NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 I 4.1346 8.0249 121.4528 60.1198 38.7790 175.1933 6 P 4.0356 0.0000 0.0000 62.5237 31.6101 176.4390 7 K 3.9714 8.7321 125.5410 57.5030 32.5653 174.4523 8 I 3.9551 7.5747 109.1735 62.5819 38.0373 175.8955 9 I 3.9827 7.4121 123.4923 59.9885 37.3421 174.7126 10 P 4.5558 0.0000 0.0000 61.6389 33.5795 175.1731 11 P 4.2385 0.0000 0.0000 66.0753 31.2368 178.5126 12 E 3.9575 8.1302 117.3676 59.2171 29.5295 178.4969 13 L 4.0212 7.8648 119.9905 57.7455 42.2486 178.4191 14 L 3.9364 8.0176 120.5590 57.9534 42.0103 178.8293 15 K 3.9080 8.1584 119.5205 59.4979 31.9139 178.7692 16 V 4.0488 7.5601 118.4787 65.6971 31.5621 177.7229 17 L 4.2933 8.0275 117.4152 58.0239 41.4858 179.0538 18 C 4.3807 7.9550 116.3067 61.7352 29.5767 175.1723 19 E 4.2512 8.2096 121.4417 55.5667 26.6967 175.4601 *21 G 3.6432 7.7304 113.3073 45.9043 0.0000 168.5135 22 H 4.3572 8.4187 119.1376 57.9550 29.7841 175.8146 23 G 3.9160 9.0720 116.8699 45.0762 0.0000 173.3290 24 D 4.5977 7.9186 119.7308 54.6201 42.0953 175.5198 25 Q 5.4584 8.7501 119.5032 54.0875 32.7460 174.3863 26 L 5.2705 8.8553 121.4790 53.9607 44.5822 175.1530 27 V 4.6134 8.5098 120.0106 61.1971 34.1600 174.5707 28 I 4.3160 8.8309 129.7079 60.3722 37.9883 174.5426 29 A 4.5542 8.8133 130.9760 50.4490 20.5726 176.7034 30 D 4.8547 9.5097 123.1581 52.6255 40.8501 177.8413 31 G 3.7001 9.0309 108.0628 48.1678 0.0000 174.4743 32 N 4.6184 7.8805 115.6311 53.6371 39.1049 175.2858 33 F 4.4128 7.9951 121.5710 57.1961 40.5883 174.2130 34 P 4.4361 0.0000 0.0000 61.5256 29.9032 176.4910 35 A 4.3456 8.0331 128.2216 56.1721 19.2829 180.2361 36 E 3.9998 8.2147 114.5191 59.4115 29.7390 179.2358 37 S 4.2484 7.8672 113.8804 61.4848 63.4858 176.4056 38 I 3.8353 7.9308 123.8152 63.4888 36.6800 177.5359 39 G 4.0483 8.3049 110.1589 46.0211 0.0000 176.3303 40 K 3.8866 7.7232 124.4722 56.8933 31.6733 180.9700 41 N 4.8221 8.0993 113.0171 52.8446 38.6539 173.4363 42 A 4.7265 7.7906 120.4593 50.0642 22.9263 175.8085 43 I 4.0424 7.9083 119.0716 60.5284 38.4589 175.7044 44 V 4.6581 8.3369 127.6242 61.2676 32.9997 174.7457 45 V 4.3470 8.4942 128.6157 61.2166 33.3701 175.7571 46 R 4.5536 8.4854 126.9217 56.0653 31.1740 176.0290 *48 D 4.5881 8.6811 118.3969 54.0915 43.3678 177.4831 49 G 3.9304 8.1318 103.1039 46.2803 0.0000 173.4332 50 H 5.0895 8.0107 117.4557 53.4345 32.1246 173.7571 51 G 4.4568 8.4140 109.2414 43.4907 0.0000 175.3111 52 G 4.1923 8.7599 108.7525 47.2023 0.0000 176.3679 53 G 3.7994 8.2687 107.8314 47.6320 0.0000 175.2117 54 E 3.9723 8.2043 121.6493 58.9120 29.6438 178.8067 55 I 3.6393 7.7568 119.8410 64.2639 37.1278 178.1607 56 L 3.7745 8.1038 121.4404 57.8657 41.6536 178.7330 57 K 3.8577 8.1490 118.5844 59.5435 32.2738 178.2724 58 A 4.1224 7.8620 120.5505 55.2233 18.3428 179.5848 59 I 3.5891 7.9458 118.6681 64.6422 36.9836 178.7597 60 L 4.0749 7.8996 118.4789 57.5156 41.3926 179.3328 61 T 4.1367 7.5832 109.2823 63.7569 68.7767 175.3308 62 V 4.3140 7.7157 111.6281 60.5145 33.0589 175.0647 63 F 4.6291 7.9609 121.7659 55.2855 40.9788 172.0384 64 P 4.5041 0.0000 0.0000 62.5481 32.4910 175.5790 65 L 4.7571 8.4596 123.4897 54.0157 42.7674 176.2027 66 D 4.5743 8.6601 123.8980 54.9746 41.2888 176.2392 67 T 4.4140 8.9180 114.8713 62.3109 69.6375 174.8084 68 Y 4.2407 8.6545 119.3899 58.8845 38.3888 175.4932 69 V 4.6456 7.4011 112.0995 59.2425 35.5123 175.4380 70 D 4.5339 8.6522 121.5209 56.7126 40.9836 175.9539 71 K 4.8011 7.5798 117.8487 53.7324 32.5265 173.7956 72 P 4.6081 0.0000 0.0000 63.6306 32.9788 175.7642 73 A 5.2538 8.1474 123.5923 50.5298 21.9030 175.4568 74 T 4.9898 8.8239 118.0364 60.7329 72.4730 172.3692 75 L 4.9961 8.8059 124.7341 54.7985 43.3702 178.5827 *77 E 4.3481 8.8330 126.1122 56.6890 30.3258 174.7352 78 K 2.9578 8.4978 122.3316 55.8505 32.9872 177.5799 79 V 3.8391 8.3218 116.3284 60.5513 32.1394 174.2803 80 P 4.3976 0.0000 0.0000 64.5501 31.5067 177.0620 81 G 3.8711 8.9969 110.6001 45.2297 0.0000 172.4536 82 D 4.6945 7.9639 119.9344 53.2558 41.3749 175.6578 83 T 4.4475 8.3354 116.0083 