NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 F 5.1002 8.3244 116.0071 56.8719 39.7051 173.3874 5 V 4.3160 8.8477 119.4807 60.7543 34.4400 172.5855 6 I 5.1729 8.3699 128.5401 59.7393 39.3530 174.5556 7 R 4.8121 8.8934 122.2041 54.0792 33.2768 172.7076 8 P 4.9910 0.0000 0.0000 62.5335 32.0287 176.4155 9 A 4.7093 9.0266 125.6559 52.2217 19.5366 176.4826 10 T 4.5705 9.5279 108.7207 58.7050 72.1634 174.9960 11 A 2.5800 7.8207 122.5766 54.8267 17.8421 179.4821 12 A 3.9960 7.2525 117.4044 54.2774 18.6652 178.4648 13 D 4.5085 7.9902 116.8557 54.9019 41.1729 177.8911 14 C 4.0446 7.6853 118.4685 62.9938 28.1477 175.8712 15 S 4.0106 7.9273 113.9040 61.6684 61.9778 175.9437 16 D 4.2126 7.8896 120.9139 57.1761 40.4606 178.7154 17 I 3.2642 7.8184 120.7615 64.0899 37.1065 178.2303 18 L 3.7950 7.9447 121.2941 57.8702 41.8743 178.9291 19 R 3.7606 7.8430 118.7237 59.4644 29.9842 178.5991 20 L 3.8729 7.7868 118.8750 57.5617 41.4946 179.4724 21 I 3.7200 7.5216 120.1228 64.4022 36.9635 178.6651 22 K 3.9650 8.0041 119.2339 59.2574 31.7601 179.3744 23 E 3.8067 7.8642 119.0442 59.1279 29.4067 179.0871 24 L 3.3433 7.2434 120.1193 57.8939 41.8839 178.8960 25 A 4.0244 7.6647 119.5966 55.1053 18.4811 179.3111 26 R 3.8508 8.0612 117.5132 59.6014 29.9357 178.0528 27 Y 3.9975 8.1056 118.8774 60.0676 38.7691 176.9707 28 E 4.5289 7.8128 116.8054 54.6902 31.1286 175.5885 29 Y 3.2986 7.2198 117.7674 58.6359 35.5120 169.2195 *31 E 4.3256 7.8809 122.5406 55.8050 31.8217 177.1802 32 E 4.2185 8.1158 114.6161 58.0865 29.9882 177.8513 33 Q 3.9688 7.9406 118.3977 58.4922 29.0025 176.1615 34 V 3.7321 7.5588 117.4111 62.8736 30.6516 175.3284 35 I 4.3756 8.0331 119.7374 60.2769 38.4937 176.0605 36 L 4.2455 7.7611 121.6295 55.1177 42.2579 176.7695 37 T 4.5518 9.2429 113.2637 59.7789 72.5017 175.4748 38 E 3.9160 8.4424 120.6537 59.2431 29.6095 178.3017 39 K 3.9428 8.0613 119.2213 59.5417 32.2577 178.1438 40 D 4.3906 8.3174 119.3544 57.5936 40.7540 178.8036 41 L 4.2901 8.0022 119.2843 57.7496 41.5713 179.4623 42 L 4.2900 8.2405 120.1827 58.3695 42.0789 178.9393 43 E 4.0286 8.4137 118.5000 59.7073 29.4112 179.0931 44 D 4.7198 9.0556 119.0209 56.3036 40.7525 178.3395 45 G 2.6547 8.0902 106.1727 43.7363 0.0000 174.2782 46 F 4.6551 7.9420 116.2111 56.6438 39.3319 175.6621 47 G 3.9791 7.5240 111.1423 44.9306 0.0000 174.3909 48 E 4.0781 8.7595 117.6669 58.6127 29.5028 176.5459 49 H 4.4973 7.3944 116.2647 53.2532 31.1002 170.8858 50 P 4.2880 0.0000 0.0000 62.3049 31.6216 176.7918 51 F 4.3412 9.0610 121.7728 57.9795 39.6393 174.6473 52 Y 4.9223 6.5012 117.9439 56.4485 41.0806 172.9315 53 H 4.8337 8.7409 116.6665 54.1135 32.6598 172.9015 54 C 5.2756 8.5123 119.4023 58.0421 35.4491 172.4525 55 L 5.4206 9.0478 124.7421 53.2634 44.6259 175.8741 56 V 5.1776 9.0945 114.4143 59.6779 36.4827 174.3156 57 A 5.2323 8.9413 125.1934 50.4819 20.9632 175.3192 58 E 5.0991 9.3794 124.4477 54.7574 32.2387 175.5716 59 V 4.9138 8.5353 119.9339 58.8235 34.5126 174.1437 60 P 4.5006 0.0000 0.0000 62.2491 32.1842 177.5707 61 K 2.0000 8.5991 122.0591 59.0304 31.9627 178.7011 62 E 3.7821 7.8897 116.6104 59.0249 29.3814 177.3626 63 H 5.0340 8.0335 114.1160 55.1328 29.2087 174.5191 64 W 4.7741 7.8768 119.9763 56.8154 29.6074 176.0808 65 T 4.4622 8.5344 110.2210 60.4621 68.7888 173.6951 66 P 4.5191 0.0000 0.0000 65.7364 31.3282 177.6038 67 E 4.0924 8.1557 115.0362 56.9207 29.6873 177.1946 68 G 3.9837 8.7125 107.5717 46.0007 0.0000 172.8064 69 H 4.4736 8.0959 116.8187 53.7151 30.5128 175.9420 70 S 4.0873 7.5968 116.9290 59.5461 64.6984 