0232 120.3628 60.3591 38.3826 178.3018 85 R 3.5493 8.0186 118.2189 59.2385 30.2806 178.6075 86 E 4.0936 8.3044 117.7834 58.9325 29.5736 178.6582 87 T 4.1639 7.9754 108.5319 61.4016 69.5673 176.1263 88 K 3.6995 7.7377 118.2876 56.4420 30.9421 175.2980 89 I 4.3934 7.6463 121.6683 58.8614 38.3790 173.6718 90 P 4.7487 0.0000 0.0000 62.8753 32.8601 175.1152 91 V 4.6886 8.6658 121.1505 61.0717 34.6911 174.2870 92 V 4.7522 8.6147 127.5733 61.1061 34.2425 174.1689 93 V 4.6092 8.9920 129.2486 62.0273 32.8964 174.9872 94 V 5.0342 8.8385 127.5087 60.4433 34.4153 176.3057 *96 R 4.3520 8.5276 121.8863 55.3084 31.9256 176.2593 97 R 4.5477 7.7297 115.9007 53.4768 32.2473 174.9837 98 K 3.1130 8.4257 123.9785 55.5747 31.9189 174.2749 99 P 4.3328 0.0000 0.0000 62.3394 32.1734 176.2894 100 D 4.4707 8.3575 122.1172 54.2030 41.9177 176.9122 *102 E 4.2809 8.6178 119.2321 56.7895 31.4386 178.6869 103 E 4.1089 7.9892 118.7748 58.6278 29.2164 179.1185 104 F 4.1391 8.0908 120.4649 61.2654 39.5560 176.4933 105 D 4.4698 8.1646 116.5866 56.8386 41.0365 178.0552 106 S 4.1735 7.8194 115.0375 61.0535 63.3824 178.0639 107 A 3.9123 7.6473 125.5307 50.9944 17.8523 178.4512 *109 R 3.9816 7.9838 119.3811 57.2106 31.5526 176.6278 110 N 4.3731 7.9738 114.8540 55.4627 38.7906 175.2531 111 L 4.3850 7.4441 117.1636 53.2246 42.8817 175.8708 112 E 3.9394 8.5082 121.2037 57.6023 30.5820 176.1705 113 N 4.1287 8.8459 122.0200 54.6435 37.1898 173.6735 114 Y 4.0632 7.7373 121.4199 60.4638 39.4419 176.6293 115 E 3.6058 8.1918 119.1596 59.2005 29.7602 178.7790 116 L 3.8589 7.6220 119.2227 58.3197 42.1383 179.2709 117 R 3.8716 7.5637 117.9332 59.1862 29.9874 178.8396 118 R 3.6964 8.0426 118.7643 59.4579 29.9210 178.6772 119 K 3.9383 7.8561 118.0403 59.4189 31.7237 179.3947 120 I 3.6956 7.6032 119.6979 64.3437 36.8123 178.5342 121 V 3.6730 7.5740 117.8679 65.9817 31.5584 177.3793 122 E 4.0616 8.1127 118.8979 59.5163 29.3416 179.3086 123 V 3.6949 7.7731 110.6248 63.9903 31.5801 177.9579 124 A 4.0884 7.3799 119.0173 55.0105 18.6178 178.8048 125 G 3.7819 8.0710 103.8787 44.8897 0.0000 172.7353 126 E 4.0108 8.5541 120.1417 56.5050 30.1539 175.9576 127 I 4.5350 8.0537 123.4405 60.1965 38.9362 174.5989 128 H 4.9656 8.9724 124.5313 53.6930 31.5074 173.5643 129 R 3.9153 8.8251 124.0258 56.0202 30.2179 176.5598 130 I 4.1429 8.2960 129.6827 59.0190 36.5209 173.3675 131 G 3.9581 8.1237 114.6705 44.9935 0.0000 171.2941 132 D 4.4201 7.3524 116.6406 54.4075 45.9516 175.9798 133 I 4.2472 7.3190 111.7690 60.1953 40.3928 173.8072 134 Y 5.2865 8.4004 118.7022 56.1105 41.1895 175.1399 135 I 5.7147 8.7657 116.0863 58.4015 41.5188 174.2648 136 Q 5.2978 8.6133 121.1681 54.4943 32.7619 174.3986 137 T 5.1621 8.3913 109.6872 60.0584 72.5239 172.9298 138 A 4.2974 9.0356 124.6631 51.4502 21.8381 177.0278 139 G 2.5216 9.9303 110.5828 44.7687 0.0000 172.5860 140 L 4.5462 6.7782 117.1155 52.0054 45.8656 176.3112 141 T 4.1930 8.2100 111.8854 60.5234 71.0272 173.9011 142 P 4.1055 0.0000 0.0000 66.1343 31.2573 179.1149 143 S 4.0653 7.8695 112.9370 61.6225 62.9661 176.3499 144 E 3.8851 8.1210 121.0317 59.2664 29.1242 179.2635 145 A 3.8968 8.0714 120.7522 55.1343 18.4990 178.8932 146 E 3.8206 8.4890 118.2821 59.5932 29.5797 178.9759 147 K 3.9387 7.9543 119.1450 59.7493 32.0128 178.7196 148 L 4.1609 7.6487 117.7476 57.5850 41.9035 179.2862 149 V 3.4238 8.2060 118.6559 65.9407 31.3637 178.1763 150 K 3.9056 8.0850 117.9004 59.5530 31.6938 179.2330 151 A 4.2182 8.0814 120.0100 54.5188 18.7671 178.8417 152 S 4.4374 7.6442 110.7861 58.0838 63.6523 174.0391 153 L 4.4350 