60.9513 69.2513 174.8905 84 V 3.5418 7.3814 120.8617 62.3155 31.5946 176.0783 85 A 4.0767 8.2092 125.2970 52.3530 19.7753 177.2838 86 T 4.2880 7.4248 107.2181 58.9367 68.4704 173.5873 87 P 4.4841 0.0000 0.0000 65.6927 31.6563 178.0657 88 I 3.5001 7.5196 118.3389 63.6446 37.8160 177.4944 89 W 4.3264 8.0269 120.0749 59.8408 28.7441 178.1324 90 D 4.4628 8.1434 118.9836 57.0081 40.3170 178.6995 91 V 3.7244 7.7728 118.3650 66.4552 31.4421 177.5394 92 Y 4.4317 8.2901 116.3387 61.1378 37.6389 178.3410 93 A 4.1906 8.4192 121.8588 55.2773 17.9788 179.8854 94 G 3.6158 8.2738 104.0959 48.0244 0.0000 175.9680 95 L 4.1305 7.8418 120.4296 57.5790 41.9262 179.3644 96 I 3.9215 8.1495 120.0861 64.2270 36.5552 178.2453 97 K 4.1602 8.4031 120.7251 59.7501 31.7194 178.5741 98 E 4.1325 7.9044 117.0011 58.7312 29.3419 177.3579 99 H 4.7409 7.5548 114.9650 55.7166 31.3417 174.0687 100 D 4.9114 8.5264 119.1076 52.0423 43.4024 176.2806 101 E 4.1402 8.9076 125.7739 59.0381 30.1409 178.5060 102 R 4.0438 8.5803 118.5166 57.0788 31.5828 178.2350 103 G 3.7975 7.8001 105.5472 46.2569 0.0000 177.2367 104 A 4.0391 8.8227 129.8946 55.4188 18.2282 179.9608 105 D 4.5075 7.9223 112.9728 55.0892 40.1561 181.1265 106 A 4.6071 7.9394 119.0802 52.5975 19.2020 176.5738 107 I 4.6037 7.5735 118.0018 59.6797 38.2740 175.3867 108 G 4.4267 9.0005 115.3707 45.0243 0.0000 171.7689 109 S 5.2973 8.2487 112.2300 57.2058 65.8875 173.6229 110 L 4.9310 8.6842 120.4257 52.5704 45.4287 176.4373 111 E 4.1086 8.9651 122.8665 56.3621 30.5899 177.2772 112 R 3.6215 8.9516 125.0596 60.1031 29.9309 178.8540 113 F 4.1909 8.6803 116.3044 60.2884 39.0460 177.5202 114 A 4.1408 8.6874 120.7328 54.9731 18.0479 179.4875 115 F 3.9529 8.6164 119.7208 61.6126 39.4819 176.8555 116 Y 4.6460 8.0635 116.4030 61.4808 37.4842 178.6591 117 E 4.0730 8.2253 118.1567 59.5236 29.8788 178.9678 118 Q 4.0482 8.2683 119.3826 59.0793 29.1248 178.0119 119 A 3.9459 8.2876 122.1564 54.9714 18.1948 179.5997 120 K 4.2750 7.9548 117.3838 58.3473 32.1621 178.0882 121 N 4.6826 7.8785 114.5702 52.2951 39.2879 175.2561 122 A 4.2950 7.2973 124.2346 52.1393 19.3493 177.2564 123 Y 4.3126 8.9642 122.9647 60.5279 40.1431 175.3905 124 C 5.0979 7.9616 117.9401 57.7416 35.6723 172.7415 125 V 4.6779 8.8752 125.6547 61.2075 33.9934 174.1104 126 I 4.6294 9.0753 129.5581 59.8666 38.5985 175.1916 127 A 4.6847 8.7761 131.4564 51.0894 18.0226 177.0401 128 S 4.4083 8.8249 116.7766 58.2783 65.0210 174.3213 129 G 4.5699 8.3760 104.4819 45.1267 0.0000 173.6206 130 E 4.1155 8.3631 122.9159 56.2521 29.8010 177.9352 131 S 4.2079 8.6841 120.7225 60.0017 63.9386 174.6637 132 A 4.0488 8.1054 124.6341 52.0712 18.5511 177.3749 133 Q 4.0562 8.4462 121.1577 56.6956 29.5220 175.0743 134 Y 3.6450 7.7355 114.4018 59.6230 35.5415 170.9009 135 A 4.9597 8.4303 117.4605 52.0318 19.9321 178.0653 136 N 4.7993 8.1363 115.0166 54.4203 39.8289 174.7537 137 L 4.8697 8.8634 124.0738 53.9734 45.9762 174.5631 138 I 4.6758 8.9645 127.8948 60.2463 39.0918 174.7118 139 L 5.1758 8.9732 126.4564 52.9337 45.1597 175.0303 140 Q 5.0806 8.9527 124.8703 54.1771 31.4722 174.4080 141 K 3.8997 9.2490 128.7961 56.3529 33.4266 176.5581 142 G 3.8874 8.0595 115.6191 45.2606 0.0000 172.9049 143 V 3.6283 7.8652 119.7197 61.5022 32.5248 176.8165 144 V 3.9342 7.6637 125.8731 61.3749 31.4928 175.7924 145 F 4.3503 8.6869 125.2675 57.8328 38.8589 175.6790 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 5 I 8.02 4.13 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 1.43 1.08 0.92 0.00 0.00 6 P 0.00 4.04 0.00 2.24 2.00 0.00 3.62 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.14 0.00 7 K 8.73 3.97 0.00 1.77 1.75 0.00 1.80 0.00 0.00 1.76 0.00 0.00 2.98 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.37 1.02 7.81 8 I 7.57 3.96 1.64 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 1.35 0.93 0.86 0.00 0.00 9 I 7.41 3.98 1.87 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 0.51 0.91 0.00 0.00 10 P 0.00 4.56 0.00 2.27 2.18 0.00 3.71 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.05 0.00 