173.4531 71 I 4.6101 7.4116 121.6966 60.2751 37.5924 175.9426 72 V 4.1525 8.4056 119.3921 60.5957 33.0170 175.3389 73 G 4.2875 7.6428 106.8523 45.9497 0.0000 172.1466 74 F 5.5479 9.0561 113.9861 56.4974 41.9032 172.7430 75 A 5.1382 8.7602 120.1483 49.6682 22.8580 174.3340 *77 Y 4.7263 8.2950 113.8116 57.7087 39.9246 173.3467 78 Y 4.8481 7.7505 116.3923 56.0933 41.9184 173.5007 79 F 5.5258 8.7956 118.6260 56.7905 41.1077 175.2248 80 T 5.0564 9.0539 111.4412 60.3318 72.6875 171.5291 81 Y 5.1554 8.5377 120.7585 56.0753 42.2168 173.6946 82 D 4.8899 8.1894 125.6617 51.5232 43.2513 174.9637 83 P 4.3569 0.0000 0.0000 64.8498 31.4937 177.0737 84 W 4.8353 8.3671 118.7750 57.7130 29.6840 176.9609 85 I 4.4136 8.1105 108.1848 59.7528 39.5976 176.2227 86 G 3.1954 8.2771 108.1149 43.3751 0.0000 172.8180 87 K 4.5844 8.4841 120.8200 57.0075 33.2624 176.2573 88 L 5.1856 8.9622 123.2605 52.8879 46.4021 175.0097 89 L 5.0667 8.5815 123.8729 53.6954 43.8447 174.8228 90 Y 4.4418 8.8904 128.5804 55.7299 40.7514 173.9964 91 L 4.2339 7.9413 130.2171 54.0939 42.1846 175.7457 92 E 4.4268 8.8768 127.6619 58.1788 30.3528 176.0283 93 D 4.9350 7.6286 117.1341 52.4469 44.4798 174.4774 94 F 5.0340 8.4216 124.4145 57.3916 42.1899 173.0640 95 F 4.4905 8.9522 127.5025 56.3919 42.9518 171.9673 96 V 4.0239 6.8716 125.9715 63.0558 34.1956 176.2538 *98 S 4.3138 8.9205 109.1460 58.1806 63.5778 175.2130 99 D 4.3442 8.0006 117.0372 56.1653 40.8139 176.4969 100 Y 3.5438 7.3812 115.6835 57.1519 37.5237 175.7011 101 R 3.9757 7.4416 120.0032 56.5936 30.9162 177.1282 102 G 3.8885 8.5803 106.4407 46.5647 0.0000 174.3866 103 F 4.6437 7.9323 115.0439 56.8666 40.1078 176.7633 104 G 4.2279 8.3457 109.4071 45.3260 0.0000 175.5850 105 I 3.1352 7.6169 121.2646 64.1223 37.0901 178.3309 106 G 3.6150 7.8568 106.0397 47.9317 0.0000 175.6918 107 S 4.3800 8.2910 117.0981 61.5235 62.9402 176.2774 108 E 4.1165 8.5310 122.0742 59.1390 29.3137 178.8711 109 I 3.7743 8.2265 120.2863 64.3559 37.1945 178.1600 110 L 3.7325 8.2171 121.1652 57.7490 41.8554 178.9634 111 K 3.9240 8.1229 119.8571 59.5139 32.1684 178.6121 112 N 4.3413 8.3019 116.7957 56.3057 38.3982 177.4061 113 L 3.7096 8.0760 120.6532 57.7747 41.3935 179.7478 114 S 4.0934 7.8887 114.2835 61.6429 62.7967 176.4849 115 Q 4.1139 7.8020 119.9005 58.7758 28.7235 178.5351 116 V 3.8090 7.8126 119.0882 65.8632 31.5379 178.3977 117 A 4.1872 8.0492 116.9481 53.3116 17.8200 178.8042 *119 R 4.1502 7.8496 121.6266 57.7633 31.6215 176.0206 120 C 4.1478 8.1999 114.7313 59.0915 31.8044 172.8594 121 R 3.8368 7.7033 115.8880 58.1359 27.0582 176.0706 122 C 4.5031 8.3460 114.9432 59.4622 29.0443 174.7741 123 S 4.4778 8.3080 117.3575 60.0331 64.3569 174.6362 124 S 4.1408 7.3289 118.0071 58.3170 68.3246 173.1510 *126 H 4.7086 8.7616 114.4352 55.7427 30.2705 172.2218 127 F 4.2951 7.1273 113.2028 56.3981 39.9876 172.9148 128 L 4.6644 8.5791 119.6255 53.0676 43.4833 176.4270 129 V 4.4515 8.0045 120.6612 60.4936 34.6122 175.1063 130 A 4.0598 8.4117 129.9350 51.8587 18.8236 177.9191 131 E 3.9272 8.9154 120.9557 59.0420 29.4367 178.4197 132 W 4.4266 7.5856 114.1796 57.8292 29.4878 176.8748 133 N 4.1589 6.7163 120.5411 51.7959 34.6960 174.3472 134 E 3.9246 8.0677 125.1882 58.9028 30.2226 175.9410 135 P 4.2867 0.0000 0.0000 65.8882 31.3822 178.7557 136 S 4.0331 8.2036 113.4703 61.1998 62.6089 176.8043 137 I 3.9178 7.9884 122.8409 64.5870 36.8767 178.2118 138 N 4.3761 8.8043 117.6606 56.0774 38.1211 177.0359 139 F 4.0663 8.1321 121.1782 61.7295 39.7245 176.6012 140 Y 4.4713 8.4136 116.3350 61.2613 