6.9967 123.4072 54.2731 42.1891 174.6155 154 I 4.1588 7.8446 120.5743 60.3265 39.5691 175.6507 155 K 4.4278 8.1220 122.7942 55.9191 34.9503 177.6353 156 G 3.8437 8.5619 110.9699 45.1654 0.0000 173.4290 157 N 4.6738 8.1212 113.9483 50.7159 36.5405 173.0926 *159 P 4.0211 0.0000 0.0000 62.4307 33.7684 176.2883 160 E 3.8904 8.5656 124.1631 59.1792 29.5878 177.5568 161 P 4.3782 0.0000 0.0000 65.1855 31.4392 178.6434 162 V 3.5647 7.6849 118.2542 66.0001 31.4911 177.2983 163 R 3.8975 7.8778 118.5454 59.9605 29.7828 178.3997 164 I 3.8701 7.8830 119.1142 64.4716 37.0856 178.5933 165 S 4.3312 8.4105 116.1501 61.7383 62.5464 176.1222 166 H 4.1603 8.5314 121.1056 59.3643 29.6225 177.2775 167 L 3.9222 7.7622 120.7254 57.7219 41.4602 179.6720 168 V 3.4612 7.8715 117.8666 65.8915 31.5811 177.6293 169 A 4.0545 8.2427 120.7140 55.5383 18.2482 179.5855 170 S 4.1230 8.5114 112.6157 60.8167 62.3001 175.9897 171 A 3.9875 8.0289 123.5100 55.3256 17.8522 179.7585 172 I 3.6136 7.5867 116.9212 64.4925 37.2923 178.5276 173 I 3.8931 7.6057 119.0560 64.1802 37.2660 176.7416 174 H 4.7587 8.4457 114.4731 56.3080 30.7284 174.8449 175 G 3.8583 7.5297 111.8904 45.9132 0.0000 172.9567 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 3 K 8.31 4.05 0.00 1.35 1.31 0.00 1.53 0.00 0.00 1.52 0.00 0.00 2.86 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.16 1.23 7.81 4 W 7.10 4.13 0.00 2.74 2.46 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 0.00 5 R 9.04 4.56 0.00 1.99 1.78 0.00 3.10 0.00 0.00 3.39 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 6 F 9.07 5.33 0.00 3.14 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 7 L 8.89 5.00 0.00 1.79 1.55 0.99 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 8 G 9.20 4.56 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 0.00 0.00 0.00 9 I 8.71 5.23 1.93 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 0.77 0.95 0.00 0.00 10 D 9.12 4.98 0.00 2.75 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.48 5.49 0.00 2.84 2.64 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 12 S 8.91 5.01 0.00 3.87 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 13 F 8.38 5.21 0.00 3.18 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 14 D 8.43 4.79 0.00 2.74 2.48 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.87 4.64 0.00 2.84 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 16 R 8.97 4.50 0.00 1.74 1.98 0.00 3.12 0.00 0.00 3.16 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.54 0.00 17 K 8.13 4.67 0.00 1.76 1.62 0.00 1.70 0.00 0.00 1.83 0.00 0.00 3.07 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.43 7.81 18 C 8.55 5.48 0.00 2.98 2.89 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 19 C 8.96 5.04 0.00 2.78 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 20 V 8.58 4.81 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 1.00 0.00 0.00 0.88 0.00 0.00 21 V 9.09 4.91 2.33 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 1.13 0.00 0.00 1.13 0.00 0.00 22 G 9.33 4.62 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 0.00 0.00 0.00 23 C 9.16 4.97 0.00 3.01 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 24 V 8.34 4.77 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 0.33 0.00 0.00 0.74 0.00 0.00 25 T 8.67 5.06 4.29 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 1.14 0.00 0.00 26 C 8.19 4.91 0.00 3.06 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 27 G 9.93 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 28 G 8.64 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 29 Y 7.82 4.28 0.00 3.06 3.05 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 30 V 7.71 3.84 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 0.56 0.00 0.00 0.84 0.00 0.00 31 E 8.43 4.52 0.00 1.51 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 2.42 2.46 0.00 32 G 6.81 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 33 F 8.87 5.57 0.00 2.94 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 34 L 9.34 5.14 0.00 1.61 1.61 1.