11 P 0.00 4.24 0.00 2.18 2.17 0.00 3.61 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.17 0.00 12 E 8.13 3.96 0.00 2.03 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 2.38 2.37 0.00 13 L 7.86 4.02 0.00 1.79 1.78 0.91 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 14 L 8.02 3.94 0.00 1.82 1.83 0.94 0.16 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 15 K 8.16 3.91 0.00 1.90 2.01 0.00 1.72 0.00 0.00 1.60 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.59 1.48 7.81 16 V 7.56 4.05 2.31 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 1.25 0.00 0.00 1.03 0.00 0.00 17 L 8.03 4.29 0.00 1.84 1.87 0.94 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 18 C 7.95 4.38 0.00 3.15 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 19 E 8.21 4.25 0.00 2.16 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 2.64 2.26 0.00 *21 G 7.73 3.64 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 0.00 22 H 8.42 4.36 0.00 2.84 3.03 0.00 5.72 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 23 G 9.07 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 24 D 7.92 4.60 0.00 2.72 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 25 Q 8.75 5.46 0.00 1.98 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.77 0.00 0.00 0.00 0.00 0.00 2.34 2.47 0.00 26 L 8.86 5.27 0.00 1.74 1.72 0.66 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 27 V 8.51 4.61 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.84 0.00 0.00 28 I 8.83 4.32 1.71 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.32 0.84 0.00 0.00 29 A 8.81 4.55 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 30 D 9.51 4.85 0.00 2.96 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 31 G 9.03 3.70 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 N 7.88 4.62 0.00 2.77 2.85 0.00 0.00 6.94 7.62 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 33 F 8.00 4.41 0.00 3.35 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 34 P 0.00 4.44 0.00 1.91 1.90 0.00 2.33 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 1.22 0.00 35 A 8.03 4.35 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.21 4.00 0.00 1.94 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 2.33 2.31 0.00 37 S 7.87 4.25 0.00 3.96 4.04 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 38 I 7.93 3.84 2.10 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.95 1.16 0.00 0.00 39 G 8.30 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 40 K 7.72 3.89 0.00 1.74 1.75 0.00 1.79 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.39 1.29 7.81 41 N 8.10 4.82 0.00 2.69 2.83 0.00 0.00 6.61 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 42 A 7.79 4.73 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 43 I 7.91 4.04 1.62 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.38 0.87 0.00 0.00 44 V 8.34 4.66 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 0.84 0.00 0.00 0.96 0.00 0.00 45 V 8.49 4.35 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 0.98 0.00 0.00 0.92 0.00 0.00 46 R 8.49 4.55 0.00 1.75 2.10 0.00 3.47 0.00 0.00 3.38 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.61 0.00 *48 D 8.68 4.59 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 49 G 8.13 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 50 H 8.01 5.09 0.00 3.17 3.16 0.00 5.61 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 G 8.41 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 0.00 0.00 0.00 0.00 52 G 8.76 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 53 G 8.27 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 0.00 0.00 0.00 54 E 8.20 3.97 0.00 2.09 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 2.36 2.42 0.00 55 I 7.76 3.64 1.84 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 1.37 0.66 0.83 0.00 0.00 56 L 8.10 3.77 0.00 1.50 1.76 0.72 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 57 K 8.15 3.86 0.00 1.88 2.01 0.00 1.90 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.52 7.81 58 A 7.86 4.12 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 