37.9027 178.7448 141 K 4.2917 8.6151 119.5684 59.2210 31.8902 179.3901 142 R 4.0263 8.0816 118.3448 58.4010 29.9107 177.5069 143 R 4.5076 7.5482 116.6879 55.7358 30.8682 177.2150 144 G 3.8899 7.8327 106.1975 45.0998 0.0000 174.5291 145 A 4.2631 7.6561 121.9057 52.0952 19.0825 176.8782 146 S 4.7021 7.8953 112.9609 56.2930 66.2739 173.7666 147 D 4.3092 8.4719 120.9158 54.2429 41.1048 175.8483 148 L 4.4854 8.1138 124.0984 53.6323 43.4524 176.2240 149 S 4.5527 8.5041 121.6080 58.3675 63.4822 175.9363 150 S 3.9881 8.0427 115.9148 61.2690 62.4948 174.9421 151 E 4.1907 7.9380 118.7178 55.5009 29.7867 174.9291 152 E 4.2040 8.1375 119.7838 58.3884 30.0027 176.9312 153 G 3.9494 9.1642 113.3901 45.2483 0.0000 172.8100 154 W 4.7764 8.0495 118.3185 54.5680 32.1178 175.0471 155 R 4.4571 8.4320 119.7101 54.1391 31.8511 175.3954 156 L 4.2847 7.9559 123.6062 53.9254 43.0490 175.6873 157 F 5.2058 8.5087 123.5512 55.4975 42.5580 174.2777 158 K 4.6873 8.4970 119.8728 55.2356 35.3832 176.1054 159 I 4.3929 8.1534 120.7089 59.2903 39.0979 175.9399 160 D 4.7055 8.6029 125.5611 53.0807 42.9886 177.0216 161 K 3.8040 8.6351 121.4291 60.0437 31.9062 177.8319 162 E 3.7449 8.1420 118.6347 59.8161 29.2409 178.4250 163 Y 4.2033 7.6687 114.2410 60.5545 38.1084 177.6763 164 L 4.1838 7.7923 119.7074 57.5963 42.1745 178.7904 165 L 4.1262 8.3374 120.7805 57.8606 41.7160 179.0215 166 K 3.7864 7.7976 115.4994 57.8685 31.8335 177.7048 *168 A 4.2472 7.9142 121.8211 51.4735 20.2388 178.1668 169 T 4.4965 7.5548 102.5378 61.2810 69.3763 174.3723 170 E 4.1288 7.8474 127.2087 57.0822 29.3583 176.6144 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 4 F 8.32 5.10 0.00 3.18 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 5 V 8.85 4.32 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 1.09 0.00 0.00 0.96 0.00 0.00 6 I 8.37 5.17 1.98 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.22 1.01 0.00 0.00 7 R 8.89 4.81 0.00 1.91 2.04 0.00 2.83 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.69 0.00 8 P 0.00 4.99 0.00 2.06 2.14 0.00 3.75 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.19 0.00 9 A 9.03 4.71 1.50 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 10 T 9.53 4.57 4.12 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 1.22 0.00 0.00 11 A 7.82 2.58 1.06 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 0.00 0.00 12 A 7.25 4.00 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 13 D 7.99 4.51 0.00 2.75 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 14 C 7.69 4.04 0.00 2.94 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 15 S 7.93 4.01 0.00 3.82 3.77 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 16 D 7.89 4.21 0.00 2.82 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 17 I 7.82 3.26 1.98 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.83 0.78 0.00 0.00 18 L 7.94 3.80 0.00 1.69 1.57 0.92 0.71 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 19 R 7.84 3.76 0.00 1.85 1.88 0.00 3.02 0.00 0.00 2.92 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.57 0.00 20 L 7.79 3.87 0.00 1.42 0.78 1.04 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 21 I 7.52 3.72 1.89 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 1.67 0.77 0.88 0.00 0.00 22 K 8.00 3.96 0.00 1.92 1.94 0.00 1.60 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.40 1.51 7.81 23 E 7.86 3.81 0.00 1.77 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 2.49 0.00 24 L 7.24 3.34 0.00 1.05 1.61 1.04 1.28 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 