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 35 Y 8.54 5.31 0.00 2.95 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 36 T 8.44 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 1.12 0.00 0.00 37 E 8.51 5.15 0.00 1.82 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.07 0.00 38 I 8.01 4.86 2.00 0.00 0.00 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 1.16 0.58 0.86 0.00 0.00 39 D 9.10 4.51 0.00 2.81 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 40 I 8.29 3.73 1.83 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.42 0.73 0.00 0.00 41 D 8.92 4.47 0.00 2.76 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 42 G 7.57 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 0.00 0.00 0.00 0.00 43 L 8.32 4.79 0.00 1.58 1.64 0.92 0.97 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 44 D 7.98 4.66 0.00 2.85 2.89 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 45 A 8.27 3.95 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 46 T 7.82 3.79 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 1.27 0.00 0.00 47 D 8.03 4.33 0.00 2.81 2.71 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 48 K 8.00 3.86 0.00 1.82 1.86 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.62 1.62 7.81 49 L 8.19 4.15 0.00 1.71 1.74 0.99 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 50 I 7.69 3.92 1.99 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 1.41 0.64 0.91 0.00 0.00 51 S 8.50 4.14 0.00 3.90 3.98 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 0.00 0.00 0.00 *53 V 7.77 4.07 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 0.89 0.00 0.00 1.02 0.00 0.00 54 R 7.31 4.02 0.00 2.09 1.87 0.00 3.17 0.00 0.00 3.09 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.71 0.00 55 R 6.93 2.95 0.00 2.06 2.28 0.00 3.30 0.00 0.00 3.22 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 0.00 56 S 7.88 4.50 0.00 3.99 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 K 8.47 4.22 0.00 1.70 1.79 0.00 1.26 0.00 0.00 1.51 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 0.86 0.51 7.81 58 F 8.02 4.75 0.00 3.14 3.07 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 0.00 0.00 0.00 59 R 8.14 4.10 0.00 1.99 2.31 0.00 3.03 0.00 0.00 3.39 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.69 0.00 60 E 8.14 4.50 0.00 1.98 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 0.00 2.25 2.32 0.00 61 Q 8.30 4.56 0.00 2.29 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0.00 0.00 0.00 0.00 0.00 1.19 1.00 0.84 0.00 0.00 131 G 8.12 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 0.00 0.00 0.00 0.00 0.00 0.00 132 D 7.35 4.42 0.00 2.51 2.52 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 0.00 133 I 7.32 4.25 1.85 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 1.39 0.72 0.89 0.00 0.00 134 Y 8.40 5.29 0.00 2.88 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 0.00 135 I 8.77 5.71 1.95 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 1.29 1.47 0.92 0.00 0.00 136 Q 8.61 5.30 0.00 1.98 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.86 0.00 0.00 0.00 0.00 