59 I 7.95 3.59 1.70 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.73 0.48 0.00 0.00 60 L 7.90 4.07 0.00 1.45 1.33 0.93 1.06 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 61 T 7.58 4.14 4.28 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 1.37 0.00 0.00 62 V 7.72 4.31 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 0.72 0.00 0.00 1.06 0.00 0.00 63 F 7.96 4.63 0.00 2.88 2.96 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 64 P 0.00 4.50 0.00 2.05 2.11 0.00 3.27 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 1.76 1.83 0.00 65 L 8.46 4.76 0.00 1.61 1.69 0.97 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 66 D 8.66 4.57 0.00 2.96 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 67 T 8.92 4.41 4.27 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 1.31 0.00 0.00 68 Y 8.65 4.24 0.00 3.20 3.13 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 0.00 69 V 7.40 4.65 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 0.79 0.00 0.00 0.98 0.00 0.00 70 D 8.65 4.53 0.00 2.71 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 71 K 7.58 4.80 0.00 1.69 1.78 0.00 1.74 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.51 1.39 7.81 72 P 0.00 4.61 0.00 2.17 2.49 0.00 3.86 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.12 0.00 73 A 8.15 5.25 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 74 T 8.82 4.99 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 1.27 0.00 0.00 75 L 8.81 5.00 0.00 1.09 0.24 -0.02 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 *77 E 8.83 4.35 0.00 1.88 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 2.18 2.40 0.00 78 K 8.50 2.96 0.00 1.52 1.36 0.00 1.54 0.00 0.00 1.30 0.00 0.00 2.69 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.30 1.15 7.81 79 V 8.32 3.84 2.20 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 0.92 0.00 0.00 1.07 0.00 0.00 80 P 0.00 4.40 0.00 2.07 2.03 0.00 3.77 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.13 0.00 81 G 9.00 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 82 D 7.96 4.69 0.00 2.74 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 83 T 8.34 4.45 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 1.19 0.00 0.00 84 V 7.38 3.54 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 0.87 0.00 0.00 0.92 0.00 0.00 85 A 8.21 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 T 7.42 4.29 2.69 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 0.00 0.00 0.48 0.00 0.00 87 P 0.00 4.48 0.00 2.20 2.27 0.00 3.76 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.79 0.00 88 I 7.52 3.50 1.69 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.37 0.78 0.00 0.00 89 W 8.03 4.33 0.00 3.47 3.13 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 0.00 90 D 8.14 4.46 0.00 2.88 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 91 V 7.77 3.72 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 1.15 0.00 0.00 0.90 0.00 0.00 92 Y 8.29 4.43 0.00 3.22 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 93 A 8.42 4.19 1.45 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 0.00 0.00 0.00 94 G 8.27 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 0.00 0.00 0.00 95 L 7.84 4.13 0.00 1.91 1.81 1.09 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 96 I 8.15 3.92 1.92 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 0.76 0.95 0.00 0.00 97 K 8.40 4.16 0.00 1.98 2.01 0.00 1.54 0.00 0.00 1.67 0.00 0.00 3.04 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.56 7.81 98 E 7.90 4.13 0.00 2.20 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 2.34 2.49 0.00 99 H 7.55 4.74 0.00 3.32 3.36 0.00 5.60 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 D 8.53 4.91 0.00 2.71 2.50 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 0.00 101 E 8.91 4.14 0.00 2.00 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 2.28 0.00 102 R 8.58 4.04 0.00 2.05 2.00 0.00 3.29 0.00 0.00 3.18 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.59 0.00 103 G 7.80 