25 A 7.66 4.02 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 26 R 8.06 3.85 0.00 2.00 2.09 0.00 3.20 0.00 0.00 3.06 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.49 0.00 27 Y 8.11 4.00 0.00 3.08 3.22 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 28 E 7.81 4.53 0.00 2.22 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 2.58 2.78 0.00 29 Y 7.22 3.30 0.00 3.08 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 *31 E 7.88 4.33 0.00 1.98 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 0.00 2.23 2.49 0.00 32 E 8.12 4.22 0.00 2.12 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 2.28 0.00 33 Q 7.94 3.97 0.00 2.08 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.15 0.00 0.00 0.00 0.00 0.00 2.38 2.32 0.00 34 V 7.56 3.73 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 0.74 0.00 0.00 0.91 0.00 0.00 35 I 8.03 4.38 1.86 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 1.41 0.81 0.96 0.00 0.00 36 L 7.76 4.25 0.00 1.63 1.62 0.88 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 37 T 9.24 4.55 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 1.20 0.00 0.00 38 E 8.44 3.92 0.00 2.04 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 2.38 2.35 0.00 39 K 8.06 3.94 0.00 1.87 1.81 0.00 1.79 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.63 1.56 7.81 40 D 8.32 4.39 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 41 L 8.00 4.29 0.00 2.00 1.98 0.90 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 42 L 8.24 4.29 0.00 1.85 1.93 0.95 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 43 E 8.41 4.03 0.00 2.37 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 2.37 2.40 0.00 44 D 9.06 4.72 0.00 2.92 2.94 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 45 G 8.09 2.65 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 F 7.94 4.66 0.00 3.01 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 47 G 7.52 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 0.00 0.00 0.00 48 E 8.76 4.08 0.00 1.97 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 0.00 2.33 2.25 0.00 49 H 7.39 4.50 0.00 2.95 2.98 0.00 5.75 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 P 0.00 4.29 0.00 1.56 1.59 0.00 3.36 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.86 0.00 51 F 9.06 4.34 0.00 3.02 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 52 Y 6.50 4.92 0.00 3.10 3.10 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 53 H 8.74 4.83 0.00 1.40 2.76 0.00 5.61 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 C 8.51 5.28 0.00 3.32 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 55 L 9.05 5.42 0.00 1.76 1.64 0.91 0.81 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 56 V 9.09 5.18 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 0.94 0.00 0.00 1.04 0.00 0.00 57 A 8.94 5.23 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 58 E 9.38 5.10 0.00 2.06 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 2.32 2.32 0.00 59 V 8.54 4.91 2.29 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 0.75 0.00 0.00 1.20 0.00 0.00 60 P 0.00 4.50 0.00 2.25 2.00 0.00 3.83 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.17 0.00 61 K 8.60 2.00 0.00 1.16 1.29 0.00 1.21 0.00 0.00 1.42 0.00 0.00 2.53 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.54 0.21 7.81 62 E 7.89 3.78 0.00 1.80 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.18 0.00 63 H 8.03 5.03 0.00 3.25 3.51 0.00 5.86 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 64 W 7.88 4.77 0.00 3.39 3.10 