0.00 2.49 2.30 0.00 137 T 8.39 5.16 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 1.20 0.00 0.00 138 A 9.04 4.30 1.24 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 0.00 139 G 9.93 2.52 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 0.00 140 L 6.78 4.55 0.00 1.44 1.40 0.77 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 141 T 8.21 4.19 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 1.17 0.00 0.00 142 P 0.00 4.11 0.00 2.03 1.87 0.00 3.51 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.72 0.00 143 S 7.87 4.07 0.00 3.83 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 0.00 144 E 8.12 3.89 0.00 1.95 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 0.00 2.28 2.29 0.00 145 A 8.07 3.90 1.34 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 0.00 146 E 8.49 3.82 0.00 2.07 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 0.00 2.31 2.32 0.00 147 K 7.95 3.94 0.00 1.92 2.00 0.00 1.76 0.00 0.00 1.73 0.00 0.00 3.32 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.58 1.63 7.81 148 L 7.65 4.16 0.00 1.85 1.80 0.72 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 149 V 8.21 3.42 2.17 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 0.85 0.00 0.00 1.00 0.00 0.00 150 K 8.08 3.91 0.00 2.03 1.87 0.00 1.73 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.59 7.81 151 A 8.08 4.22 1.89 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 0.00 152 S 7.64 4.44 0.00 3.58 3.38 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 0.00 153 L 7.00 4.43 0.00 1.57 1.57 0.86 0.58 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 0.00 154 I 7.84 4.16 2.02 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 0.88 0.92 0.00 0.00 155 K 8.12 4.43 0.00 1.71 1.70 0.00 1.82 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.35 1.40 7.81 156 G 8.56 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 0.00 0.00 0.00 157 N 8.12 4.67 0.00 2.73 2.79 0.00 0.00 5.92 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 *159 P 0.00 4.02 0.00 1.73 0.77 0.00 3.64 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.93 0.00 160 E 8.57 3.89 0.00 2.15 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 2.34 2.40 0.00 161 P 0.00 4.38 0.00 2.54 2.32 0.00 3.57 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.22 0.00 162 V 7.68 3.56 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 1.09 0.00 0.00 1.02 0.00 0.00 163 R 7.88 3.90 0.00 1.91 2.13 0.00 3.15 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.71 0.00 164 I 7.88 3.87 1.94 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.51 1.15 0.00 0.00 165 S 8.41 4.33 0.00 4.13 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 0.00 166 H 8.53 4.16 0.00 3.48 3.55 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 L 7.76 3.92 0.00 1.90 1.71 0.95 0.93 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 0.00 168 V 7.87 3.46 2.23 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 0.88 0.00 0.00 0.77 0.00 0.00 169 A 8.24 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 170 S 8.51 4.12 0.00 3.77 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 0.00 171 A 8.03 3.99 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 0.00 172 I 7.59 3.61 2.04 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 1.47 0.71 0.96 0.00 0.00 173 I 7.61 3.89 1.66 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.79 0.57 0.00 0.00 174 H 8.45 4.76 0.00 3.16 3.26 0.00 5.67 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 0.00 175 G 7.53 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.