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 0.00 0.00 0.00 104 A 8.82 4.04 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 0.00 105 D 7.92 4.51 0.00 2.75 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 0.00 106 A 7.94 4.61 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 0.00 107 I 7.57 4.60 1.95 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 1.24 0.66 0.81 0.00 0.00 108 G 9.00 4.43 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 0.00 109 S 8.25 5.30 0.00 3.69 3.60 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 0.00 110 L 8.68 4.93 0.00 1.74 1.68 0.92 0.87 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 0.00 111 E 8.97 4.11 0.00 2.02 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 2.47 2.34 0.00 112 R 8.95 3.62 0.00 1.85 1.88 0.00 3.14 0.00 0.00 3.22 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 1.03 0.00 113 F 8.68 4.19 0.00 3.42 3.25 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 0.00 114 A 8.69 4.14 1.45 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 0.00 0.00 0.00 115 F 8.62 3.95 0.00 3.18 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 0.00 116 Y 8.06 4.65 0.00 3.31 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 0.00 117 E 8.23 4.07 0.00 2.21 2.08 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 2.68 2.56 0.00 118 Q 8.27 4.05 0.00 2.11 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.22 2.36 0.00 119 A 8.29 3.95 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 0.00 0.00 0.00 0.00 0.00 120 K 7.95 4.27 0.00 2.00 1.93 0.00 1.71 0.00 0.00 1.58 0.00 0.00 3.01 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.51 1.63 7.81 121 N 7.88 4.68 0.00 2.85 2.86 0.00 0.00 6.94 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 0.00 122 A 7.30 4.29 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 0.00 123 Y 8.96 4.31 0.00 3.11 3.12 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 0.00 124 C 7.96 5.10 0.00 2.96 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 0.00 125 V 8.88 4.68 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 1.09 0.00 0.00 0.98 0.00 0.00 126 I 9.08 4.63 1.89 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.51 0.88 0.00 0.00 127 A 8.78 4.68 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 0.00 128 S 8.82 4.41 0.00 4.11 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 0.00 129 G 8.38 4.57 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 0.00 0.00 0.00 130 E 8.36 4.12 0.00 2.20 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 2.41 2.35 0.00 131 S 8.68 4.21 0.00 4.01 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 0.00 132 A 8.11 4.05 1.25 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 0.00 0.00 0.00 133 Q 8.45 4.06 0.00 2.04 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.80 0.00 0.00 0.00 0.00 0.00 2.16 2.29 0.00 134 Y 7.74 3.65 0.00 3.25 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 0.00 135 A 8.43 4.96 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 0.00 136 N 8.14 4.80 0.00 2.20 2.59 0.00 0.00 6.77 7.85 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 0.00 137 L 8.86 4.87 0.00 1.58 1.24 0.92 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 138 I 8.96 4.68 1.75 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.08 0.84 0.00 0.00 139 L 8.97 5.18 0.00 1.32 1.60 0.60 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 140 Q 8.95 5.08 0.00 2.14 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 7.02 0.00 0.00 0.00 0.00 0.00 2.27 2.48 0.00 141 K 9.25 3.90 0.00 1.45 1.59 0.00 1.32 0.00 0.00 1.42 0.00 0.00 2.60 0.00 0.00 2.57 0.00 0.00 0.00 0.00 1.00 0.33 7.81 142 G 8.06 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 0.00 143 V 7.87 3.63 1.08 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 -0.31 0.00 0.00 0.15 0.00 0.00 144 V 7.66 3.93 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 0.84 0.00 0.00 0.81 0.00 0.00 145 F 8.69 4.35 0.00 3.07 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 * Residues marked with a * may have inaccurate shift predictions.