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 65 T 8.53 4.46 4.36 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.25 0.00 136 S 8.20 4.03 0.00 3.91 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 0.00 137 I 7.99 3.92 2.06 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 1.57 0.88 0.97 0.00 0.00 138 N 8.80 4.38 0.00 2.91 2.91 0.00 0.00 6.69 8.04 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 0.00 139 F 8.13 4.07 0.00 2.93 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 0.00 140 Y 8.41 4.47 0.00 3.44 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 0.00 141 K 8.62 4.29 0.00 1.94 1.90 0.00 1.70 0.00 0.00 1.60 0.00 0.00 2.90 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.68 1.68 7.81 142 R 8.08 4.03 0.00 1.87 2.00 0.00 3.23 0.00 0.00 3.20 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.64 0.00 143 R 7.55 4.51 0.00 1.84 1.81 0.00 2.28 0.00 0.00 2.81 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.34 0.00 144 G 7.83 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 0.00 145 A 7.66 4.26 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.90 4.70 0.00 3.89 3.76 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 0.00 147 D 8.47 4.31 0.00 2.65 2.59 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 0.00 148 L 8.11 4.49 0.00 1.32 1.33 0.81 0.44 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 0.00 149 S 8.50 4.55 0.00 3.93 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 0.00 150 S 8.04 3.99 0.00 3.79 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 0.00 151 E 7.94 4.19 0.00 1.93 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 2.42 2.24 0.00 152 E 8.14 4.20 0.00 2.17 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 2.36 2.35 0.00 153 G 9.16 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 0.00 154 W 8.05 4.78 0.00 3.34 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 0.00 155 R 8.43 4.46 0.00 1.30 1.11 0.00 3.22 0.00 0.00 3.26 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.52 0.00 156 L 7.96 4.28 0.00 1.50 1.44 0.90 0.65 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 0.00 157 F 8.51 5.21 0.00 3.05 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 0.00 158 K 8.50 4.69 0.00 1.84 1.77 0.00 1.72 0.00 0.00 1.74 0.00 0.00 2.97 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.36 1.49 7.81 159 I 8.15 4.39 1.90 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 1.37 0.68 0.98 0.00 0.00 160 D 8.60 4.71 0.00 2.83 2.65 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 0.00 0.00 0.00 0.00 161 K 8.64 3.80 0.00 1.80 1.82 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.85 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.48 1.51 7.81 162 E 8.14 3.74 0.00 1.86 1.52 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 1.70 2.12 0.00 163 Y 7.67 4.20 0.00 3.16 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 0.00 164 L 7.79 4.18 0.00 1.80 1.74 0.97 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 165 L 8.34 4.13 0.00 1.74 1.77 0.90 0.19 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 0.00 166 K 7.80 3.79 0.00 1.85 1.98 0.00 1.75 0.00 0.00 1.67 0.00 0.00 3.19 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.62 1.48 7.81 *168 A 7.91 4.25 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 0.00 169 T 7.55 4.50 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 1.25 0.00 0.00 170 E 7.85 4.13 0.00 1.98 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 2.36 2.52 0.00 * Residues marked with a * may have inaccurate shift predictions.